1 VAL 37 N 0.0135 0.0323 0.0125 2 VAL 37 CA 0.0143 0.0307 0.0119 3 VAL 37 C 0.0116 0.0294 0.0118 4 VAL 37 O 0.0114 0.0287 0.0116 5 VAL 37 CB 0.0160 0.0325 0.0123 6 VAL 37 CG1 0.0190 0.0330 0.0122 7 VAL 37 CG2 0.0146 0.0353 0.0132 8 LEU 38 N 0.0095 0.0290 0.0118 9 LEU 38 CA 0.0068 0.0278 0.0117 10 LEU 38 C 0.0070 0.0248 0.0108 11 LEU 38 O 0.0059 0.0239 0.0106 12 LEU 38 CB 0.0046 0.0282 0.0120 13 LEU 38 CG 0.0027 0.0308 0.0129 14 LEU 38 CD1 0.0005 0.0309 0.0132 15 LEU 38 CD2 0.0045 0.0335 0.0136 16 TYR 39 N 0.0084 0.0232 0.0103 17 TYR 39 CA 0.0090 0.0203 0.0094 18 TYR 39 C 0.0062 0.0186 0.0091 19 TYR 39 O 0.0057 0.0173 0.0088 20 TYR 39 CB 0.0111 0.0198 0.0090 21 TYR 39 CG 0.0141 0.0209 0.0091 22 TYR 39 CD1 0.0160 0.0194 0.0085 23 TYR 39 CD2 0.0150 0.0234 0.0097 24 TYR 39 CE1 0.0187 0.0203 0.0085 25 TYR 39 CE2 0.0178 0.0243 0.0098 26 TYR 39 CZ 0.0196 0.0228 0.0092 27 TYR 39 OH 0.0224 0.0237 0.0092 28 VAL 40 N 0.0045 0.0186 0.0092 29 VAL 40 CA 0.0018 0.0169 0.0090 30 VAL 40 C 0.0025 0.0139 0.0080 31 VAL 40 O 0.0012 0.0121 0.0076 32 VAL 40 CB -0.0002 0.0179 0.0094 33 VAL 40 CG1 -0.0030 0.0162 0.0091 34 VAL 40 CG2 -0.0009 0.0209 0.0104 35 GLY 41 N 0.0058 0.0118 0.0070 36 GLY 41 CA 0.0065 0.0098 0.0061 37 GLY 41 C 0.0087 0.0094 0.0060 38 GLY 41 O 0.0099 0.0084 0.0056 39 SER 42 N 0.0093 0.0102 0.0064 40 SER 42 CA 0.0115 0.0104 0.0065 41 SER 42 C 0.0125 0.0084 0.0057 42 SER 42 O 0.0143 0.0081 0.0056 43 SER 42 CB 0.0117 0.0116 0.0070 44 SER 42 OG 0.0138 0.0117 0.0072 45 LYS 43 N 0.0113 0.0071 0.0051 46 LYS 43 CA 0.0119 0.0051 0.0042 47 LYS 43 C 0.0100 0.0039 0.0037 48 LYS 43 O 0.0090 0.0042 0.0037 49 LYS 43 CB 0.0136 0.0046 0.0040 50 LYS 43 CG 0.0144 0.0026 0.0032 51 LYS 43 CD 0.0161 0.0021 0.0030 52 LYS 43 CE 0.0170 0.0002 0.0022 53 LYS 43 NZ 0.0155 -0.0014 0.0015 54 THR 44 N 0.0093 0.0027 0.0031 55 THR 44 CA 0.0077 0.0014 0.0025 56 THR 44 C 0.0085 -0.0006 0.0016 57 THR 44 O 0.0100 -0.0009 0.0015 58 THR 44 CB 0.0058 0.0018 0.0026 59 THR 44 OG1 0.0064 0.0015 0.0025 60 THR 44 CG2 0.0050 0.0038 0.0035 61 LYS 45 N 0.0065 -0.0017 0.0011 62 LYS 45 CA 0.0066 -0.0018 0.0006 63 LYS 45 C 0.0063 -0.0019 0.0004 64 LYS 45 O 0.0059 -0.0020 0.0002 65 LYS 45 CB 0.0067 -0.0019 0.0004 66 LYS 45 CG 0.0069 -0.0020 -0.0001 67 LYS 45 CD 0.0069 -0.0020 -0.0002 68 LYS 45 CE 0.0071 -0.0021 -0.0007 69 LYS 45 NZ 0.0072 -0.0021 -0.0008 70 GLU 46 N 0.0064 -0.0019 0.0003 71 GLU 46 CA 0.0061 -0.0020 0.0001 72 GLU 46 C 0.0063 -0.0020 -0.0003 73 GLU 46 O 0.0066 -0.0020 -0.0002 74 GLU 46 CB 0.0059 -0.0019 0.0005 75 GLU 46 CG 0.0063 -0.0018 0.0009 76 GLU 46 CD 0.0061 -0.0017 0.0013 77 GLU 46 OE1 0.0056 -0.0017 0.0014 78 GLU 46 OE2 0.0063 -0.0016 0.0016 79 GLY 47 N 0.0060 -0.0022 -0.0007 80 GLY 47 CA 0.0062 -0.0022 -0.0011 81 GLY 47 C 0.0065 -0.0023 -0.0014 82 GLY 47 O 0.0069 -0.0023 -0.0015 83 VAL 48 N 0.0064 -0.0023 -0.0014 84 VAL 48 CA 0.0068 -0.0023 -0.0016 85 VAL 48 C 0.0066 -0.0024 -0.0021 86 VAL 48 O 0.0062 -0.0025 -0.0021 87 VAL 48 CB 0.0069 -0.0022 -0.0013 88 VAL 48 CG1 0.0073 -0.0022 -0.0015 89 VAL 48 CG2 0.0071 -0.0021 -0.0009 90 VAL 49 N 0.0051 -0.0022 -0.0029 91 VAL 49 CA 0.0048 -0.0020 -0.0033 92 VAL 49 C 0.0046 -0.0017 -0.0037 93 VAL 49 O 0.0049 -0.0014 -0.0037 94 VAL 49 CB 0.0051 -0.0016 -0.0034 95 VAL 49 CG1 0.0048 -0.0013 -0.0039 96 VAL 49 CG2 0.0052 -0.0019 -0.0030 97 HIS 50 N 0.0041 -0.0019 -0.0041 98 HIS 50 CA 0.0039 -0.0016 -0.0045 99 HIS 50 C 0.0034 -0.0016 -0.0049 100 HIS 50 O 0.0031 -0.0020 -0.0050 101 HIS 50 CB 0.0038 -0.0019 -0.0043 102 HIS 50 CG 0.0034 -0.0025 -0.0042 103 HIS 50 ND1 0.0029 -0.0026 -0.0046 104 HIS 50 CD2 0.0034 -0.0029 -0.0038 105 HIS 50 CE1 0.0026 -0.0031 -0.0044 106 HIS 50 NE2 0.0029 -0.0033 -0.0039 107 GLY 51 N 0.0034 -0.0011 -0.0053 108 GLY 51 CA 0.0030 -0.0010 -0.0058 109 GLY 51 C 0.0030 -0.0009 -0.0059 110 GLY 51 O 0.0026 -0.0012 -0.0060 111 VAL 52 N 0.0033 -0.0004 -0.0060 112 VAL 52 CA 0.0034 -0.0002 -0.0061 113 VAL 52 C 0.0034 0.0003 -0.0065 114 VAL 52 O 0.0036 0.0007 -0.0066 115 VAL 52 CB 0.0039 -0.0002 -0.0056 116 VAL 52 CG1 0.0039 0.0000 -0.0058 117 VAL 52 CG2 0.0039 -0.0008 -0.0052 118 ALA 53 N 0.0015 -0.0008 -0.0066 119 ALA 53 CA 0.0015 -0.0006 -0.0066 120 ALA 53 C 0.0016 -0.0003 -0.0068 121 ALA 53 O 0.0016 -0.0002 -0.0068 122 ALA 53 CB 0.0012 -0.0005 -0.0064 123 THR 54 N 0.0017 -0.0002 -0.0069 124 THR 54 CA 0.0019 0.0000 -0.0071 125 THR 54 C 0.0018 0.0002 -0.0071 126 THR 54 O 0.0019 0.0001 -0.0071 127 THR 54 CB 0.0022 -0.0001 -0.0072 128 THR 54 OG1 0.0022 -0.0002 -0.0072 129 THR 54 CG2 0.0023 0.0002 -0.0074 130 VAL 55 N 0.0018 0.0005 -0.0071 131 VAL 55 CA 0.0018 0.0007 -0.0072 132 VAL 55 C 0.0019 0.0010 -0.0074 133 VAL 55 O 0.0019 0.0011 -0.0074 134 VAL 55 CB 0.0015 0.0009 -0.0070 135 VAL 55 CG1 0.0015 0.0011 -0.0071 136 VAL 55 CG2 0.0013 0.0007 -0.0068 137 ALA 56 N 0.0021 0.0010 -0.0075 138 ALA 56 CA 0.0023 0.0013 -0.0077 139 ALA 56 C 0.0023 0.0014 -0.0077 140 ALA 56 O 0.0024 0.0013 -0.0077 141 ALA 56 CB 0.0026 0.0011 -0.0078 142 GLU 57 N 0.0029 0.0021 -0.0070 143 GLU 57 CA 0.0029 0.0030 -0.0075 144 GLU 57 C 0.0036 0.0037 -0.0080 145 GLU 57 O 0.0032 0.0041 -0.0081 146 GLU 57 CB 0.0018 0.0035 -0.0074 147 GLU 57 CG 0.0011 0.0029 -0.0069 148 GLU 57 CD -0.0000 0.0035 -0.0069 149 GLU 57 OE1 -0.0003 0.0043 -0.0072 150 GLU 57 OE2 -0.0006 0.0031 -0.0065 151 LYS 58 N 0.0045 0.0038 -0.0084 152 LYS 58 CA 0.0053 0.0044 -0.0089 153 LYS 58 C 0.0057 0.0052 -0.0094 154 LYS 58 O 0.0063 0.0049 -0.0095 155 LYS 58 CB 0.0063 0.0036 -0.0088 156 LYS 58 CG 0.0060 0.0029 -0.0084 157 LYS 58 CD 0.0070 0.0022 -0.0083 158 LYS 58 CE 0.0067 0.0015 -0.0079 159 LYS 58 NZ 0.0077 0.0008 -0.0079 160 THR 59 N 0.0053 0.0061 -0.0097 161 THR 59 CA 0.0056 0.0070 -0.0102 162 THR 59 C 0.0068 0.0071 -0.0107 163 THR 59 O 0.0072 0.0074 -0.0109 164 THR 59 CB 0.0048 0.0079 -0.0105 165 THR 59 OG1 0.0037 0.0078 -0.0101 166 THR 59 CG2 0.0050 0.0088 -0.0109 167 LYS 60 N 0.0073 0.0069 -0.0107 168 LYS 60 CA 0.0084 0.0070 -0.0111 169 LYS 60 C 0.0089 0.0063 -0.0109 170 LYS 60 O 0.0086 0.0064 -0.0109 171 LYS 60 CB 0.0086 0.0081 -0.0117 172 LYS 60 CG 0.0098 0.0082 -0.0121 173 LYS 60 CD 0.0100 0.0093 -0.0127 174 LYS 60 CE 0.0112 0.0095 -0.0131 175 LYS 60 NZ 0.0113 0.0106 -0.0137 176 GLU 61 N 0.0098 0.0068 -0.0102 177 GLU 61 CA 0.0101 0.0063 -0.0096 178 GLU 61 C 0.0110 0.0065 -0.0096 179 GLU 61 O 0.0117 0.0067 -0.0095 180 GLU 61 CB 0.0100 0.0058 -0.0089 181 GLU 61 CG 0.0103 0.0053 -0.0082 182 GLU 61 CD 0.0102 0.0048 -0.0076 183 GLU 61 OE1 0.0100 0.0048 -0.0077 184 GLU 61 OE2 0.0104 0.0043 -0.0069 185 GLN 62 N 0.0110 0.0066 -0.0096 186 GLN 62 CA 0.0119 0.0068 -0.0096 187 GLN 62 C 0.0120 0.0063 -0.0090 188 GLN 62 O 0.0115 0.0061 -0.0089 189 GLN 62 CB 0.0118 0.0074 -0.0103 190 GLN 62 CG 0.0127 0.0076 -0.0104 191 GLN 62 CD 0.0126 0.0082 -0.0112 192 GLN 62 OE1 0.0119 0.0084 -0.0116 193 GLN 62 NE2 0.0133 0.0085 -0.0113 194 VAL 63 N 0.0128 0.0061 -0.0085 195 VAL 63 CA 0.0131 0.0057 -0.0079 196 VAL 63 C 0.0140 0.0059 -0.0080 197 VAL 63 O 0.0147 0.0059 -0.0078 198 VAL 63 CB 0.0130 0.0051 -0.0072 199 VAL 63 CG1 0.0133 0.0046 -0.0066 200 VAL 63 CG2 0.0121 0.0048 -0.0071 201 THR 64 N 0.0141 0.0062 -0.0082 202 THR 64 CA 0.0150 0.0064 -0.0083 203 THR 64 C 0.0151 0.0061 -0.0079 204 THR 64 O 0.0146 0.0063 -0.0082 205 THR 64 CB 0.0151 0.0071 -0.0091 206 THR 64 OG1 0.0145 0.0072 -0.0094 207 THR 64 CG2 0.0148 0.0074 -0.0096 208 ASN 65 N 0.0154 0.0070 -0.0071 209 ASN 65 CA 0.0152 0.0067 -0.0065 210 ASN 65 C 0.0158 0.0070 -0.0063 211 ASN 65 O 0.0165 0.0074 -0.0065 212 ASN 65 CB 0.0149 0.0064 -0.0057 213 ASN 65 CG 0.0156 0.0065 -0.0050 214 ASN 65 OD1 0.0163 0.0068 -0.0049 215 ASN 65 ND2 0.0154 0.0062 -0.0045 216 VAL 66 N 0.0156 0.0068 -0.0060 217 VAL 66 CA 0.0162 0.0070 -0.0056 218 VAL 66 C 0.0160 0.0066 -0.0047 219 VAL 66 O 0.0153 0.0062 -0.0045 220 VAL 66 CB 0.0162 0.0071 -0.0062 221 VAL 66 CG1 0.0162 0.0074 -0.0071 222 VAL 66 CG2 0.0156 0.0068 -0.0060 223 GLY 67 N 0.0166 0.0068 -0.0041 224 GLY 67 CA 0.0166 0.0065 -0.0032 225 GLY 67 C 0.0162 0.0061 -0.0027 226 GLY 67 O 0.0161 0.0059 -0.0019 227 GLY 68 N 0.0159 0.0061 -0.0031 228 GLY 68 CA 0.0153 0.0057 -0.0027 229 GLY 68 C 0.0156 0.0059 -0.0027 230 GLY 68 O 0.0162 0.0063 -0.0031 231 ALA 69 N 0.0151 0.0059 -0.0023 232 ALA 69 CA 0.0150 0.0058 -0.0023 233 ALA 69 C 0.0142 0.0054 -0.0027 234 ALA 69 O 0.0138 0.0048 -0.0024 235 ALA 69 CB 0.0154 0.0054 -0.0016 236 VAL 70 N 0.0139 0.0058 -0.0033 237 VAL 70 CA 0.0131 0.0056 -0.0038 238 VAL 70 C 0.0130 0.0055 -0.0038 239 VAL 70 O 0.0134 0.0060 -0.0039 240 VAL 70 CB 0.0129 0.0061 -0.0046 241 VAL 70 CG1 0.0121 0.0059 -0.0050 242 VAL 70 CG2 0.0129 0.0061 -0.0045 243 VAL 71 N 0.0124 0.0049 -0.0037 244 VAL 71 CA 0.0122 0.0047 -0.0038 245 VAL 71 C 0.0114 0.0047 -0.0044 246 VAL 71 O 0.0108 0.0043 -0.0045 247 VAL 71 CB 0.0121 0.0040 -0.0031 248 VAL 71 CG1 0.0118 0.0039 -0.0032 249 VAL 71 CG2 0.0129 0.0041 -0.0024 250 THR 72 N 0.0113 0.0052 -0.0049 251 THR 72 CA 0.0106 0.0052 -0.0056 252 THR 72 C 0.0103 0.0051 -0.0057 253 THR 72 O 0.0107 0.0055 -0.0057 254 THR 72 CB 0.0107 0.0059 -0.0063 255 THR 72 OG1 0.0112 0.0065 -0.0063 256 THR 72 CG2 0.0109 0.0061 -0.0062 257 GLY 73 N 0.0086 0.0039 -0.0055 258 GLY 73 CA 0.0081 0.0038 -0.0057 259 GLY 73 C 0.0082 0.0035 -0.0054 260 GLY 73 O 0.0082 0.0038 -0.0056 261 VAL 74 N 0.0083 0.0028 -0.0050 262 VAL 74 CA 0.0083 0.0025 -0.0047 263 VAL 74 C 0.0075 0.0021 -0.0048 264 VAL 74 O 0.0070 0.0020 -0.0049 265 VAL 74 CB 0.0089 0.0020 -0.0041 266 VAL 74 CG1 0.0096 0.0023 -0.0041 267 VAL 74 CG2 0.0085 0.0013 -0.0038 268 THR 75 N 0.0074 0.0020 -0.0047 269 THR 75 CA 0.0067 0.0017 -0.0049 270 THR 75 C 0.0067 0.0012 -0.0045 271 THR 75 O 0.0072 0.0014 -0.0044 272 THR 75 CB 0.0063 0.0022 -0.0054 273 THR 75 OG1 0.0063 0.0027 -0.0057 274 THR 75 CG2 0.0055 0.0020 -0.0056 275 ALA 76 N 0.0062 0.0006 -0.0043 276 ALA 76 CA 0.0061 0.0002 -0.0041 277 ALA 76 C 0.0069 -0.0001 -0.0036 278 ALA 76 O 0.0071 -0.0001 -0.0035 279 ALA 76 CB 0.0059 0.0005 -0.0044 280 VAL 77 N 0.0075 0.0005 -0.0034 281 VAL 77 CA 0.0078 0.0005 -0.0030 282 VAL 77 C 0.0077 0.0001 -0.0026 283 VAL 77 O 0.0073 -0.0002 -0.0025 284 VAL 77 CB 0.0080 0.0006 -0.0030 285 VAL 77 CG1 0.0084 0.0006 -0.0025 286 VAL 77 CG2 0.0081 0.0009 -0.0034 287 ALA 78 N 0.0079 0.0001 -0.0023 288 ALA 78 CA 0.0078 -0.0002 -0.0019 289 ALA 78 C 0.0082 -0.0002 -0.0015 290 ALA 78 O 0.0084 -0.0001 -0.0014 291 ALA 78 CB 0.0075 -0.0004 -0.0020 292 GLN 79 N 0.0083 -0.0004 -0.0011 293 GLN 79 CA 0.0086 -0.0004 -0.0007 294 GLN 79 C 0.0084 -0.0008 -0.0003 295 GLN 79 O 0.0080 -0.0010 -0.0004 296 GLN 79 CB 0.0089 -0.0003 -0.0006 297 GLN 79 CG 0.0087 -0.0005 -0.0005 298 GLN 79 CD 0.0090 -0.0003 -0.0004 299 GLN 79 OE1 0.0094 -0.0001 -0.0004 300 GLN 79 NE2 0.0088 -0.0005 -0.0003 301 LYS 80 N 0.0087 -0.0008 0.0001 302 LYS 80 CA 0.0086 -0.0011 0.0005 303 LYS 80 C 0.0090 -0.0011 0.0008 304 LYS 80 O 0.0094 -0.0008 0.0008 305 LYS 80 CB 0.0086 -0.0013 0.0006 306 LYS 80 CG 0.0084 -0.0017 0.0010 307 LYS 80 CD 0.0083 -0.0018 0.0012 308 LYS 80 CE 0.0082 -0.0022 0.0016 309 LYS 80 NZ 0.0081 -0.0023 0.0018 310 THR 81 N 0.0094 -0.0014 0.0012 311 THR 81 CA 0.0099 -0.0014 0.0016 312 THR 81 C 0.0098 -0.0019 0.0021 313 THR 81 O 0.0094 -0.0022 0.0021 314 THR 81 CB 0.0101 -0.0012 0.0014 315 THR 81 OG1 0.0101 -0.0008 0.0009 316 THR 81 CG2 0.0106 -0.0012 0.0017 317 VAL 82 N 0.0102 -0.0020 0.0024 318 VAL 82 CA 0.0103 -0.0025 0.0029 319 VAL 82 C 0.0108 -0.0024 0.0032 320 VAL 82 O 0.0113 -0.0022 0.0032 321 VAL 82 CB 0.0103 -0.0027 0.0032 322 VAL 82 CG1 0.0104 -0.0031 0.0037 323 VAL 82 CG2 0.0098 -0.0027 0.0030 324 GLU 83 N 0.0106 -0.0026 0.0034 325 GLU 83 CA 0.0111 -0.0026 0.0036 326 GLU 83 C 0.0114 -0.0022 0.0033 327 GLU 83 O 0.0119 -0.0020 0.0034 328 GLU 83 CB 0.0115 -0.0029 0.0041 329 GLU 83 CG 0.0112 -0.0033 0.0044 330 GLU 83 CD 0.0116 -0.0036 0.0049 331 GLU 83 OE1 0.0121 -0.0033 0.0050 332 GLU 83 OE2 0.0114 -0.0040 0.0053 333 GLY 84 N 0.0111 -0.0020 0.0029 334 GLY 84 CA 0.0113 -0.0016 0.0026 335 GLY 84 C 0.0109 -0.0015 0.0022 336 GLY 84 O 0.0104 -0.0017 0.0021 337 ALA 85 N 0.0112 -0.0014 0.0018 338 ALA 85 CA 0.0109 -0.0013 0.0015 339 ALA 85 C 0.0108 -0.0008 0.0011 340 ALA 85 O 0.0111 -0.0005 0.0011 341 ALA 85 CB 0.0112 -0.0012 0.0017 342 GLY 86 N 0.0103 -0.0008 0.0008 343 GLY 86 CA 0.0102 -0.0004 0.0004 344 GLY 86 C 0.0099 -0.0002 0.0002 345 GLY 86 O 0.0095 -0.0005 0.0000 346 SER 87 N 0.0102 0.0002 0.0000 347 SER 87 CA 0.0100 0.0004 -0.0003 348 SER 87 C 0.0099 0.0009 -0.0006 349 SER 87 O 0.0102 0.0012 -0.0007 350 SER 87 CB 0.0103 0.0006 -0.0001 351 SER 87 OG 0.0104 0.0002 0.0002 352 ILE 88 N 0.0094 0.0008 -0.0009 353 ILE 88 CA 0.0093 0.0012 -0.0013 354 ILE 88 C 0.0094 0.0016 -0.0015 355 ILE 88 O 0.0096 0.0020 -0.0016 356 ILE 88 CB 0.0087 0.0010 -0.0015 357 ILE 88 CG1 0.0087 0.0006 -0.0012 358 ILE 88 CG2 0.0086 0.0014 -0.0019 359 ILE 88 CD1 0.0082 0.0003 -0.0014 360 ALA 89 N 0.0096 0.0028 -0.0017 361 ALA 89 CA 0.0097 0.0035 -0.0022 362 ALA 89 C 0.0102 0.0032 -0.0015 363 ALA 89 O 0.0097 0.0027 -0.0016 364 ALA 89 CB 0.0089 0.0035 -0.0031 365 ALA 90 N 0.0110 0.0036 -0.0009 366 ALA 90 CA 0.0115 0.0034 -0.0002 367 ALA 90 C 0.0121 0.0043 -0.0004 368 ALA 90 O 0.0123 0.0052 -0.0008 369 ALA 90 CB 0.0122 0.0030 0.0008 370 ALA 91 N 0.0122 0.0042 -0.0001 371 ALA 91 CA 0.0127 0.0050 -0.0003 372 ALA 91 C 0.0131 0.0047 0.0004 373 ALA 91 O 0.0127 0.0040 0.0005 374 ALA 91 CB 0.0120 0.0054 -0.0013 375 THR 92 N 0.0140 0.0052 0.0010 376 THR 92 CA 0.0145 0.0050 0.0017 377 THR 92 C 0.0151 0.0060 0.0015 378 THR 92 O 0.0154 0.0068 0.0011 379 THR 92 CB 0.0152 0.0047 0.0027 380 THR 92 OG1 0.0159 0.0055 0.0027 381 THR 92 CG2 0.0147 0.0038 0.0029 382 GLY 93 N 0.0162 0.0059 0.0012 383 GLY 93 CA 0.0164 0.0058 0.0005 384 GLY 93 C 0.0166 0.0062 0.0015 385 GLY 93 O 0.0173 0.0066 0.0011 386 PHE 94 N 0.0159 0.0061 0.0028 387 PHE 94 CA 0.0159 0.0064 0.0038 388 PHE 94 C 0.0158 0.0067 0.0053 389 PHE 94 O 0.0150 0.0063 0.0057 390 PHE 94 CB 0.0149 0.0058 0.0038 391 PHE 94 CG 0.0150 0.0055 0.0024 392 PHE 94 CD1 0.0157 0.0059 0.0024 393 PHE 94 CD2 0.0145 0.0049 0.0012 394 PHE 94 CE1 0.0158 0.0057 0.0012 395 PHE 94 CE2 0.0146 0.0047 -0.0000 396 PHE 94 CZ 0.0153 0.0051 -0.0000 397 VAL 95 N 0.0166 0.0074 0.0062 398 VAL 95 CA 0.0165 0.0077 0.0078 399 VAL 95 C 0.0166 0.0080 0.0086 400 VAL 95 O 0.0175 0.0085 0.0084 401 VAL 95 CB 0.0175 0.0084 0.0081 402 VAL 95 CG1 0.0174 0.0088 0.0098 403 VAL 95 CG2 0.0173 0.0081 0.0074 404 LYS 96 N 0.0156 0.0076 0.0096 405 LYS 96 CA 0.0155 0.0078 0.0104 406 LYS 96 C 0.0153 0.0081 0.0120 407 LYS 96 O 0.0152 0.0082 0.0125 408 LYS 96 CB 0.0144 0.0071 0.0101 409 LYS 96 CG 0.0146 0.0068 0.0085 410 LYS 96 CD 0.0156 0.0074 0.0083 411 LYS 96 CE 0.0158 0.0071 0.0068 412 LYS 96 NZ 0.0147 0.0064 0.0065 413 LYS 97 N 0.0143 0.0094 0.0133 414 LYS 97 CA 0.0128 0.0130 0.0151 415 LYS 97 C 0.0087 0.0126 0.0157 416 LYS 97 O 0.0078 0.0102 0.0148 417 LYS 97 CB 0.0156 0.0156 0.0158 418 LYS 97 CG 0.0145 0.0195 0.0177 419 LYS 97 CD 0.0150 0.0214 0.0185 420 LYS 97 CE 0.0138 0.0253 0.0205 421 LYS 97 NZ 0.0165 0.0276 0.0210 422 ASP 98 N 0.0062 0.0149 0.0172 423 ASP 98 CA 0.0022 0.0151 0.0180 424 ASP 98 C 0.0015 0.0191 0.0200 425 ASP 98 O 0.0041 0.0215 0.0206 426 ASP 98 CB -0.0008 0.0129 0.0176 427 ASP 98 CG -0.0047 0.0119 0.0179 428 ASP 98 OD1 -0.0052 0.0130 0.0185 429 ASP 98 OD2 -0.0074 0.0100 0.0176 430 GLN 99 N -0.0021 0.0199 0.0210 431 GLN 99 CA -0.0032 0.0237 0.0229 432 GLN 99 C -0.0035 0.0256 0.0238 433 GLN 99 O -0.0018 0.0286 0.0248 434 GLN 99 CB -0.0072 0.0237 0.0236 435 GLN 99 CG -0.0085 0.0275 0.0256 436 GLN 99 CD -0.0124 0.0274 0.0263 437 GLN 99 OE1 -0.0142 0.0245 0.0253 438 GLN 99 NE2 -0.0137 0.0307 0.0280 439 VAL 37 N 0.0116 0.0315 0.0123 440 VAL 37 CA 0.0123 0.0299 0.0118 441 VAL 37 C 0.0096 0.0286 0.0117 442 VAL 37 O 0.0094 0.0279 0.0115 443 VAL 37 CB 0.0140 0.0316 0.0121 444 VAL 37 CG1 0.0170 0.0321 0.0120 445 VAL 37 CG2 0.0127 0.0344 0.0131 446 LEU 38 N 0.0076 0.0283 0.0118 447 LEU 38 CA 0.0049 0.0271 0.0117 448 LEU 38 C 0.0050 0.0241 0.0108 449 LEU 38 O 0.0040 0.0232 0.0106 450 LEU 38 CB 0.0027 0.0276 0.0120 451 LEU 38 CG 0.0010 0.0301 0.0129 452 LEU 38 CD1 -0.0012 0.0302 0.0132 453 LEU 38 CD2 0.0027 0.0327 0.0135 454 TYR 39 N 0.0064 0.0226 0.0102 455 TYR 39 CA 0.0070 0.0197 0.0093 456 TYR 39 C 0.0042 0.0180 0.0090 457 TYR 39 O 0.0037 0.0168 0.0087 458 TYR 39 CB 0.0090 0.0192 0.0089 459 TYR 39 CG 0.0120 0.0202 0.0090 460 TYR 39 CD1 0.0138 0.0187 0.0083 461 TYR 39 CD2 0.0129 0.0226 0.0096 462 TYR 39 CE1 0.0166 0.0196 0.0084 463 TYR 39 CE2 0.0157 0.0235 0.0096 464 TYR 39 CZ 0.0175 0.0220 0.0090 465 TYR 39 OH 0.0202 0.0230 0.0090 466 VAL 40 N 0.0025 0.0180 0.0092 467 VAL 40 CA -0.0001 0.0164 0.0090 468 VAL 40 C 0.0005 0.0134 0.0080 469 VAL 40 O -0.0008 0.0117 0.0076 470 VAL 40 CB -0.0021 0.0174 0.0095 471 VAL 40 CG1 -0.0048 0.0158 0.0092 472 VAL 40 CG2 -0.0027 0.0204 0.0104 473 GLY 41 N 0.0038 0.0116 0.0073 474 GLY 41 CA 0.0044 0.0096 0.0064 475 GLY 41 C 0.0066 0.0093 0.0061 476 GLY 41 O 0.0078 0.0085 0.0057 477 SER 42 N 0.0072 0.0100 0.0064 478 SER 42 CA 0.0094 0.0101 0.0063 479 SER 42 C 0.0104 0.0082 0.0053 480 SER 42 O 0.0121 0.0079 0.0051 481 SER 42 CB 0.0096 0.0111 0.0067 482 SER 42 OG 0.0117 0.0113 0.0066 483 LYS 43 N 0.0092 0.0067 0.0048 484 LYS 43 CA 0.0098 0.0048 0.0039 485 LYS 43 C 0.0078 0.0035 0.0035 486 LYS 43 O 0.0069 0.0036 0.0036 487 LYS 43 CB 0.0114 0.0042 0.0036 488 LYS 43 CG 0.0122 0.0022 0.0026 489 LYS 43 CD 0.0139 0.0017 0.0023 490 LYS 43 CE 0.0148 -0.0002 0.0014 491 LYS 43 NZ 0.0133 -0.0018 0.0008 492 THR 44 N 0.0072 0.0024 0.0031 493 THR 44 CA 0.0055 0.0010 0.0026 494 THR 44 C 0.0063 -0.0009 0.0017 495 THR 44 O 0.0078 -0.0010 0.0015 496 THR 44 CB 0.0036 0.0015 0.0029 497 THR 44 OG1 0.0042 0.0014 0.0028 498 THR 44 CG2 0.0029 0.0035 0.0038 499 LYS 45 N 0.0049 -0.0021 0.0009 500 LYS 45 CA 0.0050 -0.0022 0.0004 501 LYS 45 C 0.0046 -0.0023 0.0002 502 LYS 45 O 0.0042 -0.0025 0.0000 503 LYS 45 CB 0.0051 -0.0022 0.0000 504 LYS 45 CG 0.0053 -0.0023 -0.0006 505 LYS 45 CD 0.0054 -0.0023 -0.0009 506 LYS 45 CE 0.0056 -0.0024 -0.0014 507 LYS 45 NZ 0.0057 -0.0024 -0.0018 508 GLU 46 N 0.0048 -0.0023 0.0002 509 GLU 46 CA 0.0044 -0.0024 0.0002 510 GLU 46 C 0.0046 -0.0025 -0.0002 511 GLU 46 O 0.0050 -0.0023 -0.0001 512 GLU 46 CB 0.0042 -0.0024 0.0007 513 GLU 46 CG 0.0046 -0.0021 0.0011 514 GLU 46 CD 0.0044 -0.0021 0.0017 515 GLU 46 OE1 0.0039 -0.0022 0.0018 516 GLU 46 OE2 0.0046 -0.0019 0.0021 517 GLY 47 N 0.0043 -0.0026 -0.0006 518 GLY 47 CA 0.0045 -0.0027 -0.0010 519 GLY 47 C 0.0049 -0.0027 -0.0014 520 GLY 47 O 0.0053 -0.0026 -0.0016 521 VAL 48 N 0.0048 -0.0027 -0.0016 522 VAL 48 CA 0.0052 -0.0027 -0.0020 523 VAL 48 C 0.0050 -0.0029 -0.0025 524 VAL 48 O 0.0045 -0.0031 -0.0026 525 VAL 48 CB 0.0053 -0.0026 -0.0017 526 VAL 48 CG1 0.0057 -0.0025 -0.0021 527 VAL 48 CG2 0.0055 -0.0024 -0.0012 528 VAL 49 N 0.0041 -0.0026 -0.0032 529 VAL 49 CA 0.0039 -0.0024 -0.0037 530 VAL 49 C 0.0037 -0.0021 -0.0040 531 VAL 49 O 0.0040 -0.0018 -0.0041 532 VAL 49 CB 0.0041 -0.0020 -0.0038 533 VAL 49 CG1 0.0039 -0.0017 -0.0043 534 VAL 49 CG2 0.0042 -0.0023 -0.0035 535 HIS 50 N 0.0032 -0.0023 -0.0043 536 HIS 50 CA 0.0030 -0.0020 -0.0047 537 HIS 50 C 0.0026 -0.0020 -0.0051 538 HIS 50 O 0.0022 -0.0023 -0.0052 539 HIS 50 CB 0.0030 -0.0023 -0.0045 540 HIS 50 CG 0.0026 -0.0028 -0.0044 541 HIS 50 ND1 0.0021 -0.0029 -0.0048 542 HIS 50 CD2 0.0026 -0.0032 -0.0040 543 HIS 50 CE1 0.0019 -0.0034 -0.0046 544 HIS 50 NE2 0.0021 -0.0036 -0.0041 545 GLY 51 N 0.0026 -0.0016 -0.0055 546 GLY 51 CA 0.0022 -0.0015 -0.0060 547 GLY 51 C 0.0022 -0.0013 -0.0061 548 GLY 51 O 0.0018 -0.0016 -0.0062 549 VAL 52 N 0.0025 -0.0009 -0.0062 550 VAL 52 CA 0.0026 -0.0007 -0.0063 551 VAL 52 C 0.0026 -0.0002 -0.0067 552 VAL 52 O 0.0028 0.0001 -0.0068 553 VAL 52 CB 0.0030 -0.0007 -0.0059 554 VAL 52 CG1 0.0031 -0.0005 -0.0060 555 VAL 52 CG2 0.0030 -0.0012 -0.0055 556 ALA 53 N 0.0013 -0.0007 -0.0068 557 ALA 53 CA 0.0012 -0.0004 -0.0069 558 ALA 53 C 0.0014 -0.0001 -0.0070 559 ALA 53 O 0.0015 -0.0001 -0.0070 560 ALA 53 CB 0.0009 -0.0003 -0.0068 561 THR 54 N 0.0015 0.0000 -0.0070 562 THR 54 CA 0.0017 0.0003 -0.0071 563 THR 54 C 0.0017 0.0005 -0.0071 564 THR 54 O 0.0017 0.0005 -0.0071 565 THR 54 CB 0.0021 0.0002 -0.0072 566 THR 54 OG1 0.0021 -0.0001 -0.0071 567 THR 54 CG2 0.0023 0.0004 -0.0073 568 VAL 55 N 0.0016 0.0008 -0.0072 569 VAL 55 CA 0.0016 0.0011 -0.0072 570 VAL 55 C 0.0018 0.0013 -0.0073 571 VAL 55 O 0.0019 0.0014 -0.0073 572 VAL 55 CB 0.0013 0.0012 -0.0071 573 VAL 55 CG1 0.0013 0.0016 -0.0072 574 VAL 55 CG2 0.0011 0.0010 -0.0070 575 ALA 56 N 0.0020 0.0015 -0.0074 576 ALA 56 CA 0.0023 0.0017 -0.0074 577 ALA 56 C 0.0022 0.0019 -0.0075 578 ALA 56 O 0.0023 0.0019 -0.0075 579 ALA 56 CB 0.0026 0.0015 -0.0075 580 GLU 57 N 0.0023 0.0025 -0.0072 581 GLU 57 CA 0.0024 0.0032 -0.0077 582 GLU 57 C 0.0029 0.0037 -0.0082 583 GLU 57 O 0.0025 0.0041 -0.0083 584 GLU 57 CB 0.0015 0.0036 -0.0077 585 GLU 57 CG 0.0010 0.0032 -0.0073 586 GLU 57 CD 0.0001 0.0036 -0.0072 587 GLU 57 OE1 -0.0002 0.0042 -0.0075 588 GLU 57 OE2 -0.0003 0.0034 -0.0069 589 LYS 58 N 0.0037 0.0038 -0.0085 590 LYS 58 CA 0.0042 0.0042 -0.0089 591 LYS 58 C 0.0046 0.0049 -0.0094 592 LYS 58 O 0.0051 0.0047 -0.0094 593 LYS 58 CB 0.0050 0.0037 -0.0088 594 LYS 58 CG 0.0047 0.0031 -0.0083 595 LYS 58 CD 0.0055 0.0026 -0.0083 596 LYS 58 CE 0.0052 0.0020 -0.0078 597 LYS 58 NZ 0.0060 0.0015 -0.0077 598 THR 59 N 0.0043 0.0056 -0.0097 599 THR 59 CA 0.0045 0.0063 -0.0102 600 THR 59 C 0.0055 0.0064 -0.0106 601 THR 59 O 0.0059 0.0065 -0.0108 602 THR 59 CB 0.0039 0.0070 -0.0105 603 THR 59 OG1 0.0030 0.0069 -0.0101 604 THR 59 CG2 0.0040 0.0077 -0.0109 605 LYS 60 N 0.0058 0.0062 -0.0106 606 LYS 60 CA 0.0067 0.0062 -0.0109 607 LYS 60 C 0.0070 0.0057 -0.0106 608 LYS 60 O 0.0067 0.0058 -0.0106 609 LYS 60 CB 0.0069 0.0071 -0.0114 610 LYS 60 CG 0.0078 0.0072 -0.0118 611 LYS 60 CD 0.0079 0.0080 -0.0123 612 LYS 60 CE 0.0089 0.0081 -0.0127 613 LYS 60 NZ 0.0090 0.0090 -0.0132 614 GLU 61 N 0.0078 0.0058 -0.0103 615 GLU 61 CA 0.0080 0.0054 -0.0097 616 GLU 61 C 0.0088 0.0056 -0.0096 617 GLU 61 O 0.0094 0.0058 -0.0096 618 GLU 61 CB 0.0080 0.0050 -0.0091 619 GLU 61 CG 0.0082 0.0045 -0.0085 620 GLU 61 CD 0.0082 0.0041 -0.0079 621 GLU 61 OE1 0.0080 0.0042 -0.0081 622 GLU 61 OE2 0.0083 0.0037 -0.0073 623 GLN 62 N 0.0088 0.0056 -0.0096 624 GLN 62 CA 0.0096 0.0058 -0.0095 625 GLN 62 C 0.0097 0.0053 -0.0089 626 GLN 62 O 0.0092 0.0051 -0.0088 627 GLN 62 CB 0.0095 0.0062 -0.0102 628 GLN 62 CG 0.0102 0.0065 -0.0102 629 GLN 62 CD 0.0102 0.0070 -0.0108 630 GLN 62 OE1 0.0096 0.0071 -0.0113 631 GLN 62 NE2 0.0108 0.0072 -0.0109 632 VAL 63 N 0.0103 0.0052 -0.0085 633 VAL 63 CA 0.0106 0.0048 -0.0079 634 VAL 63 C 0.0114 0.0051 -0.0079 635 VAL 63 O 0.0120 0.0051 -0.0077 636 VAL 63 CB 0.0105 0.0043 -0.0073 637 VAL 63 CG1 0.0108 0.0039 -0.0066 638 VAL 63 CG2 0.0097 0.0041 -0.0073 639 THR 64 N 0.0114 0.0052 -0.0080 640 THR 64 CA 0.0122 0.0055 -0.0081 641 THR 64 C 0.0122 0.0052 -0.0077 642 THR 64 O 0.0119 0.0052 -0.0079 643 THR 64 CB 0.0123 0.0061 -0.0088 644 THR 64 OG1 0.0117 0.0061 -0.0090 645 THR 64 CG2 0.0121 0.0064 -0.0092 646 ASN 65 N 0.0126 0.0056 -0.0069 647 ASN 65 CA 0.0123 0.0053 -0.0063 648 ASN 65 C 0.0130 0.0056 -0.0061 649 ASN 65 O 0.0137 0.0060 -0.0062 650 ASN 65 CB 0.0121 0.0050 -0.0055 651 ASN 65 CG 0.0127 0.0051 -0.0048 652 ASN 65 OD1 0.0134 0.0054 -0.0047 653 ASN 65 ND2 0.0125 0.0048 -0.0043 654 VAL 66 N 0.0128 0.0054 -0.0058 655 VAL 66 CA 0.0134 0.0056 -0.0054 656 VAL 66 C 0.0132 0.0052 -0.0045 657 VAL 66 O 0.0125 0.0048 -0.0043 658 VAL 66 CB 0.0134 0.0058 -0.0059 659 VAL 66 CG1 0.0134 0.0060 -0.0069 660 VAL 66 CG2 0.0128 0.0054 -0.0057 661 GLY 67 N 0.0138 0.0054 -0.0039 662 GLY 67 CA 0.0137 0.0051 -0.0030 663 GLY 67 C 0.0133 0.0047 -0.0025 664 GLY 67 O 0.0133 0.0045 -0.0017 665 GLY 68 N 0.0130 0.0047 -0.0029 666 GLY 68 CA 0.0125 0.0043 -0.0025 667 GLY 68 C 0.0128 0.0045 -0.0025 668 GLY 68 O 0.0134 0.0049 -0.0029 669 ALA 69 N 0.0124 0.0044 -0.0022 670 ALA 69 CA 0.0123 0.0043 -0.0022 671 ALA 69 C 0.0116 0.0040 -0.0026 672 ALA 69 O 0.0111 0.0034 -0.0023 673 ALA 69 CB 0.0127 0.0040 -0.0015 674 VAL 70 N 0.0114 0.0044 -0.0032 675 VAL 70 CA 0.0107 0.0041 -0.0037 676 VAL 70 C 0.0106 0.0041 -0.0037 677 VAL 70 O 0.0110 0.0046 -0.0038 678 VAL 70 CB 0.0104 0.0046 -0.0044 679 VAL 70 CG1 0.0097 0.0044 -0.0049 680 VAL 70 CG2 0.0104 0.0045 -0.0044 681 VAL 71 N 0.0101 0.0036 -0.0035 682 VAL 71 CA 0.0099 0.0035 -0.0036 683 VAL 71 C 0.0092 0.0034 -0.0043 684 VAL 71 O 0.0086 0.0030 -0.0043 685 VAL 71 CB 0.0098 0.0028 -0.0029 686 VAL 71 CG1 0.0095 0.0027 -0.0030 687 VAL 71 CG2 0.0105 0.0029 -0.0023 688 THR 72 N 0.0092 0.0038 -0.0048 689 THR 72 CA 0.0086 0.0038 -0.0054 690 THR 72 C 0.0083 0.0037 -0.0055 691 THR 72 O 0.0088 0.0041 -0.0056 692 THR 72 CB 0.0087 0.0045 -0.0061 693 THR 72 OG1 0.0092 0.0050 -0.0062 694 THR 72 CG2 0.0088 0.0046 -0.0061 695 GLY 73 N 0.0071 0.0028 -0.0055 696 GLY 73 CA 0.0066 0.0027 -0.0057 697 GLY 73 C 0.0067 0.0024 -0.0055 698 GLY 73 O 0.0068 0.0028 -0.0057 699 VAL 74 N 0.0068 0.0018 -0.0050 700 VAL 74 CA 0.0069 0.0015 -0.0047 701 VAL 74 C 0.0061 0.0012 -0.0049 702 VAL 74 O 0.0056 0.0010 -0.0050 703 VAL 74 CB 0.0073 0.0011 -0.0042 704 VAL 74 CG1 0.0080 0.0014 -0.0040 705 VAL 74 CG2 0.0070 0.0004 -0.0039 706 THR 75 N 0.0060 0.0011 -0.0049 707 THR 75 CA 0.0053 0.0008 -0.0051 708 THR 75 C 0.0053 0.0004 -0.0047 709 THR 75 O 0.0058 0.0006 -0.0046 710 THR 75 CB 0.0049 0.0014 -0.0056 711 THR 75 OG1 0.0049 0.0017 -0.0059 712 THR 75 CG2 0.0042 0.0011 -0.0058 713 ALA 76 N 0.0049 -0.0002 -0.0046 714 ALA 76 CA 0.0048 -0.0006 -0.0043 715 ALA 76 C 0.0054 -0.0008 -0.0038 716 ALA 76 O 0.0057 -0.0008 -0.0037 717 ALA 76 CB 0.0045 -0.0003 -0.0047 718 VAL 77 N 0.0060 -0.0004 -0.0037 719 VAL 77 CA 0.0064 -0.0003 -0.0032 720 VAL 77 C 0.0062 -0.0007 -0.0028 721 VAL 77 O 0.0058 -0.0010 -0.0028 722 VAL 77 CB 0.0065 -0.0003 -0.0032 723 VAL 77 CG1 0.0069 -0.0002 -0.0028 724 VAL 77 CG2 0.0067 0.0001 -0.0037 725 ALA 78 N 0.0065 -0.0007 -0.0025 726 ALA 78 CA 0.0063 -0.0010 -0.0021 727 ALA 78 C 0.0067 -0.0010 -0.0016 728 ALA 78 O 0.0070 -0.0008 -0.0016 729 ALA 78 CB 0.0061 -0.0011 -0.0022 730 GLN 79 N 0.0068 -0.0012 -0.0012 731 GLN 79 CA 0.0071 -0.0012 -0.0008 732 GLN 79 C 0.0069 -0.0015 -0.0004 733 GLN 79 O 0.0065 -0.0018 -0.0004 734 GLN 79 CB 0.0074 -0.0010 -0.0007 735 GLN 79 CG 0.0072 -0.0013 -0.0006 736 GLN 79 CD 0.0075 -0.0011 -0.0005 737 GLN 79 OE1 0.0079 -0.0008 -0.0005 738 GLN 79 NE2 0.0073 -0.0013 -0.0003 739 LYS 80 N 0.0072 -0.0016 0.0000 740 LYS 80 CA 0.0071 -0.0019 0.0005 741 LYS 80 C 0.0075 -0.0018 0.0009 742 LYS 80 O 0.0079 -0.0015 0.0009 743 LYS 80 CB 0.0071 -0.0020 0.0007 744 LYS 80 CG 0.0069 -0.0024 0.0011 745 LYS 80 CD 0.0068 -0.0025 0.0013 746 LYS 80 CE 0.0066 -0.0029 0.0017 747 LYS 80 NZ 0.0066 -0.0030 0.0020 748 THR 81 N 0.0079 -0.0021 0.0013 749 THR 81 CA 0.0084 -0.0022 0.0017 750 THR 81 C 0.0083 -0.0026 0.0022 751 THR 81 O 0.0078 -0.0029 0.0022 752 THR 81 CB 0.0085 -0.0020 0.0015 753 THR 81 OG1 0.0086 -0.0016 0.0010 754 THR 81 CG2 0.0090 -0.0020 0.0018 755 VAL 82 N 0.0086 -0.0027 0.0025 756 VAL 82 CA 0.0087 -0.0031 0.0030 757 VAL 82 C 0.0091 -0.0031 0.0032 758 VAL 82 O 0.0096 -0.0029 0.0032 759 VAL 82 CB 0.0087 -0.0033 0.0033 760 VAL 82 CG1 0.0088 -0.0037 0.0038 761 VAL 82 CG2 0.0082 -0.0034 0.0031 762 GLU 83 N 0.0090 -0.0033 0.0034 763 GLU 83 CA 0.0094 -0.0033 0.0037 764 GLU 83 C 0.0097 -0.0029 0.0033 765 GLU 83 O 0.0102 -0.0027 0.0034 766 GLU 83 CB 0.0098 -0.0035 0.0042 767 GLU 83 CG 0.0095 -0.0040 0.0045 768 GLU 83 CD 0.0099 -0.0042 0.0050 769 GLU 83 OE1 0.0104 -0.0040 0.0050 770 GLU 83 OE2 0.0097 -0.0045 0.0054 771 GLY 84 N 0.0094 -0.0027 0.0030 772 GLY 84 CA 0.0097 -0.0024 0.0026 773 GLY 84 C 0.0092 -0.0022 0.0022 774 GLY 84 O 0.0087 -0.0024 0.0022 775 ALA 85 N 0.0095 -0.0021 0.0020 776 ALA 85 CA 0.0093 -0.0020 0.0017 777 ALA 85 C 0.0092 -0.0015 0.0013 778 ALA 85 O 0.0095 -0.0012 0.0013 779 ALA 85 CB 0.0095 -0.0019 0.0019 780 GLY 86 N 0.0087 -0.0016 0.0010 781 GLY 86 CA 0.0086 -0.0012 0.0006 782 GLY 86 C 0.0084 -0.0010 0.0003 783 GLY 86 O 0.0080 -0.0013 0.0002 784 SER 87 N 0.0086 -0.0006 0.0002 785 SER 87 CA 0.0084 -0.0004 -0.0001 786 SER 87 C 0.0083 -0.0000 -0.0005 787 SER 87 O 0.0087 0.0004 -0.0005 788 SER 87 CB 0.0088 -0.0003 0.0001 789 SER 87 OG 0.0088 -0.0007 0.0004 790 ILE 88 N 0.0079 -0.0001 -0.0008 791 ILE 88 CA 0.0078 0.0003 -0.0011 792 ILE 88 C 0.0079 0.0007 -0.0014 793 ILE 88 O 0.0081 0.0011 -0.0014 794 ILE 88 CB 0.0073 0.0001 -0.0014 795 ILE 88 CG1 0.0073 -0.0003 -0.0011 796 ILE 88 CG2 0.0071 0.0005 -0.0018 797 ILE 88 CD1 0.0068 -0.0005 -0.0013 798 ALA 89 N 0.0079 0.0015 -0.0015 799 ALA 89 CA 0.0080 0.0021 -0.0020 800 ALA 89 C 0.0083 0.0018 -0.0013 801 ALA 89 O 0.0079 0.0013 -0.0014 802 ALA 89 CB 0.0073 0.0021 -0.0029 803 ALA 90 N 0.0091 0.0022 -0.0007 804 ALA 90 CA 0.0094 0.0019 -0.0000 805 ALA 90 C 0.0099 0.0027 -0.0002 806 ALA 90 O 0.0102 0.0035 -0.0006 807 ALA 90 CB 0.0099 0.0016 0.0009 808 ALA 91 N 0.0100 0.0026 0.0001 809 ALA 91 CA 0.0104 0.0033 -0.0001 810 ALA 91 C 0.0107 0.0030 0.0006 811 ALA 91 O 0.0102 0.0023 0.0007 812 ALA 91 CB 0.0098 0.0035 -0.0011 813 THR 92 N 0.0114 0.0034 0.0011 814 THR 92 CA 0.0118 0.0032 0.0018 815 THR 92 C 0.0123 0.0040 0.0016 816 THR 92 O 0.0126 0.0048 0.0012 817 THR 92 CB 0.0124 0.0030 0.0027 818 THR 92 OG1 0.0130 0.0038 0.0028 819 THR 92 CG2 0.0120 0.0023 0.0029 820 GLY 93 N 0.0126 0.0038 0.0015 821 GLY 93 CA 0.0128 0.0037 0.0009 822 GLY 93 C 0.0129 0.0041 0.0019 823 GLY 93 O 0.0135 0.0044 0.0016 824 PHE 94 N 0.0122 0.0041 0.0031 825 PHE 94 CA 0.0122 0.0044 0.0042 826 PHE 94 C 0.0120 0.0047 0.0056 827 PHE 94 O 0.0113 0.0044 0.0059 828 PHE 94 CB 0.0111 0.0037 0.0042 829 PHE 94 CG 0.0112 0.0034 0.0030 830 PHE 94 CD1 0.0118 0.0038 0.0030 831 PHE 94 CD2 0.0108 0.0027 0.0018 832 PHE 94 CE1 0.0119 0.0035 0.0019 833 PHE 94 CE2 0.0109 0.0024 0.0007 834 PHE 94 CZ 0.0115 0.0028 0.0007 835 VAL 95 N 0.0127 0.0054 0.0064 836 VAL 95 CA 0.0126 0.0058 0.0079 837 VAL 95 C 0.0126 0.0061 0.0087 838 VAL 95 O 0.0135 0.0066 0.0085 839 VAL 95 CB 0.0136 0.0065 0.0082 840 VAL 95 CG1 0.0135 0.0070 0.0097 841 VAL 95 CG2 0.0135 0.0063 0.0074 842 LYS 96 N 0.0116 0.0058 0.0097 843 LYS 96 CA 0.0115 0.0060 0.0106 844 LYS 96 C 0.0113 0.0063 0.0120 845 LYS 96 O 0.0112 0.0064 0.0124 846 LYS 96 CB 0.0104 0.0052 0.0103 847 LYS 96 CG 0.0106 0.0049 0.0088 848 LYS 96 CD 0.0115 0.0054 0.0087 849 LYS 96 CE 0.0117 0.0051 0.0073 850 LYS 96 NZ 0.0106 0.0043 0.0070 851 LYS 97 N 0.0092 0.0081 0.0136 852 LYS 97 CA 0.0077 0.0118 0.0155 853 LYS 97 C 0.0034 0.0114 0.0162 854 LYS 97 O 0.0024 0.0090 0.0154 855 LYS 97 CB 0.0104 0.0145 0.0161 856 LYS 97 CG 0.0093 0.0187 0.0180 857 LYS 97 CD 0.0100 0.0206 0.0186 858 LYS 97 CE 0.0088 0.0247 0.0206 859 LYS 97 NZ 0.0115 0.0270 0.0210 860 ASP 98 N 0.0008 0.0138 0.0177 861 ASP 98 CA -0.0033 0.0141 0.0186 862 ASP 98 C -0.0040 0.0183 0.0205 863 ASP 98 O -0.0013 0.0208 0.0210 864 ASP 98 CB -0.0063 0.0118 0.0183 865 ASP 98 CG -0.0104 0.0108 0.0187 866 ASP 98 OD1 -0.0109 0.0120 0.0193 867 ASP 98 OD2 -0.0130 0.0088 0.0184 868 GLN 99 N -0.0076 0.0192 0.0216 869 GLN 99 CA -0.0088 0.0231 0.0234 870 GLN 99 C -0.0089 0.0250 0.0242 871 GLN 99 O -0.0072 0.0281 0.0252 872 GLN 99 CB -0.0129 0.0232 0.0243 873 GLN 99 CG -0.0143 0.0272 0.0262 874 GLN 99 CD -0.0183 0.0271 0.0270 875 GLN 99 OE1 -0.0202 0.0241 0.0261 876 GLN 99 NE2 -0.0197 0.0305 0.0287 877 VAL 37 N 0.0099 0.0306 0.0122 878 VAL 37 CA 0.0107 0.0290 0.0116 879 VAL 37 C 0.0080 0.0277 0.0116 880 VAL 37 O 0.0077 0.0270 0.0114 881 VAL 37 CB 0.0123 0.0306 0.0120 882 VAL 37 CG1 0.0153 0.0311 0.0118 883 VAL 37 CG2 0.0110 0.0333 0.0129 884 LEU 38 N 0.0060 0.0274 0.0117 885 LEU 38 CA 0.0032 0.0263 0.0116 886 LEU 38 C 0.0034 0.0233 0.0107 887 LEU 38 O 0.0023 0.0223 0.0106 888 LEU 38 CB 0.0012 0.0268 0.0120 889 LEU 38 CG -0.0006 0.0293 0.0130 890 LEU 38 CD1 -0.0027 0.0294 0.0132 891 LEU 38 CD2 0.0012 0.0319 0.0135 892 TYR 39 N 0.0047 0.0218 0.0101 893 TYR 39 CA 0.0052 0.0190 0.0092 894 TYR 39 C 0.0025 0.0173 0.0090 895 TYR 39 O 0.0020 0.0160 0.0087 896 TYR 39 CB 0.0072 0.0184 0.0088 897 TYR 39 CG 0.0102 0.0194 0.0088 898 TYR 39 CD1 0.0120 0.0179 0.0082 899 TYR 39 CD2 0.0112 0.0217 0.0094 900 TYR 39 CE1 0.0147 0.0188 0.0082 901 TYR 39 CE2 0.0139 0.0226 0.0094 902 TYR 39 CZ 0.0156 0.0212 0.0088 903 TYR 39 OH 0.0183 0.0221 0.0087 904 VAL 40 N 0.0008 0.0174 0.0092 905 VAL 40 CA -0.0018 0.0158 0.0090 906 VAL 40 C -0.0012 0.0128 0.0081 907 VAL 40 O -0.0025 0.0111 0.0077 908 VAL 40 CB -0.0037 0.0169 0.0096 909 VAL 40 CG1 -0.0064 0.0152 0.0094 910 VAL 40 CG2 -0.0043 0.0198 0.0105 911 GLY 41 N 0.0022 0.0110 0.0073 912 GLY 41 CA 0.0027 0.0091 0.0064 913 GLY 41 C 0.0049 0.0087 0.0061 914 GLY 41 O 0.0060 0.0079 0.0056 915 SER 42 N 0.0055 0.0093 0.0063 916 SER 42 CA 0.0076 0.0094 0.0061 917 SER 42 C 0.0086 0.0075 0.0051 918 SER 42 O 0.0103 0.0073 0.0049 919 SER 42 CB 0.0079 0.0104 0.0065 920 SER 42 OG 0.0099 0.0105 0.0063 921 LYS 43 N 0.0074 0.0061 0.0046 922 LYS 43 CA 0.0079 0.0041 0.0037 923 LYS 43 C 0.0060 0.0029 0.0034 924 LYS 43 O 0.0051 0.0029 0.0035 925 LYS 43 CB 0.0096 0.0035 0.0033 926 LYS 43 CG 0.0103 0.0016 0.0024 927 LYS 43 CD 0.0120 0.0010 0.0019 928 LYS 43 CE 0.0128 -0.0008 0.0010 929 LYS 43 NZ 0.0113 -0.0024 0.0005 930 THR 44 N 0.0054 0.0019 0.0030 931 THR 44 CA 0.0037 0.0005 0.0026 932 THR 44 C 0.0045 -0.0014 0.0017 933 THR 44 O 0.0059 -0.0015 0.0015 934 THR 44 CB 0.0019 0.0010 0.0030 935 THR 44 OG1 0.0025 0.0010 0.0029 936 THR 44 CG2 0.0011 0.0029 0.0039 937 LYS 45 N 0.0035 -0.0024 0.0009 938 LYS 45 CA 0.0037 -0.0025 0.0003 939 LYS 45 C 0.0032 -0.0027 0.0002 940 LYS 45 O 0.0028 -0.0029 0.0000 941 LYS 45 CB 0.0037 -0.0026 -0.0001 942 LYS 45 CG 0.0039 -0.0026 -0.0007 943 LYS 45 CD 0.0040 -0.0027 -0.0011 944 LYS 45 CE 0.0043 -0.0027 -0.0017 945 LYS 45 NZ 0.0044 -0.0028 -0.0020 946 GLU 46 N 0.0034 -0.0026 0.0002 947 GLU 46 CA 0.0030 -0.0028 0.0002 948 GLU 46 C 0.0032 -0.0028 -0.0001 949 GLU 46 O 0.0036 -0.0026 0.0000 950 GLU 46 CB 0.0027 -0.0027 0.0009 951 GLU 46 CG 0.0032 -0.0024 0.0013 952 GLU 46 CD 0.0029 -0.0024 0.0019 953 GLU 46 OE1 0.0024 -0.0025 0.0020 954 GLU 46 OE2 0.0032 -0.0021 0.0023 955 GLY 47 N 0.0029 -0.0030 -0.0006 956 GLY 47 CA 0.0031 -0.0030 -0.0010 957 GLY 47 C 0.0035 -0.0030 -0.0015 958 GLY 47 O 0.0039 -0.0028 -0.0016 959 VAL 48 N 0.0034 -0.0031 -0.0017 960 VAL 48 CA 0.0038 -0.0030 -0.0021 961 VAL 48 C 0.0036 -0.0032 -0.0027 962 VAL 48 O 0.0031 -0.0034 -0.0028 963 VAL 48 CB 0.0040 -0.0029 -0.0019 964 VAL 48 CG1 0.0044 -0.0028 -0.0023 965 VAL 48 CG2 0.0042 -0.0026 -0.0013 966 VAL 49 N 0.0032 -0.0027 -0.0035 967 VAL 49 CA 0.0030 -0.0025 -0.0039 968 VAL 49 C 0.0028 -0.0023 -0.0042 969 VAL 49 O 0.0031 -0.0020 -0.0042 970 VAL 49 CB 0.0032 -0.0022 -0.0040 971 VAL 49 CG1 0.0030 -0.0019 -0.0044 972 VAL 49 CG2 0.0033 -0.0024 -0.0037 973 HIS 50 N 0.0024 -0.0024 -0.0045 974 HIS 50 CA 0.0023 -0.0022 -0.0049 975 HIS 50 C 0.0019 -0.0021 -0.0053 976 HIS 50 O 0.0015 -0.0024 -0.0053 977 HIS 50 CB 0.0022 -0.0024 -0.0047 978 HIS 50 CG 0.0019 -0.0028 -0.0046 979 HIS 50 ND1 0.0015 -0.0029 -0.0049 980 HIS 50 CD2 0.0018 -0.0032 -0.0042 981 HIS 50 CE1 0.0012 -0.0033 -0.0048 982 HIS 50 NE2 0.0014 -0.0035 -0.0043 983 GLY 51 N 0.0019 -0.0018 -0.0056 984 GLY 51 CA 0.0015 -0.0017 -0.0061 985 GLY 51 C 0.0015 -0.0016 -0.0062 986 GLY 51 O 0.0012 -0.0018 -0.0063 987 VAL 52 N 0.0018 -0.0012 -0.0063 988 VAL 52 CA 0.0019 -0.0011 -0.0064 989 VAL 52 C 0.0019 -0.0006 -0.0068 990 VAL 52 O 0.0021 -0.0003 -0.0068 991 VAL 52 CB 0.0022 -0.0011 -0.0060 992 VAL 52 CG1 0.0023 -0.0009 -0.0061 993 VAL 52 CG2 0.0022 -0.0015 -0.0056 994 ALA 53 N 0.0010 -0.0007 -0.0069 995 ALA 53 CA 0.0009 -0.0004 -0.0069 996 ALA 53 C 0.0011 -0.0001 -0.0070 997 ALA 53 O 0.0011 -0.0001 -0.0070 998 ALA 53 CB 0.0006 -0.0003 -0.0069 999 THR 54 N 0.0013 0.0001 -0.0070 1000 THR 54 CA 0.0015 0.0003 -0.0071 1001 THR 54 C 0.0014 0.0006 -0.0072 1002 THR 54 O 0.0015 0.0006 -0.0072 1003 THR 54 CB 0.0018 0.0002 -0.0071 1004 THR 54 OG1 0.0019 -0.0001 -0.0071 1005 THR 54 CG2 0.0020 0.0005 -0.0072 1006 VAL 55 N 0.0014 0.0009 -0.0072 1007 VAL 55 CA 0.0013 0.0012 -0.0073 1008 VAL 55 C 0.0016 0.0014 -0.0073 1009 VAL 55 O 0.0016 0.0014 -0.0073 1010 VAL 55 CB 0.0010 0.0013 -0.0073 1011 VAL 55 CG1 0.0010 0.0017 -0.0073 1012 VAL 55 CG2 0.0008 0.0011 -0.0072 1013 ALA 56 N 0.0018 0.0016 -0.0074 1014 ALA 56 CA 0.0020 0.0018 -0.0075 1015 ALA 56 C 0.0020 0.0021 -0.0075 1016 ALA 56 O 0.0021 0.0021 -0.0075 1017 ALA 56 CB 0.0024 0.0016 -0.0075 1018 GLU 57 N 0.0019 0.0025 -0.0074 1019 GLU 57 CA 0.0019 0.0030 -0.0078 1020 GLU 57 C 0.0022 0.0033 -0.0082 1021 GLU 57 O 0.0019 0.0036 -0.0083 1022 GLU 57 CB 0.0012 0.0033 -0.0078 1023 GLU 57 CG 0.0010 0.0030 -0.0075 1024 GLU 57 CD 0.0003 0.0033 -0.0075 1025 GLU 57 OE1 -0.0000 0.0037 -0.0078 1026 GLU 57 OE2 0.0000 0.0031 -0.0073 1027 LYS 58 N 0.0029 0.0034 -0.0085 1028 LYS 58 CA 0.0033 0.0037 -0.0089 1029 LYS 58 C 0.0036 0.0041 -0.0094 1030 LYS 58 O 0.0041 0.0040 -0.0094 1031 LYS 58 CB 0.0039 0.0033 -0.0087 1032 LYS 58 CG 0.0036 0.0029 -0.0083 1033 LYS 58 CD 0.0042 0.0025 -0.0082 1034 LYS 58 CE 0.0039 0.0021 -0.0078 1035 LYS 58 NZ 0.0044 0.0017 -0.0076 1036 THR 59 N 0.0033 0.0047 -0.0097 1037 THR 59 CA 0.0035 0.0051 -0.0101 1038 THR 59 C 0.0043 0.0052 -0.0104 1039 THR 59 O 0.0047 0.0053 -0.0107 1040 THR 59 CB 0.0030 0.0057 -0.0104 1041 THR 59 OG1 0.0023 0.0056 -0.0101 1042 THR 59 CG2 0.0032 0.0061 -0.0109 1043 LYS 60 N 0.0044 0.0051 -0.0104 1044 LYS 60 CA 0.0051 0.0051 -0.0107 1045 LYS 60 C 0.0053 0.0047 -0.0104 1046 LYS 60 O 0.0050 0.0048 -0.0104 1047 LYS 60 CB 0.0052 0.0057 -0.0112 1048 LYS 60 CG 0.0060 0.0057 -0.0115 1049 LYS 60 CD 0.0060 0.0063 -0.0120 1050 LYS 60 CE 0.0067 0.0064 -0.0123 1051 LYS 60 NZ 0.0068 0.0070 -0.0128 1052 GLU 61 N 0.0060 0.0046 -0.0102 1053 GLU 61 CA 0.0061 0.0043 -0.0096 1054 GLU 61 C 0.0068 0.0045 -0.0095 1055 GLU 61 O 0.0074 0.0047 -0.0095 1056 GLU 61 CB 0.0061 0.0040 -0.0091 1057 GLU 61 CG 0.0062 0.0036 -0.0084 1058 GLU 61 CD 0.0062 0.0033 -0.0079 1059 GLU 61 OE1 0.0061 0.0033 -0.0081 1060 GLU 61 OE2 0.0063 0.0029 -0.0074 1061 GLN 62 N 0.0067 0.0044 -0.0094 1062 GLN 62 CA 0.0073 0.0046 -0.0094 1063 GLN 62 C 0.0074 0.0042 -0.0088 1064 GLN 62 O 0.0069 0.0040 -0.0087 1065 GLN 62 CB 0.0073 0.0049 -0.0099 1066 GLN 62 CG 0.0079 0.0052 -0.0099 1067 GLN 62 CD 0.0078 0.0055 -0.0105 1068 GLN 62 OE1 0.0073 0.0056 -0.0110 1069 GLN 62 NE2 0.0084 0.0057 -0.0106 1070 VAL 63 N 0.0080 0.0041 -0.0083 1071 VAL 63 CA 0.0081 0.0038 -0.0077 1072 VAL 63 C 0.0088 0.0040 -0.0077 1073 VAL 63 O 0.0094 0.0041 -0.0075 1074 VAL 63 CB 0.0081 0.0034 -0.0071 1075 VAL 63 CG1 0.0083 0.0031 -0.0065 1076 VAL 63 CG2 0.0074 0.0032 -0.0072 1077 THR 64 N 0.0088 0.0041 -0.0078 1078 THR 64 CA 0.0095 0.0044 -0.0078 1079 THR 64 C 0.0095 0.0041 -0.0074 1080 THR 64 O 0.0091 0.0041 -0.0076 1081 THR 64 CB 0.0096 0.0048 -0.0085 1082 THR 64 OG1 0.0090 0.0048 -0.0087 1083 THR 64 CG2 0.0094 0.0051 -0.0090 1084 ASN 65 N 0.0098 0.0041 -0.0067 1085 ASN 65 CA 0.0095 0.0038 -0.0061 1086 ASN 65 C 0.0102 0.0040 -0.0058 1087 ASN 65 O 0.0109 0.0045 -0.0060 1088 ASN 65 CB 0.0092 0.0034 -0.0053 1089 ASN 65 CG 0.0099 0.0036 -0.0046 1090 ASN 65 OD1 0.0106 0.0039 -0.0045 1091 ASN 65 ND2 0.0097 0.0033 -0.0041 1092 VAL 66 N 0.0099 0.0038 -0.0055 1093 VAL 66 CA 0.0105 0.0040 -0.0050 1094 VAL 66 C 0.0103 0.0037 -0.0041 1095 VAL 66 O 0.0096 0.0032 -0.0039 1096 VAL 66 CB 0.0106 0.0042 -0.0055 1097 VAL 66 CG1 0.0106 0.0045 -0.0065 1098 VAL 66 CG2 0.0099 0.0038 -0.0053 1099 GLY 67 N 0.0110 0.0038 -0.0035 1100 GLY 67 CA 0.0109 0.0035 -0.0025 1101 GLY 67 C 0.0104 0.0032 -0.0020 1102 GLY 67 O 0.0104 0.0029 -0.0012 1103 GLY 68 N 0.0101 0.0031 -0.0025 1104 GLY 68 CA 0.0096 0.0027 -0.0021 1105 GLY 68 C 0.0099 0.0029 -0.0022 1106 GLY 68 O 0.0105 0.0034 -0.0026 1107 ALA 69 N 0.0097 0.0029 -0.0020 1108 ALA 69 CA 0.0097 0.0029 -0.0020 1109 ALA 69 C 0.0090 0.0026 -0.0024 1110 ALA 69 O 0.0086 0.0020 -0.0021 1111 ALA 69 CB 0.0100 0.0027 -0.0012 1112 VAL 70 N 0.0089 0.0029 -0.0030 1113 VAL 70 CA 0.0083 0.0027 -0.0035 1114 VAL 70 C 0.0083 0.0027 -0.0035 1115 VAL 70 O 0.0087 0.0032 -0.0036 1116 VAL 70 CB 0.0081 0.0030 -0.0043 1117 VAL 70 CG1 0.0074 0.0028 -0.0048 1118 VAL 70 CG2 0.0080 0.0029 -0.0042 1119 VAL 71 N 0.0078 0.0022 -0.0034 1120 VAL 71 CA 0.0077 0.0022 -0.0035 1121 VAL 71 C 0.0071 0.0021 -0.0041 1122 VAL 71 O 0.0065 0.0017 -0.0042 1123 VAL 71 CB 0.0076 0.0017 -0.0028 1124 VAL 71 CG1 0.0074 0.0016 -0.0029 1125 VAL 71 CG2 0.0082 0.0018 -0.0021 1126 THR 72 N 0.0071 0.0025 -0.0047 1127 THR 72 CA 0.0066 0.0025 -0.0053 1128 THR 72 C 0.0065 0.0024 -0.0054 1129 THR 72 O 0.0069 0.0028 -0.0055 1130 THR 72 CB 0.0067 0.0030 -0.0060 1131 THR 72 OG1 0.0073 0.0035 -0.0061 1132 THR 72 CG2 0.0068 0.0030 -0.0060 1133 GLY 73 N 0.0056 0.0017 -0.0055 1134 GLY 73 CA 0.0052 0.0016 -0.0057 1135 GLY 73 C 0.0053 0.0014 -0.0054 1136 GLY 73 O 0.0054 0.0017 -0.0057 1137 VAL 74 N 0.0053 0.0009 -0.0050 1138 VAL 74 CA 0.0054 0.0007 -0.0048 1139 VAL 74 C 0.0048 0.0004 -0.0049 1140 VAL 74 O 0.0043 0.0002 -0.0051 1141 VAL 74 CB 0.0058 0.0003 -0.0042 1142 VAL 74 CG1 0.0064 0.0006 -0.0041 1143 VAL 74 CG2 0.0055 -0.0003 -0.0040 1144 THR 75 N 0.0047 0.0003 -0.0050 1145 THR 75 CA 0.0041 0.0001 -0.0051 1146 THR 75 C 0.0042 -0.0002 -0.0049 1147 THR 75 O 0.0046 0.0000 -0.0048 1148 THR 75 CB 0.0038 0.0006 -0.0057 1149 THR 75 OG1 0.0038 0.0009 -0.0059 1150 THR 75 CG2 0.0032 0.0003 -0.0059 1151 ALA 76 N 0.0037 -0.0007 -0.0047 1152 ALA 76 CA 0.0037 -0.0010 -0.0045 1153 ALA 76 C 0.0042 -0.0012 -0.0040 1154 ALA 76 O 0.0045 -0.0011 -0.0039 1155 ALA 76 CB 0.0035 -0.0007 -0.0048 1156 VAL 77 N 0.0046 -0.0010 -0.0039 1157 VAL 77 CA 0.0049 -0.0010 -0.0034 1158 VAL 77 C 0.0048 -0.0013 -0.0029 1159 VAL 77 O 0.0044 -0.0016 -0.0029 1160 VAL 77 CB 0.0051 -0.0009 -0.0034 1161 VAL 77 CG1 0.0054 -0.0009 -0.0029 1162 VAL 77 CG2 0.0052 -0.0006 -0.0038 1163 ALA 78 N 0.0050 -0.0013 -0.0026 1164 ALA 78 CA 0.0049 -0.0016 -0.0021 1165 ALA 78 C 0.0053 -0.0016 -0.0017 1166 ALA 78 O 0.0056 -0.0014 -0.0016 1167 ALA 78 CB 0.0046 -0.0017 -0.0023 1168 GLN 79 N 0.0053 -0.0017 -0.0013 1169 GLN 79 CA 0.0056 -0.0017 -0.0008 1170 GLN 79 C 0.0054 -0.0021 -0.0003 1171 GLN 79 O 0.0050 -0.0023 -0.0004 1172 GLN 79 CB 0.0059 -0.0016 -0.0007 1173 GLN 79 CG 0.0056 -0.0018 -0.0005 1174 GLN 79 CD 0.0059 -0.0017 -0.0004 1175 GLN 79 OE1 0.0063 -0.0014 -0.0004 1176 GLN 79 NE2 0.0057 -0.0019 -0.0003 1177 LYS 80 N 0.0057 -0.0021 0.0001 1178 LYS 80 CA 0.0056 -0.0024 0.0006 1179 LYS 80 C 0.0060 -0.0023 0.0010 1180 LYS 80 O 0.0064 -0.0020 0.0010 1181 LYS 80 CB 0.0056 -0.0025 0.0007 1182 LYS 80 CG 0.0053 -0.0028 0.0012 1183 LYS 80 CD 0.0053 -0.0029 0.0014 1184 LYS 80 CE 0.0051 -0.0033 0.0019 1185 LYS 80 NZ 0.0051 -0.0034 0.0021 1186 THR 81 N 0.0063 -0.0027 0.0014 1187 THR 81 CA 0.0067 -0.0027 0.0018 1188 THR 81 C 0.0066 -0.0032 0.0023 1189 THR 81 O 0.0062 -0.0034 0.0023 1190 THR 81 CB 0.0068 -0.0026 0.0016 1191 THR 81 OG1 0.0069 -0.0022 0.0011 1192 THR 81 CG2 0.0073 -0.0026 0.0019 1193 VAL 82 N 0.0070 -0.0032 0.0026 1194 VAL 82 CA 0.0070 -0.0036 0.0031 1195 VAL 82 C 0.0074 -0.0036 0.0034 1196 VAL 82 O 0.0079 -0.0034 0.0034 1197 VAL 82 CB 0.0071 -0.0038 0.0034 1198 VAL 82 CG1 0.0071 -0.0041 0.0040 1199 VAL 82 CG2 0.0066 -0.0038 0.0032 1200 GLU 83 N 0.0073 -0.0038 0.0035 1201 GLU 83 CA 0.0076 -0.0038 0.0038 1202 GLU 83 C 0.0079 -0.0034 0.0034 1203 GLU 83 O 0.0084 -0.0033 0.0035 1204 GLU 83 CB 0.0080 -0.0040 0.0043 1205 GLU 83 CG 0.0077 -0.0044 0.0047 1206 GLU 83 CD 0.0081 -0.0046 0.0051 1207 GLU 83 OE1 0.0086 -0.0044 0.0052 1208 GLU 83 OE2 0.0079 -0.0049 0.0055 1209 GLY 84 N 0.0076 -0.0033 0.0031 1210 GLY 84 CA 0.0079 -0.0029 0.0027 1211 GLY 84 C 0.0074 -0.0028 0.0023 1212 GLY 84 O 0.0069 -0.0030 0.0023 1213 ALA 85 N 0.0076 -0.0026 0.0021 1214 ALA 85 CA 0.0074 -0.0026 0.0019 1215 ALA 85 C 0.0073 -0.0021 0.0015 1216 ALA 85 O 0.0076 -0.0018 0.0014 1217 ALA 85 CB 0.0076 -0.0025 0.0020 1218 GLY 86 N 0.0069 -0.0022 0.0011 1219 GLY 86 CA 0.0069 -0.0018 0.0007 1220 GLY 86 C 0.0066 -0.0017 0.0004 1221 GLY 86 O 0.0062 -0.0020 0.0003 1222 SER 87 N 0.0068 -0.0013 0.0003 1223 SER 87 CA 0.0067 -0.0012 0.0000 1224 SER 87 C 0.0066 -0.0008 -0.0004 1225 SER 87 O 0.0069 -0.0004 -0.0004 1226 SER 87 CB 0.0069 -0.0011 0.0002 1227 SER 87 OG 0.0070 -0.0015 0.0006 1228 ILE 88 N 0.0062 -0.0009 -0.0007 1229 ILE 88 CA 0.0061 -0.0005 -0.0010 1230 ILE 88 C 0.0062 -0.0001 -0.0013 1231 ILE 88 O 0.0065 0.0002 -0.0014 1232 ILE 88 CB 0.0057 -0.0007 -0.0013 1233 ILE 88 CG1 0.0057 -0.0010 -0.0011 1234 ILE 88 CG2 0.0055 -0.0003 -0.0017 1235 ILE 88 CD1 0.0052 -0.0013 -0.0012 1236 ALA 89 N 0.0062 0.0006 -0.0014 1237 ALA 89 CA 0.0063 0.0010 -0.0019 1238 ALA 89 C 0.0064 0.0007 -0.0012 1239 ALA 89 O 0.0059 0.0002 -0.0013 1240 ALA 89 CB 0.0056 0.0009 -0.0028 1241 ALA 90 N 0.0070 0.0011 -0.0006 1242 ALA 90 CA 0.0073 0.0008 0.0001 1243 ALA 90 C 0.0077 0.0015 -0.0001 1244 ALA 90 O 0.0080 0.0022 -0.0005 1245 ALA 90 CB 0.0077 0.0007 0.0010 1246 ALA 91 N 0.0076 0.0012 0.0002 1247 ALA 91 CA 0.0080 0.0018 0.0000 1248 ALA 91 C 0.0081 0.0015 0.0008 1249 ALA 91 O 0.0077 0.0008 0.0008 1250 ALA 91 CB 0.0075 0.0020 -0.0009 1251 THR 92 N 0.0088 0.0020 0.0013 1252 THR 92 CA 0.0090 0.0017 0.0020 1253 THR 92 C 0.0094 0.0024 0.0018 1254 THR 92 O 0.0098 0.0031 0.0014 1255 THR 92 CB 0.0095 0.0016 0.0029 1256 THR 92 OG1 0.0101 0.0024 0.0030 1257 THR 92 CG2 0.0092 0.0010 0.0031 1258 GLY 93 N 0.0095 0.0020 0.0019 1259 GLY 93 CA 0.0096 0.0018 0.0013 1260 GLY 93 C 0.0096 0.0023 0.0023 1261 GLY 93 O 0.0102 0.0025 0.0020 1262 PHE 94 N 0.0089 0.0023 0.0035 1263 PHE 94 CA 0.0088 0.0027 0.0046 1264 PHE 94 C 0.0086 0.0031 0.0059 1265 PHE 94 O 0.0080 0.0028 0.0061 1266 PHE 94 CB 0.0076 0.0019 0.0046 1267 PHE 94 CG 0.0077 0.0015 0.0034 1268 PHE 94 CD1 0.0082 0.0019 0.0035 1269 PHE 94 CD2 0.0074 0.0008 0.0023 1270 PHE 94 CE1 0.0083 0.0015 0.0025 1271 PHE 94 CE2 0.0075 0.0004 0.0012 1272 PHE 94 CZ 0.0080 0.0008 0.0013 1273 VAL 95 N 0.0092 0.0039 0.0068 1274 VAL 95 CA 0.0091 0.0044 0.0081 1275 VAL 95 C 0.0090 0.0047 0.0090 1276 VAL 95 O 0.0098 0.0051 0.0088 1277 VAL 95 CB 0.0101 0.0052 0.0084 1278 VAL 95 CG1 0.0100 0.0057 0.0098 1279 VAL 95 CG2 0.0102 0.0049 0.0076 1280 LYS 96 N 0.0079 0.0044 0.0099 1281 LYS 96 CA 0.0077 0.0046 0.0108 1282 LYS 96 C 0.0075 0.0051 0.0123 1283 LYS 96 O 0.0075 0.0052 0.0126 1284 LYS 96 CB 0.0066 0.0038 0.0106 1285 LYS 96 CG 0.0068 0.0033 0.0092 1286 LYS 96 CD 0.0076 0.0038 0.0091 1287 LYS 96 CE 0.0078 0.0034 0.0077 1288 LYS 96 NZ 0.0067 0.0025 0.0075 1289 LYS 97 N 0.0049 0.0068 0.0140 1290 LYS 97 CA 0.0033 0.0108 0.0159 1291 LYS 97 C -0.0013 0.0105 0.0167 1292 LYS 97 O -0.0024 0.0079 0.0159 1293 LYS 97 CB 0.0062 0.0137 0.0165 1294 LYS 97 CG 0.0050 0.0181 0.0184 1295 LYS 97 CD 0.0059 0.0202 0.0190 1296 LYS 97 CE 0.0046 0.0245 0.0209 1297 LYS 97 NZ 0.0074 0.0271 0.0214 1298 ASP 98 N -0.0039 0.0130 0.0182 1299 ASP 98 CA -0.0083 0.0134 0.0192 1300 ASP 98 C -0.0091 0.0179 0.0211 1301 ASP 98 O -0.0061 0.0205 0.0215 1302 ASP 98 CB -0.0115 0.0109 0.0189 1303 ASP 98 CG -0.0159 0.0099 0.0194 1304 ASP 98 OD1 -0.0165 0.0113 0.0200 1305 ASP 98 OD2 -0.0187 0.0078 0.0191 1306 GLN 99 N -0.0130 0.0189 0.0222 1307 GLN 99 CA -0.0142 0.0231 0.0241 1308 GLN 99 C -0.0142 0.0251 0.0249 1309 GLN 99 O -0.0123 0.0285 0.0258 1310 GLN 99 CB -0.0186 0.0232 0.0250 1311 GLN 99 CG -0.0200 0.0275 0.0270 1312 GLN 99 CD -0.0244 0.0276 0.0279 1313 GLN 99 OE1 -0.0264 0.0244 0.0270 1314 GLN 99 NE2 -0.0258 0.0312 0.0295 1315 VAL 37 N 0.0084 0.0295 0.0121 1316 VAL 37 CA 0.0091 0.0279 0.0115 1317 VAL 37 C 0.0064 0.0267 0.0115 1318 VAL 37 O 0.0061 0.0259 0.0113 1319 VAL 37 CB 0.0107 0.0295 0.0118 1320 VAL 37 CG1 0.0136 0.0299 0.0116 1321 VAL 37 CG2 0.0095 0.0322 0.0128 1322 LEU 38 N 0.0044 0.0264 0.0116 1323 LEU 38 CA 0.0017 0.0253 0.0116 1324 LEU 38 C 0.0018 0.0223 0.0107 1325 LEU 38 O 0.0007 0.0214 0.0105 1326 LEU 38 CB -0.0004 0.0258 0.0120 1327 LEU 38 CG -0.0020 0.0284 0.0130 1328 LEU 38 CD1 -0.0041 0.0284 0.0133 1329 LEU 38 CD2 -0.0002 0.0309 0.0136 1330 TYR 39 N 0.0031 0.0209 0.0101 1331 TYR 39 CA 0.0036 0.0181 0.0092 1332 TYR 39 C 0.0009 0.0164 0.0090 1333 TYR 39 O 0.0003 0.0152 0.0087 1334 TYR 39 CB 0.0055 0.0174 0.0087 1335 TYR 39 CG 0.0085 0.0184 0.0087 1336 TYR 39 CD1 0.0102 0.0170 0.0080 1337 TYR 39 CD2 0.0095 0.0207 0.0093 1338 TYR 39 CE1 0.0129 0.0178 0.0080 1339 TYR 39 CE2 0.0121 0.0216 0.0092 1340 TYR 39 CZ 0.0139 0.0201 0.0085 1341 TYR 39 OH 0.0165 0.0210 0.0085 1342 VAL 40 N -0.0008 0.0165 0.0092 1343 VAL 40 CA -0.0034 0.0150 0.0091 1344 VAL 40 C -0.0029 0.0121 0.0081 1345 VAL 40 O -0.0042 0.0104 0.0078 1346 VAL 40 CB -0.0053 0.0161 0.0097 1347 VAL 40 CG1 -0.0080 0.0145 0.0095 1348 VAL 40 CG2 -0.0058 0.0190 0.0106 1349 GLY 41 N 0.0006 0.0102 0.0073 1350 GLY 41 CA 0.0012 0.0083 0.0064 1351 GLY 41 C 0.0033 0.0079 0.0060 1352 GLY 41 O 0.0044 0.0072 0.0055 1353 SER 42 N 0.0038 0.0085 0.0062 1354 SER 42 CA 0.0059 0.0086 0.0059 1355 SER 42 C 0.0068 0.0067 0.0050 1356 SER 42 O 0.0085 0.0065 0.0046 1357 SER 42 CB 0.0062 0.0095 0.0063 1358 SER 42 OG 0.0082 0.0095 0.0060 1359 LYS 43 N 0.0057 0.0053 0.0045 1360 LYS 43 CA 0.0062 0.0034 0.0036 1361 LYS 43 C 0.0042 0.0022 0.0033 1362 LYS 43 O 0.0033 0.0022 0.0034 1363 LYS 43 CB 0.0078 0.0028 0.0031 1364 LYS 43 CG 0.0084 0.0009 0.0022 1365 LYS 43 CD 0.0101 0.0003 0.0017 1366 LYS 43 CE 0.0109 -0.0015 0.0008 1367 LYS 43 NZ 0.0094 -0.0031 0.0003 1368 THR 44 N 0.0036 0.0012 0.0029 1369 THR 44 CA 0.0020 -0.0001 0.0026 1370 THR 44 C 0.0027 -0.0020 0.0017 1371 THR 44 O 0.0041 -0.0020 0.0015 1372 THR 44 CB 0.0002 0.0004 0.0030 1373 THR 44 OG1 0.0008 0.0004 0.0030 1374 THR 44 CG2 -0.0005 0.0023 0.0040 1375 LYS 45 N 0.0021 -0.0027 0.0010 1376 LYS 45 CA 0.0023 -0.0028 0.0004 1377 LYS 45 C 0.0019 -0.0030 0.0002 1378 LYS 45 O 0.0014 -0.0033 0.0001 1379 LYS 45 CB 0.0023 -0.0029 -0.0001 1380 LYS 45 CG 0.0026 -0.0029 -0.0008 1381 LYS 45 CD 0.0026 -0.0030 -0.0012 1382 LYS 45 CE 0.0029 -0.0030 -0.0018 1383 LYS 45 NZ 0.0030 -0.0031 -0.0023 1384 GLU 46 N 0.0020 -0.0029 0.0003 1385 GLU 46 CA 0.0016 -0.0031 0.0003 1386 GLU 46 C 0.0018 -0.0031 -0.0000 1387 GLU 46 O 0.0023 -0.0029 0.0001 1388 GLU 46 CB 0.0014 -0.0031 0.0010 1389 GLU 46 CG 0.0019 -0.0028 0.0015 1390 GLU 46 CD 0.0016 -0.0027 0.0022 1391 GLU 46 OE1 0.0011 -0.0029 0.0023 1392 GLU 46 OE2 0.0019 -0.0025 0.0026 1393 GLY 47 N 0.0015 -0.0033 -0.0005 1394 GLY 47 CA 0.0017 -0.0033 -0.0009 1395 GLY 47 C 0.0022 -0.0033 -0.0014 1396 GLY 47 O 0.0026 -0.0031 -0.0016 1397 VAL 48 N 0.0021 -0.0034 -0.0017 1398 VAL 48 CA 0.0025 -0.0033 -0.0022 1399 VAL 48 C 0.0022 -0.0035 -0.0028 1400 VAL 48 O 0.0017 -0.0038 -0.0029 1401 VAL 48 CB 0.0026 -0.0032 -0.0019 1402 VAL 48 CG1 0.0031 -0.0031 -0.0024 1403 VAL 48 CG2 0.0029 -0.0029 -0.0013 1404 VAL 49 N 0.0023 -0.0027 -0.0036 1405 VAL 49 CA 0.0020 -0.0026 -0.0040 1406 VAL 49 C 0.0019 -0.0024 -0.0043 1407 VAL 49 O 0.0022 -0.0021 -0.0043 1408 VAL 49 CB 0.0023 -0.0023 -0.0041 1409 VAL 49 CG1 0.0020 -0.0021 -0.0045 1410 VAL 49 CG2 0.0023 -0.0026 -0.0038 1411 HIS 50 N 0.0016 -0.0025 -0.0046 1412 HIS 50 CA 0.0015 -0.0023 -0.0049 1413 HIS 50 C 0.0011 -0.0023 -0.0054 1414 HIS 50 O 0.0008 -0.0026 -0.0054 1415 HIS 50 CB 0.0014 -0.0025 -0.0048 1416 HIS 50 CG 0.0011 -0.0029 -0.0047 1417 HIS 50 ND1 0.0007 -0.0030 -0.0050 1418 HIS 50 CD2 0.0011 -0.0032 -0.0044 1419 HIS 50 CE1 0.0005 -0.0034 -0.0049 1420 HIS 50 NE2 0.0007 -0.0035 -0.0045 1421 GLY 51 N 0.0012 -0.0020 -0.0057 1422 GLY 51 CA 0.0008 -0.0019 -0.0061 1423 GLY 51 C 0.0008 -0.0018 -0.0062 1424 GLY 51 O 0.0005 -0.0021 -0.0063 1425 VAL 52 N 0.0011 -0.0015 -0.0063 1426 VAL 52 CA 0.0011 -0.0014 -0.0064 1427 VAL 52 C 0.0011 -0.0010 -0.0068 1428 VAL 52 O 0.0014 -0.0007 -0.0068 1429 VAL 52 CB 0.0014 -0.0014 -0.0060 1430 VAL 52 CG1 0.0015 -0.0013 -0.0061 1431 VAL 52 CG2 0.0014 -0.0018 -0.0056 1432 ALA 53 N 0.0006 -0.0007 -0.0068 1433 ALA 53 CA 0.0006 -0.0004 -0.0069 1434 ALA 53 C 0.0007 -0.0002 -0.0069 1435 ALA 53 O 0.0008 -0.0002 -0.0069 1436 ALA 53 CB 0.0002 -0.0003 -0.0069 1437 THR 54 N 0.0009 0.0001 -0.0070 1438 THR 54 CA 0.0011 0.0003 -0.0071 1439 THR 54 C 0.0011 0.0006 -0.0071 1440 THR 54 O 0.0011 0.0006 -0.0072 1441 THR 54 CB 0.0015 0.0002 -0.0070 1442 THR 54 OG1 0.0015 -0.0001 -0.0070 1443 THR 54 CG2 0.0017 0.0004 -0.0071 1444 VAL 55 N 0.0010 0.0009 -0.0072 1445 VAL 55 CA 0.0010 0.0012 -0.0073 1446 VAL 55 C 0.0012 0.0014 -0.0073 1447 VAL 55 O 0.0012 0.0014 -0.0073 1448 VAL 55 CB 0.0006 0.0014 -0.0073 1449 VAL 55 CG1 0.0006 0.0017 -0.0074 1450 VAL 55 CG2 0.0004 0.0012 -0.0073 1451 ALA 56 N 0.0015 0.0016 -0.0074 1452 ALA 56 CA 0.0017 0.0018 -0.0075 1453 ALA 56 C 0.0017 0.0021 -0.0075 1454 ALA 56 O 0.0018 0.0022 -0.0076 1455 ALA 56 CB 0.0021 0.0017 -0.0074 1456 GLU 57 N 0.0014 0.0022 -0.0075 1457 GLU 57 CA 0.0015 0.0025 -0.0079 1458 GLU 57 C 0.0016 0.0028 -0.0083 1459 GLU 57 O 0.0013 0.0030 -0.0084 1460 GLU 57 CB 0.0010 0.0028 -0.0079 1461 GLU 57 CG 0.0009 0.0025 -0.0076 1462 GLU 57 CD 0.0004 0.0028 -0.0077 1463 GLU 57 OE1 0.0002 0.0031 -0.0079 1464 GLU 57 OE2 0.0003 0.0026 -0.0074 1465 LYS 58 N 0.0021 0.0028 -0.0085 1466 LYS 58 CA 0.0023 0.0030 -0.0089 1467 LYS 58 C 0.0026 0.0032 -0.0093 1468 LYS 58 O 0.0030 0.0031 -0.0093 1469 LYS 58 CB 0.0027 0.0027 -0.0087 1470 LYS 58 CG 0.0024 0.0025 -0.0083 1471 LYS 58 CD 0.0028 0.0022 -0.0081 1472 LYS 58 CE 0.0025 0.0020 -0.0077 1473 LYS 58 NZ 0.0029 0.0018 -0.0076 1474 THR 59 N 0.0023 0.0036 -0.0096 1475 THR 59 CA 0.0026 0.0038 -0.0101 1476 THR 59 C 0.0031 0.0038 -0.0104 1477 THR 59 O 0.0034 0.0038 -0.0106 1478 THR 59 CB 0.0021 0.0042 -0.0104 1479 THR 59 OG1 0.0017 0.0041 -0.0101 1480 THR 59 CG2 0.0023 0.0044 -0.0108 1481 LYS 60 N 0.0031 0.0038 -0.0103 1482 LYS 60 CA 0.0036 0.0038 -0.0105 1483 LYS 60 C 0.0036 0.0035 -0.0103 1484 LYS 60 O 0.0033 0.0036 -0.0102 1485 LYS 60 CB 0.0036 0.0041 -0.0110 1486 LYS 60 CG 0.0041 0.0041 -0.0113 1487 LYS 60 CD 0.0041 0.0045 -0.0118 1488 LYS 60 CE 0.0046 0.0045 -0.0121 1489 LYS 60 NZ 0.0046 0.0049 -0.0126 1490 GLU 61 N 0.0041 0.0033 -0.0101 1491 GLU 61 CA 0.0042 0.0030 -0.0095 1492 GLU 61 C 0.0048 0.0032 -0.0093 1493 GLU 61 O 0.0053 0.0034 -0.0093 1494 GLU 61 CB 0.0042 0.0028 -0.0090 1495 GLU 61 CG 0.0043 0.0025 -0.0083 1496 GLU 61 CD 0.0043 0.0023 -0.0078 1497 GLU 61 OE1 0.0043 0.0024 -0.0080 1498 GLU 61 OE2 0.0044 0.0021 -0.0073 1499 GLN 62 N 0.0046 0.0031 -0.0092 1500 GLN 62 CA 0.0052 0.0033 -0.0092 1501 GLN 62 C 0.0051 0.0030 -0.0086 1502 GLN 62 O 0.0046 0.0027 -0.0085 1503 GLN 62 CB 0.0051 0.0035 -0.0097 1504 GLN 62 CG 0.0056 0.0037 -0.0097 1505 GLN 62 CD 0.0055 0.0039 -0.0103 1506 GLN 62 OE1 0.0050 0.0040 -0.0107 1507 GLN 62 NE2 0.0059 0.0041 -0.0103 1508 VAL 63 N 0.0057 0.0030 -0.0081 1509 VAL 63 CA 0.0057 0.0027 -0.0075 1510 VAL 63 C 0.0063 0.0029 -0.0075 1511 VAL 63 O 0.0068 0.0030 -0.0073 1512 VAL 63 CB 0.0057 0.0024 -0.0070 1513 VAL 63 CG1 0.0058 0.0022 -0.0064 1514 VAL 63 CG2 0.0051 0.0022 -0.0071 1515 THR 64 N 0.0062 0.0029 -0.0076 1516 THR 64 CA 0.0068 0.0031 -0.0076 1517 THR 64 C 0.0067 0.0029 -0.0072 1518 THR 64 O 0.0063 0.0028 -0.0074 1519 THR 64 CB 0.0069 0.0035 -0.0082 1520 THR 64 OG1 0.0064 0.0034 -0.0085 1521 THR 64 CG2 0.0068 0.0037 -0.0087 1522 ASN 65 N 0.0070 0.0025 -0.0066 1523 ASN 65 CA 0.0067 0.0021 -0.0059 1524 ASN 65 C 0.0074 0.0024 -0.0055 1525 ASN 65 O 0.0081 0.0029 -0.0057 1526 ASN 65 CB 0.0065 0.0017 -0.0051 1527 ASN 65 CG 0.0071 0.0020 -0.0044 1528 ASN 65 OD1 0.0078 0.0024 -0.0042 1529 ASN 65 ND2 0.0069 0.0017 -0.0039 1530 VAL 66 N 0.0071 0.0022 -0.0051 1531 VAL 66 CA 0.0077 0.0024 -0.0046 1532 VAL 66 C 0.0075 0.0020 -0.0036 1533 VAL 66 O 0.0068 0.0015 -0.0035 1534 VAL 66 CB 0.0077 0.0025 -0.0051 1535 VAL 66 CG1 0.0077 0.0028 -0.0061 1536 VAL 66 CG2 0.0071 0.0021 -0.0048 1537 GLY 67 N 0.0081 0.0022 -0.0030 1538 GLY 67 CA 0.0080 0.0019 -0.0020 1539 GLY 67 C 0.0076 0.0016 -0.0016 1540 GLY 67 O 0.0075 0.0013 -0.0007 1541 GLY 68 N 0.0073 0.0015 -0.0021 1542 GLY 68 CA 0.0068 0.0011 -0.0017 1543 GLY 68 C 0.0071 0.0013 -0.0019 1544 GLY 68 O 0.0077 0.0018 -0.0023 1545 ALA 69 N 0.0070 0.0013 -0.0017 1546 ALA 69 CA 0.0071 0.0014 -0.0018 1547 ALA 69 C 0.0064 0.0011 -0.0022 1548 ALA 69 O 0.0060 0.0006 -0.0019 1549 ALA 69 CB 0.0073 0.0013 -0.0010 1550 VAL 70 N 0.0064 0.0014 -0.0028 1551 VAL 70 CA 0.0059 0.0012 -0.0033 1552 VAL 70 C 0.0060 0.0013 -0.0034 1553 VAL 70 O 0.0064 0.0017 -0.0035 1554 VAL 70 CB 0.0057 0.0014 -0.0041 1555 VAL 70 CG1 0.0052 0.0012 -0.0046 1556 VAL 70 CG2 0.0055 0.0012 -0.0040 1557 VAL 71 N 0.0055 0.0008 -0.0033 1558 VAL 71 CA 0.0055 0.0009 -0.0034 1559 VAL 71 C 0.0050 0.0007 -0.0040 1560 VAL 71 O 0.0044 0.0003 -0.0041 1561 VAL 71 CB 0.0054 0.0005 -0.0027 1562 VAL 71 CG1 0.0053 0.0004 -0.0028 1563 VAL 71 CG2 0.0059 0.0006 -0.0020 1564 THR 72 N 0.0051 0.0011 -0.0046 1565 THR 72 CA 0.0046 0.0010 -0.0053 1566 THR 72 C 0.0046 0.0011 -0.0054 1567 THR 72 O 0.0051 0.0015 -0.0055 1568 THR 72 CB 0.0048 0.0015 -0.0059 1569 THR 72 OG1 0.0054 0.0020 -0.0060 1570 THR 72 CG2 0.0048 0.0014 -0.0059 1571 GLY 73 N 0.0040 0.0006 -0.0054 1572 GLY 73 CA 0.0037 0.0005 -0.0057 1573 GLY 73 C 0.0038 0.0004 -0.0054 1574 GLY 73 O 0.0039 0.0007 -0.0056 1575 VAL 74 N 0.0039 0.0000 -0.0050 1576 VAL 74 CA 0.0039 -0.0001 -0.0048 1577 VAL 74 C 0.0034 -0.0004 -0.0050 1578 VAL 74 O 0.0030 -0.0006 -0.0051 1579 VAL 74 CB 0.0043 -0.0004 -0.0043 1580 VAL 74 CG1 0.0047 -0.0002 -0.0041 1581 VAL 74 CG2 0.0039 -0.0009 -0.0040 1582 THR 75 N 0.0034 -0.0004 -0.0050 1583 THR 75 CA 0.0029 -0.0006 -0.0052 1584 THR 75 C 0.0030 -0.0008 -0.0049 1585 THR 75 O 0.0034 -0.0005 -0.0048 1586 THR 75 CB 0.0027 -0.0002 -0.0057 1587 THR 75 OG1 0.0027 0.0000 -0.0060 1588 THR 75 CG2 0.0022 -0.0004 -0.0059 1589 ALA 76 N 0.0026 -0.0012 -0.0048 1590 ALA 76 CA 0.0026 -0.0014 -0.0046 1591 ALA 76 C 0.0031 -0.0015 -0.0041 1592 ALA 76 O 0.0033 -0.0014 -0.0040 1593 ALA 76 CB 0.0025 -0.0011 -0.0049 1594 VAL 77 N 0.0032 -0.0016 -0.0039 1595 VAL 77 CA 0.0035 -0.0016 -0.0034 1596 VAL 77 C 0.0033 -0.0019 -0.0030 1597 VAL 77 O 0.0029 -0.0022 -0.0029 1598 VAL 77 CB 0.0036 -0.0015 -0.0034 1599 VAL 77 CG1 0.0040 -0.0015 -0.0029 1600 VAL 77 CG2 0.0038 -0.0012 -0.0039 1601 ALA 78 N 0.0036 -0.0018 -0.0026 1602 ALA 78 CA 0.0034 -0.0021 -0.0022 1603 ALA 78 C 0.0038 -0.0021 -0.0017 1604 ALA 78 O 0.0041 -0.0019 -0.0016 1605 ALA 78 CB 0.0032 -0.0022 -0.0023 1606 GLN 79 N 0.0038 -0.0022 -0.0012 1607 GLN 79 CA 0.0042 -0.0022 -0.0007 1608 GLN 79 C 0.0039 -0.0025 -0.0003 1609 GLN 79 O 0.0035 -0.0028 -0.0003 1610 GLN 79 CB 0.0044 -0.0021 -0.0006 1611 GLN 79 CG 0.0041 -0.0024 -0.0005 1612 GLN 79 CD 0.0044 -0.0022 -0.0003 1613 GLN 79 OE1 0.0048 -0.0019 -0.0004 1614 GLN 79 NE2 0.0041 -0.0024 -0.0002 1615 LYS 80 N 0.0043 -0.0025 0.0002 1616 LYS 80 CA 0.0041 -0.0028 0.0007 1617 LYS 80 C 0.0045 -0.0027 0.0011 1618 LYS 80 O 0.0049 -0.0024 0.0011 1619 LYS 80 CB 0.0041 -0.0029 0.0008 1620 LYS 80 CG 0.0038 -0.0032 0.0013 1621 LYS 80 CD 0.0038 -0.0033 0.0015 1622 LYS 80 CE 0.0036 -0.0037 0.0020 1623 LYS 80 NZ 0.0036 -0.0038 0.0022 1624 THR 81 N 0.0046 -0.0032 0.0015 1625 THR 81 CA 0.0051 -0.0032 0.0019 1626 THR 81 C 0.0049 -0.0036 0.0024 1627 THR 81 O 0.0045 -0.0038 0.0024 1628 THR 81 CB 0.0051 -0.0031 0.0017 1629 THR 81 OG1 0.0052 -0.0027 0.0012 1630 THR 81 CG2 0.0056 -0.0031 0.0020 1631 VAL 82 N 0.0053 -0.0037 0.0027 1632 VAL 82 CA 0.0053 -0.0040 0.0033 1633 VAL 82 C 0.0057 -0.0040 0.0035 1634 VAL 82 O 0.0062 -0.0038 0.0035 1635 VAL 82 CB 0.0054 -0.0041 0.0035 1636 VAL 82 CG1 0.0054 -0.0045 0.0041 1637 VAL 82 CG2 0.0050 -0.0042 0.0033 1638 GLU 83 N 0.0055 -0.0042 0.0037 1639 GLU 83 CA 0.0058 -0.0042 0.0039 1640 GLU 83 C 0.0061 -0.0039 0.0036 1641 GLU 83 O 0.0066 -0.0037 0.0037 1642 GLU 83 CB 0.0062 -0.0044 0.0044 1643 GLU 83 CG 0.0059 -0.0047 0.0048 1644 GLU 83 CD 0.0062 -0.0049 0.0053 1645 GLU 83 OE1 0.0067 -0.0047 0.0053 1646 GLU 83 OE2 0.0060 -0.0052 0.0056 1647 GLY 84 N 0.0058 -0.0037 0.0032 1648 GLY 84 CA 0.0061 -0.0034 0.0029 1649 GLY 84 C 0.0056 -0.0033 0.0025 1650 GLY 84 O 0.0052 -0.0035 0.0024 1651 ALA 85 N 0.0058 -0.0032 0.0024 1652 ALA 85 CA 0.0055 -0.0031 0.0021 1653 ALA 85 C 0.0055 -0.0027 0.0016 1654 ALA 85 O 0.0058 -0.0024 0.0016 1655 ALA 85 CB 0.0057 -0.0031 0.0023 1656 GLY 86 N 0.0051 -0.0028 0.0013 1657 GLY 86 CA 0.0051 -0.0025 0.0009 1658 GLY 86 C 0.0048 -0.0024 0.0006 1659 GLY 86 O 0.0045 -0.0027 0.0004 1660 SER 87 N 0.0050 -0.0021 0.0005 1661 SER 87 CA 0.0049 -0.0020 0.0002 1662 SER 87 C 0.0048 -0.0016 -0.0003 1663 SER 87 O 0.0052 -0.0012 -0.0003 1664 SER 87 CB 0.0051 -0.0019 0.0004 1665 SER 87 OG 0.0051 -0.0023 0.0007 1666 ILE 88 N 0.0045 -0.0017 -0.0006 1667 ILE 88 CA 0.0044 -0.0013 -0.0010 1668 ILE 88 C 0.0045 -0.0010 -0.0012 1669 ILE 88 O 0.0048 -0.0006 -0.0013 1670 ILE 88 CB 0.0040 -0.0015 -0.0013 1671 ILE 88 CG1 0.0040 -0.0017 -0.0010 1672 ILE 88 CG2 0.0039 -0.0012 -0.0017 1673 ILE 88 CD1 0.0036 -0.0020 -0.0012 1674 ALA 89 N 0.0044 -0.0004 -0.0014 1675 ALA 89 CA 0.0045 -0.0001 -0.0018 1676 ALA 89 C 0.0045 -0.0005 -0.0012 1677 ALA 89 O 0.0040 -0.0010 -0.0012 1678 ALA 89 CB 0.0040 -0.0003 -0.0028 1679 ALA 90 N 0.0050 -0.0001 -0.0005 1680 ALA 90 CA 0.0051 -0.0003 0.0002 1681 ALA 90 C 0.0055 0.0002 0.0001 1682 ALA 90 O 0.0058 0.0009 -0.0003 1683 ALA 90 CB 0.0054 -0.0004 0.0012 1684 ALA 91 N 0.0053 -0.0001 0.0003 1685 ALA 91 CA 0.0056 0.0004 0.0002 1686 ALA 91 C 0.0056 0.0000 0.0009 1687 ALA 91 O 0.0051 -0.0007 0.0010 1688 ALA 91 CB 0.0053 0.0004 -0.0008 1689 THR 92 N 0.0062 0.0005 0.0015 1690 THR 92 CA 0.0063 0.0002 0.0022 1691 THR 92 C 0.0066 0.0007 0.0020 1692 THR 92 O 0.0070 0.0015 0.0017 1693 THR 92 CB 0.0067 0.0002 0.0031 1694 THR 92 OG1 0.0073 0.0010 0.0032 1695 THR 92 CG2 0.0064 -0.0002 0.0033 1696 GLY 93 N 0.0065 0.0003 0.0022 1697 GLY 93 CA 0.0065 0.0000 0.0017 1698 GLY 93 C 0.0064 0.0005 0.0027 1699 GLY 93 O 0.0069 0.0007 0.0025 1700 PHE 94 N 0.0056 0.0006 0.0039 1701 PHE 94 CA 0.0054 0.0010 0.0050 1702 PHE 94 C 0.0052 0.0016 0.0063 1703 PHE 94 O 0.0047 0.0013 0.0065 1704 PHE 94 CB 0.0042 0.0002 0.0051 1705 PHE 94 CG 0.0043 -0.0003 0.0040 1706 PHE 94 CD1 0.0047 0.0000 0.0041 1707 PHE 94 CD2 0.0040 -0.0012 0.0029 1708 PHE 94 CE1 0.0047 -0.0005 0.0031 1709 PHE 94 CE2 0.0041 -0.0016 0.0018 1710 PHE 94 CZ 0.0044 -0.0013 0.0020 1711 VAL 95 N 0.0058 0.0024 0.0071 1712 VAL 95 CA 0.0056 0.0030 0.0085 1713 VAL 95 C 0.0054 0.0033 0.0094 1714 VAL 95 O 0.0061 0.0038 0.0093 1715 VAL 95 CB 0.0067 0.0039 0.0087 1716 VAL 95 CG1 0.0065 0.0045 0.0101 1717 VAL 95 CG2 0.0069 0.0036 0.0078 1718 LYS 96 N 0.0043 0.0031 0.0103 1719 LYS 96 CA 0.0039 0.0033 0.0113 1720 LYS 96 C 0.0037 0.0039 0.0127 1721 LYS 96 O 0.0038 0.0041 0.0129 1722 LYS 96 CB 0.0028 0.0024 0.0111 1723 LYS 96 CG 0.0030 0.0018 0.0098 1724 LYS 96 CD 0.0037 0.0023 0.0097 1725 LYS 96 CE 0.0039 0.0018 0.0084 1726 LYS 96 NZ 0.0028 0.0008 0.0082 1727 LYS 97 N 0.0007 0.0054 0.0145 1728 LYS 97 CA -0.0010 0.0098 0.0164 1729 LYS 97 C -0.0059 0.0095 0.0172 1730 LYS 97 O -0.0072 0.0067 0.0165 1731 LYS 97 CB 0.0021 0.0129 0.0169 1732 LYS 97 CG 0.0009 0.0177 0.0189 1733 LYS 97 CD 0.0019 0.0199 0.0195 1734 LYS 97 CE 0.0006 0.0246 0.0215 1735 LYS 97 NZ 0.0035 0.0273 0.0219 1736 ASP 98 N -0.0087 0.0123 0.0188 1737 ASP 98 CA -0.0134 0.0128 0.0199 1738 ASP 98 C -0.0141 0.0177 0.0218 1739 ASP 98 O -0.0110 0.0204 0.0222 1740 ASP 98 CB -0.0168 0.0102 0.0196 1741 ASP 98 CG -0.0215 0.0092 0.0201 1742 ASP 98 OD1 -0.0222 0.0106 0.0208 1743 ASP 98 OD2 -0.0245 0.0069 0.0199 1744 GLN 99 N -0.0183 0.0187 0.0230 1745 GLN 99 CA -0.0196 0.0233 0.0250 1746 GLN 99 C -0.0195 0.0255 0.0257 1747 GLN 99 O -0.0174 0.0291 0.0267 1748 GLN 99 CB -0.0243 0.0235 0.0260 1749 GLN 99 CG -0.0258 0.0282 0.0280 1750 GLN 99 CD -0.0305 0.0283 0.0289 1751 GLN 99 OE1 -0.0328 0.0249 0.0281 1752 GLN 99 NE2 -0.0320 0.0322 0.0307 1753 VAL 37 N 0.0068 0.0285 0.0121 1754 VAL 37 CA 0.0075 0.0268 0.0114 1755 VAL 37 C 0.0048 0.0256 0.0114 1756 VAL 37 O 0.0045 0.0248 0.0112 1757 VAL 37 CB 0.0092 0.0283 0.0117 1758 VAL 37 CG1 0.0121 0.0288 0.0114 1759 VAL 37 CG2 0.0080 0.0310 0.0127 1760 LEU 38 N 0.0028 0.0254 0.0116 1761 LEU 38 CA 0.0001 0.0243 0.0117 1762 LEU 38 C 0.0002 0.0213 0.0107 1763 LEU 38 O -0.0010 0.0203 0.0105 1764 LEU 38 CB -0.0019 0.0249 0.0121 1765 LEU 38 CG -0.0035 0.0274 0.0131 1766 LEU 38 CD1 -0.0056 0.0274 0.0135 1767 LEU 38 CD2 -0.0017 0.0299 0.0137 1768 TYR 39 N 0.0015 0.0199 0.0101 1769 TYR 39 CA 0.0019 0.0171 0.0091 1770 TYR 39 C -0.0008 0.0155 0.0090 1771 TYR 39 O -0.0014 0.0142 0.0087 1772 TYR 39 CB 0.0038 0.0164 0.0086 1773 TYR 39 CG 0.0067 0.0173 0.0085 1774 TYR 39 CD1 0.0085 0.0159 0.0078 1775 TYR 39 CD2 0.0078 0.0196 0.0091 1776 TYR 39 CE1 0.0112 0.0168 0.0077 1777 TYR 39 CE2 0.0105 0.0205 0.0090 1778 TYR 39 CZ 0.0122 0.0190 0.0083 1779 TYR 39 OH 0.0148 0.0199 0.0082 1780 VAL 40 N -0.0025 0.0156 0.0093 1781 VAL 40 CA -0.0051 0.0141 0.0091 1782 VAL 40 C -0.0046 0.0112 0.0082 1783 VAL 40 O -0.0059 0.0095 0.0078 1784 VAL 40 CB -0.0069 0.0153 0.0098 1785 VAL 40 CG1 -0.0097 0.0137 0.0096 1786 VAL 40 CG2 -0.0074 0.0181 0.0107 1787 GLY 41 N -0.0009 0.0093 0.0074 1788 GLY 41 CA -0.0005 0.0075 0.0065 1789 GLY 41 C 0.0016 0.0071 0.0060 1790 GLY 41 O 0.0027 0.0065 0.0055 1791 SER 42 N 0.0022 0.0076 0.0061 1792 SER 42 CA 0.0042 0.0077 0.0057 1793 SER 42 C 0.0051 0.0058 0.0047 1794 SER 42 O 0.0067 0.0057 0.0044 1795 SER 42 CB 0.0045 0.0085 0.0060 1796 SER 42 OG 0.0064 0.0085 0.0057 1797 LYS 43 N 0.0039 0.0044 0.0043 1798 LYS 43 CA 0.0044 0.0026 0.0034 1799 LYS 43 C 0.0025 0.0014 0.0032 1800 LYS 43 O 0.0016 0.0013 0.0033 1801 LYS 43 CB 0.0059 0.0019 0.0028 1802 LYS 43 CG 0.0066 0.0001 0.0019 1803 LYS 43 CD 0.0082 -0.0006 0.0013 1804 LYS 43 CE 0.0089 -0.0023 0.0004 1805 LYS 43 NZ 0.0074 -0.0038 -0.0000 1806 THR 44 N 0.0019 0.0005 0.0029 1807 THR 44 CA 0.0002 -0.0009 0.0026 1808 THR 44 C 0.0009 -0.0026 0.0017 1809 THR 44 O 0.0023 -0.0026 0.0015 1810 THR 44 CB -0.0015 -0.0003 0.0032 1811 THR 44 OG1 -0.0009 -0.0002 0.0031 1812 THR 44 CG2 -0.0022 0.0015 0.0041 1813 LYS 45 N 0.0007 -0.0032 0.0012 1814 LYS 45 CA 0.0009 -0.0033 0.0005 1815 LYS 45 C 0.0004 -0.0036 0.0003 1816 LYS 45 O -0.0001 -0.0039 0.0002 1817 LYS 45 CB 0.0009 -0.0034 -0.0001 1818 LYS 45 CG 0.0012 -0.0035 -0.0008 1819 LYS 45 CD 0.0013 -0.0035 -0.0013 1820 LYS 45 CE 0.0016 -0.0035 -0.0020 1821 LYS 45 NZ 0.0017 -0.0036 -0.0026 1822 GLU 46 N 0.0006 -0.0035 0.0005 1823 GLU 46 CA 0.0001 -0.0037 0.0005 1824 GLU 46 C 0.0004 -0.0036 0.0002 1825 GLU 46 O 0.0009 -0.0033 0.0004 1826 GLU 46 CB -0.0001 -0.0036 0.0013 1827 GLU 46 CG 0.0004 -0.0033 0.0018 1828 GLU 46 CD 0.0001 -0.0032 0.0026 1829 GLU 46 OE1 -0.0005 -0.0035 0.0027 1830 GLU 46 OE2 0.0005 -0.0029 0.0031 1831 GLY 47 N 0.0000 -0.0039 -0.0003 1832 GLY 47 CA 0.0003 -0.0039 -0.0007 1833 GLY 47 C 0.0007 -0.0038 -0.0014 1834 GLY 47 O 0.0012 -0.0036 -0.0015 1835 VAL 48 N 0.0006 -0.0039 -0.0017 1836 VAL 48 CA 0.0011 -0.0038 -0.0022 1837 VAL 48 C 0.0008 -0.0041 -0.0029 1838 VAL 48 O 0.0002 -0.0044 -0.0030 1839 VAL 48 CB 0.0012 -0.0037 -0.0020 1840 VAL 48 CG1 0.0017 -0.0036 -0.0026 1841 VAL 48 CG2 0.0015 -0.0034 -0.0013 1842 VAL 49 N 0.0013 -0.0031 -0.0036 1843 VAL 49 CA 0.0011 -0.0030 -0.0040 1844 VAL 49 C 0.0010 -0.0028 -0.0043 1845 VAL 49 O 0.0012 -0.0025 -0.0044 1846 VAL 49 CB 0.0013 -0.0027 -0.0040 1847 VAL 49 CG1 0.0011 -0.0026 -0.0045 1848 VAL 49 CG2 0.0013 -0.0030 -0.0038 1849 HIS 50 N 0.0006 -0.0029 -0.0046 1850 HIS 50 CA 0.0006 -0.0027 -0.0050 1851 HIS 50 C 0.0002 -0.0027 -0.0054 1852 HIS 50 O -0.0001 -0.0030 -0.0054 1853 HIS 50 CB 0.0005 -0.0028 -0.0048 1854 HIS 50 CG 0.0002 -0.0032 -0.0048 1855 HIS 50 ND1 -0.0001 -0.0033 -0.0051 1856 HIS 50 CD2 0.0002 -0.0036 -0.0044 1857 HIS 50 CE1 -0.0003 -0.0037 -0.0050 1858 HIS 50 NE2 -0.0002 -0.0038 -0.0046 1859 GLY 51 N 0.0003 -0.0024 -0.0057 1860 GLY 51 CA -0.0000 -0.0023 -0.0061 1861 GLY 51 C -0.0001 -0.0023 -0.0062 1862 GLY 51 O -0.0003 -0.0025 -0.0062 1863 VAL 52 N 0.0002 -0.0020 -0.0062 1864 VAL 52 CA 0.0002 -0.0019 -0.0063 1865 VAL 52 C 0.0003 -0.0015 -0.0066 1866 VAL 52 O 0.0005 -0.0012 -0.0067 1867 VAL 52 CB 0.0005 -0.0019 -0.0059 1868 VAL 52 CG1 0.0006 -0.0018 -0.0060 1869 VAL 52 CG2 0.0005 -0.0023 -0.0055 1870 ALA 53 N 0.0001 -0.0009 -0.0067 1871 ALA 53 CA 0.0001 -0.0006 -0.0068 1872 ALA 53 C 0.0003 -0.0003 -0.0068 1873 ALA 53 O 0.0003 -0.0004 -0.0068 1874 ALA 53 CB -0.0004 -0.0005 -0.0068 1875 THR 54 N 0.0004 -0.0000 -0.0069 1876 THR 54 CA 0.0007 0.0002 -0.0070 1877 THR 54 C 0.0006 0.0006 -0.0071 1878 THR 54 O 0.0007 0.0006 -0.0071 1879 THR 54 CB 0.0011 0.0001 -0.0069 1880 THR 54 OG1 0.0011 -0.0003 -0.0068 1881 THR 54 CG2 0.0013 0.0003 -0.0070 1882 VAL 55 N 0.0006 0.0008 -0.0071 1883 VAL 55 CA 0.0006 0.0012 -0.0072 1884 VAL 55 C 0.0008 0.0014 -0.0073 1885 VAL 55 O 0.0008 0.0014 -0.0073 1886 VAL 55 CB 0.0002 0.0014 -0.0073 1887 VAL 55 CG1 0.0002 0.0018 -0.0074 1888 VAL 55 CG2 -0.0001 0.0012 -0.0072 1889 ALA 56 N 0.0011 0.0016 -0.0073 1890 ALA 56 CA 0.0013 0.0018 -0.0074 1891 ALA 56 C 0.0013 0.0022 -0.0075 1892 ALA 56 O 0.0015 0.0023 -0.0075 1893 ALA 56 CB 0.0017 0.0017 -0.0073 1894 GLU 57 N 0.0008 0.0021 -0.0074 1895 GLU 57 CA 0.0010 0.0022 -0.0079 1896 GLU 57 C 0.0009 0.0024 -0.0082 1897 GLU 57 O 0.0005 0.0025 -0.0083 1898 GLU 57 CB 0.0007 0.0023 -0.0079 1899 GLU 57 CG 0.0008 0.0022 -0.0076 1900 GLU 57 CD 0.0005 0.0023 -0.0077 1901 GLU 57 OE1 0.0002 0.0025 -0.0080 1902 GLU 57 OE2 0.0005 0.0023 -0.0075 1903 LYS 58 N 0.0013 0.0023 -0.0085 1904 LYS 58 CA 0.0013 0.0024 -0.0088 1905 LYS 58 C 0.0015 0.0024 -0.0092 1906 LYS 58 O 0.0019 0.0023 -0.0093 1907 LYS 58 CB 0.0015 0.0023 -0.0086 1908 LYS 58 CG 0.0012 0.0022 -0.0082 1909 LYS 58 CD 0.0014 0.0021 -0.0080 1910 LYS 58 CE 0.0011 0.0021 -0.0076 1911 LYS 58 NZ 0.0013 0.0020 -0.0075 1912 THR 59 N 0.0013 0.0026 -0.0096 1913 THR 59 CA 0.0015 0.0027 -0.0100 1914 THR 59 C 0.0017 0.0026 -0.0102 1915 THR 59 O 0.0021 0.0026 -0.0105 1916 THR 59 CB 0.0011 0.0029 -0.0103 1917 THR 59 OG1 0.0008 0.0029 -0.0100 1918 THR 59 CG2 0.0013 0.0029 -0.0107 1919 LYS 60 N 0.0016 0.0027 -0.0102 1920 LYS 60 CA 0.0019 0.0026 -0.0104 1921 LYS 60 C 0.0018 0.0026 -0.0101 1922 LYS 60 O 0.0014 0.0027 -0.0101 1923 LYS 60 CB 0.0018 0.0028 -0.0109 1924 LYS 60 CG 0.0021 0.0028 -0.0111 1925 LYS 60 CD 0.0020 0.0029 -0.0116 1926 LYS 60 CE 0.0024 0.0029 -0.0118 1927 LYS 60 NZ 0.0023 0.0031 -0.0123 1928 GLU 61 N 0.0023 0.0020 -0.0099 1929 GLU 61 CA 0.0023 0.0018 -0.0093 1930 GLU 61 C 0.0028 0.0020 -0.0092 1931 GLU 61 O 0.0033 0.0022 -0.0092 1932 GLU 61 CB 0.0024 0.0017 -0.0088 1933 GLU 61 CG 0.0024 0.0015 -0.0082 1934 GLU 61 CD 0.0024 0.0014 -0.0077 1935 GLU 61 OE1 0.0025 0.0015 -0.0079 1936 GLU 61 OE2 0.0024 0.0012 -0.0072 1937 GLN 62 N 0.0026 0.0019 -0.0091 1938 GLN 62 CA 0.0030 0.0020 -0.0090 1939 GLN 62 C 0.0029 0.0018 -0.0084 1940 GLN 62 O 0.0024 0.0016 -0.0083 1941 GLN 62 CB 0.0029 0.0021 -0.0095 1942 GLN 62 CG 0.0033 0.0023 -0.0095 1943 GLN 62 CD 0.0032 0.0024 -0.0100 1944 GLN 62 OE1 0.0028 0.0024 -0.0104 1945 GLN 62 NE2 0.0036 0.0026 -0.0100 1946 VAL 63 N 0.0034 0.0018 -0.0080 1947 VAL 63 CA 0.0033 0.0016 -0.0074 1948 VAL 63 C 0.0039 0.0018 -0.0073 1949 VAL 63 O 0.0044 0.0019 -0.0071 1950 VAL 63 CB 0.0034 0.0015 -0.0069 1951 VAL 63 CG1 0.0034 0.0013 -0.0063 1952 VAL 63 CG2 0.0029 0.0013 -0.0069 1953 THR 64 N 0.0037 0.0018 -0.0074 1954 THR 64 CA 0.0042 0.0019 -0.0074 1955 THR 64 C 0.0040 0.0017 -0.0070 1956 THR 64 O 0.0036 0.0016 -0.0072 1957 THR 64 CB 0.0042 0.0022 -0.0080 1958 THR 64 OG1 0.0037 0.0020 -0.0082 1959 THR 64 CG2 0.0043 0.0024 -0.0085 1960 ASN 65 N 0.0043 0.0008 -0.0064 1961 ASN 65 CA 0.0040 0.0004 -0.0057 1962 ASN 65 C 0.0046 0.0007 -0.0053 1963 ASN 65 O 0.0053 0.0012 -0.0054 1964 ASN 65 CB 0.0037 0.0000 -0.0049 1965 ASN 65 CG 0.0044 0.0003 -0.0042 1966 ASN 65 OD1 0.0051 0.0007 -0.0040 1967 ASN 65 ND2 0.0042 0.0000 -0.0037 1968 VAL 66 N 0.0044 0.0004 -0.0048 1969 VAL 66 CA 0.0049 0.0007 -0.0042 1970 VAL 66 C 0.0047 0.0003 -0.0032 1971 VAL 66 O 0.0040 -0.0002 -0.0031 1972 VAL 66 CB 0.0050 0.0008 -0.0046 1973 VAL 66 CG1 0.0050 0.0011 -0.0057 1974 VAL 66 CG2 0.0043 0.0003 -0.0044 1975 GLY 67 N 0.0053 0.0006 -0.0025 1976 GLY 67 CA 0.0052 0.0002 -0.0015 1977 GLY 67 C 0.0048 -0.0001 -0.0011 1978 GLY 67 O 0.0047 -0.0004 -0.0002 1979 GLY 68 N 0.0046 -0.0002 -0.0017 1980 GLY 68 CA 0.0040 -0.0006 -0.0014 1981 GLY 68 C 0.0044 -0.0003 -0.0016 1982 GLY 68 O 0.0050 0.0002 -0.0020 1983 ALA 69 N 0.0043 -0.0003 -0.0015 1984 ALA 69 CA 0.0045 -0.0001 -0.0016 1985 ALA 69 C 0.0040 -0.0004 -0.0020 1986 ALA 69 O 0.0036 -0.0009 -0.0017 1987 ALA 69 CB 0.0047 -0.0002 -0.0008 1988 VAL 70 N 0.0040 -0.0002 -0.0027 1989 VAL 70 CA 0.0036 -0.0004 -0.0032 1990 VAL 70 C 0.0037 -0.0003 -0.0033 1991 VAL 70 O 0.0042 0.0002 -0.0034 1992 VAL 70 CB 0.0034 -0.0003 -0.0039 1993 VAL 70 CG1 0.0030 -0.0005 -0.0045 1994 VAL 70 CG2 0.0032 -0.0005 -0.0039 1995 VAL 71 N 0.0033 -0.0007 -0.0032 1996 VAL 71 CA 0.0033 -0.0006 -0.0033 1997 VAL 71 C 0.0029 -0.0008 -0.0040 1998 VAL 71 O 0.0024 -0.0012 -0.0040 1999 VAL 71 CB 0.0032 -0.0009 -0.0026 2000 VAL 71 CG1 0.0032 -0.0009 -0.0028 2001 VAL 71 CG2 0.0037 -0.0007 -0.0019 2002 THR 72 N 0.0031 -0.0004 -0.0045 2003 THR 72 CA 0.0027 -0.0005 -0.0052 2004 THR 72 C 0.0028 -0.0004 -0.0054 2005 THR 72 O 0.0032 0.0000 -0.0055 2006 THR 72 CB 0.0029 -0.0002 -0.0059 2007 THR 72 OG1 0.0035 0.0004 -0.0060 2008 THR 72 CG2 0.0028 -0.0002 -0.0058 2009 GLY 73 N 0.0024 -0.0007 -0.0054 2010 GLY 73 CA 0.0022 -0.0007 -0.0056 2011 GLY 73 C 0.0024 -0.0007 -0.0054 2012 GLY 73 O 0.0025 -0.0004 -0.0056 2013 VAL 74 N 0.0024 -0.0010 -0.0050 2014 VAL 74 CA 0.0025 -0.0011 -0.0048 2015 VAL 74 C 0.0021 -0.0013 -0.0050 2016 VAL 74 O 0.0017 -0.0015 -0.0051 2017 VAL 74 CB 0.0027 -0.0013 -0.0043 2018 VAL 74 CG1 0.0031 -0.0011 -0.0041 2019 VAL 74 CG2 0.0024 -0.0017 -0.0041 2020 THR 75 N 0.0021 -0.0012 -0.0050 2021 THR 75 CA 0.0017 -0.0014 -0.0052 2022 THR 75 C 0.0019 -0.0015 -0.0049 2023 THR 75 O 0.0022 -0.0012 -0.0049 2024 THR 75 CB 0.0016 -0.0011 -0.0057 2025 THR 75 OG1 0.0015 -0.0010 -0.0060 2026 THR 75 CG2 0.0012 -0.0013 -0.0059 2027 ALA 76 N 0.0015 -0.0018 -0.0048 2028 ALA 76 CA 0.0015 -0.0019 -0.0046 2029 ALA 76 C 0.0019 -0.0020 -0.0042 2030 ALA 76 O 0.0022 -0.0018 -0.0041 2031 ALA 76 CB 0.0016 -0.0017 -0.0050 2032 VAL 77 N 0.0018 -0.0023 -0.0040 2033 VAL 77 CA 0.0021 -0.0023 -0.0035 2034 VAL 77 C 0.0019 -0.0026 -0.0030 2035 VAL 77 O 0.0015 -0.0029 -0.0029 2036 VAL 77 CB 0.0022 -0.0022 -0.0034 2037 VAL 77 CG1 0.0025 -0.0022 -0.0029 2038 VAL 77 CG2 0.0024 -0.0019 -0.0039 2039 ALA 78 N 0.0022 -0.0025 -0.0026 2040 ALA 78 CA 0.0020 -0.0028 -0.0021 2041 ALA 78 C 0.0024 -0.0027 -0.0016 2042 ALA 78 O 0.0027 -0.0025 -0.0016 2043 ALA 78 CB 0.0018 -0.0028 -0.0023 2044 GLN 79 N 0.0024 -0.0029 -0.0012 2045 GLN 79 CA 0.0027 -0.0028 -0.0007 2046 GLN 79 C 0.0025 -0.0031 -0.0002 2047 GLN 79 O 0.0020 -0.0034 -0.0003 2048 GLN 79 CB 0.0030 -0.0027 -0.0005 2049 GLN 79 CG 0.0026 -0.0030 -0.0004 2050 GLN 79 CD 0.0029 -0.0028 -0.0003 2051 GLN 79 OE1 0.0033 -0.0026 -0.0003 2052 GLN 79 NE2 0.0026 -0.0031 -0.0001 2053 LYS 80 N 0.0028 -0.0031 0.0002 2054 LYS 80 CA 0.0026 -0.0034 0.0008 2055 LYS 80 C 0.0030 -0.0033 0.0012 2056 LYS 80 O 0.0034 -0.0030 0.0012 2057 LYS 80 CB 0.0026 -0.0034 0.0009 2058 LYS 80 CG 0.0024 -0.0038 0.0014 2059 LYS 80 CD 0.0024 -0.0038 0.0016 2060 LYS 80 CE 0.0021 -0.0041 0.0021 2061 LYS 80 NZ 0.0021 -0.0042 0.0023 2062 THR 81 N 0.0031 -0.0038 0.0016 2063 THR 81 CA 0.0035 -0.0038 0.0020 2064 THR 81 C 0.0033 -0.0042 0.0025 2065 THR 81 O 0.0029 -0.0044 0.0025 2066 THR 81 CB 0.0035 -0.0037 0.0018 2067 THR 81 OG1 0.0036 -0.0033 0.0013 2068 THR 81 CG2 0.0039 -0.0037 0.0022 2069 VAL 82 N 0.0037 -0.0042 0.0028 2070 VAL 82 CA 0.0036 -0.0045 0.0033 2071 VAL 82 C 0.0040 -0.0045 0.0036 2072 VAL 82 O 0.0045 -0.0043 0.0036 2073 VAL 82 CB 0.0038 -0.0046 0.0036 2074 VAL 82 CG1 0.0038 -0.0049 0.0041 2075 VAL 82 CG2 0.0034 -0.0047 0.0033 2076 GLU 83 N 0.0038 -0.0047 0.0038 2077 GLU 83 CA 0.0041 -0.0047 0.0041 2078 GLU 83 C 0.0044 -0.0044 0.0038 2079 GLU 83 O 0.0049 -0.0042 0.0039 2080 GLU 83 CB 0.0044 -0.0048 0.0046 2081 GLU 83 CG 0.0042 -0.0052 0.0049 2082 GLU 83 CD 0.0045 -0.0053 0.0054 2083 GLU 83 OE1 0.0050 -0.0051 0.0054 2084 GLU 83 OE2 0.0043 -0.0056 0.0057 2085 GLY 84 N 0.0041 -0.0043 0.0034 2086 GLY 84 CA 0.0043 -0.0040 0.0031 2087 GLY 84 C 0.0039 -0.0040 0.0027 2088 GLY 84 O 0.0035 -0.0042 0.0026 2089 ALA 85 N 0.0040 -0.0038 0.0026 2090 ALA 85 CA 0.0038 -0.0039 0.0023 2091 ALA 85 C 0.0038 -0.0035 0.0018 2092 ALA 85 O 0.0041 -0.0031 0.0018 2093 ALA 85 CB 0.0039 -0.0039 0.0025 2094 GLY 86 N 0.0034 -0.0036 0.0014 2095 GLY 86 CA 0.0034 -0.0032 0.0010 2096 GLY 86 C 0.0032 -0.0033 0.0007 2097 GLY 86 O 0.0028 -0.0036 0.0005 2098 SER 87 N 0.0034 -0.0029 0.0006 2099 SER 87 CA 0.0032 -0.0029 0.0003 2100 SER 87 C 0.0032 -0.0025 -0.0002 2101 SER 87 O 0.0035 -0.0022 -0.0002 2102 SER 87 CB 0.0034 -0.0029 0.0005 2103 SER 87 OG 0.0033 -0.0032 0.0009 2104 ILE 88 N 0.0028 -0.0026 -0.0006 2105 ILE 88 CA 0.0028 -0.0023 -0.0010 2106 ILE 88 C 0.0029 -0.0020 -0.0012 2107 ILE 88 O 0.0032 -0.0016 -0.0013 2108 ILE 88 CB 0.0025 -0.0025 -0.0013 2109 ILE 88 CG1 0.0025 -0.0027 -0.0011 2110 ILE 88 CG2 0.0024 -0.0021 -0.0018 2111 ILE 88 CD1 0.0021 -0.0029 -0.0013 2112 ALA 89 N 0.0028 -0.0017 -0.0014 2113 ALA 89 CA 0.0028 -0.0016 -0.0018 2114 ALA 89 C 0.0027 -0.0019 -0.0011 2115 ALA 89 O 0.0022 -0.0025 -0.0012 2116 ALA 89 CB 0.0024 -0.0018 -0.0027 2117 ALA 90 N 0.0031 -0.0015 -0.0005 2118 ALA 90 CA 0.0031 -0.0018 0.0002 2119 ALA 90 C 0.0034 -0.0014 0.0001 2120 ALA 90 O 0.0038 -0.0007 -0.0003 2121 ALA 90 CB 0.0033 -0.0017 0.0012 2122 ALA 91 N 0.0032 -0.0018 0.0004 2123 ALA 91 CA 0.0034 -0.0014 0.0003 2124 ALA 91 C 0.0033 -0.0018 0.0010 2125 ALA 91 O 0.0028 -0.0025 0.0011 2126 ALA 91 CB 0.0031 -0.0015 -0.0007 2127 THR 92 N 0.0037 -0.0013 0.0016 2128 THR 92 CA 0.0037 -0.0016 0.0023 2129 THR 92 C 0.0039 -0.0012 0.0021 2130 THR 92 O 0.0044 -0.0005 0.0018 2131 THR 92 CB 0.0040 -0.0014 0.0032 2132 THR 92 OG1 0.0046 -0.0007 0.0033 2133 THR 92 CG2 0.0038 -0.0018 0.0034 2134 GLY 93 N 0.0035 -0.0018 0.0024 2135 GLY 93 CA 0.0034 -0.0022 0.0020 2136 GLY 93 C 0.0032 -0.0017 0.0031 2137 GLY 93 O 0.0036 -0.0014 0.0029 2138 PHE 94 N 0.0024 -0.0015 0.0043 2139 PHE 94 CA 0.0020 -0.0010 0.0055 2140 PHE 94 C 0.0019 -0.0003 0.0067 2141 PHE 94 O 0.0014 -0.0006 0.0068 2142 PHE 94 CB 0.0008 -0.0019 0.0057 2143 PHE 94 CG 0.0009 -0.0026 0.0047 2144 PHE 94 CD1 0.0011 -0.0022 0.0049 2145 PHE 94 CD2 0.0007 -0.0035 0.0036 2146 PHE 94 CE1 0.0011 -0.0028 0.0040 2147 PHE 94 CE2 0.0007 -0.0041 0.0026 2148 PHE 94 CZ 0.0009 -0.0037 0.0029 2149 VAL 95 N 0.0023 0.0007 0.0075 2150 VAL 95 CA 0.0021 0.0014 0.0088 2151 VAL 95 C 0.0017 0.0017 0.0098 2152 VAL 95 O 0.0024 0.0022 0.0097 2153 VAL 95 CB 0.0033 0.0024 0.0088 2154 VAL 95 CG1 0.0031 0.0032 0.0102 2155 VAL 95 CG2 0.0036 0.0020 0.0079 2156 LYS 96 N 0.0007 0.0015 0.0107 2157 LYS 96 CA 0.0002 0.0018 0.0118 2158 LYS 96 C -0.0001 0.0025 0.0131 2159 LYS 96 O 0.0001 0.0027 0.0132 2160 LYS 96 CB -0.0010 0.0007 0.0117 2161 LYS 96 CG -0.0008 0.0001 0.0105 2162 LYS 96 CD -0.0002 0.0006 0.0105 2163 LYS 96 CE -0.0000 -0.0001 0.0092 2164 LYS 96 NZ -0.0012 -0.0012 0.0091 2165 LYS 97 N -0.0035 0.0040 0.0149 2166 LYS 97 CA -0.0052 0.0087 0.0169 2167 LYS 97 C -0.0105 0.0084 0.0178 2168 LYS 97 O -0.0120 0.0055 0.0171 2169 LYS 97 CB -0.0020 0.0119 0.0174 2170 LYS 97 CG -0.0032 0.0171 0.0194 2171 LYS 97 CD -0.0020 0.0194 0.0200 2172 LYS 97 CE -0.0033 0.0244 0.0221 2173 LYS 97 NZ -0.0003 0.0273 0.0225 2174 ASP 98 N -0.0133 0.0115 0.0195 2175 ASP 98 CA -0.0184 0.0120 0.0206 2176 ASP 98 C -0.0191 0.0172 0.0226 2177 ASP 98 O -0.0157 0.0201 0.0230 2178 ASP 98 CB -0.0219 0.0092 0.0203 2179 ASP 98 CG -0.0270 0.0082 0.0210 2180 ASP 98 OD1 -0.0278 0.0098 0.0217 2181 ASP 98 OD2 -0.0301 0.0059 0.0208 2182 GLN 99 N -0.0236 0.0184 0.0239 2183 GLN 99 CA -0.0248 0.0233 0.0259 2184 GLN 99 C -0.0247 0.0256 0.0266 2185 GLN 99 O -0.0224 0.0294 0.0275 2186 GLN 99 CB -0.0299 0.0236 0.0270 2187 GLN 99 CG -0.0315 0.0286 0.0290 2188 GLN 99 CD -0.0365 0.0288 0.0300 2189 GLN 99 OE1 -0.0389 0.0251 0.0292 2190 GLN 99 NE2 -0.0381 0.0330 0.0318 2191 VAL 37 N 0.0050 0.0272 0.0120 2192 VAL 37 CA 0.0056 0.0255 0.0113 2193 VAL 37 C 0.0029 0.0243 0.0113 2194 VAL 37 O 0.0026 0.0234 0.0111 2195 VAL 37 CB 0.0073 0.0270 0.0116 2196 VAL 37 CG1 0.0102 0.0274 0.0113 2197 VAL 37 CG2 0.0061 0.0297 0.0126 2198 LEU 38 N 0.0009 0.0241 0.0116 2199 LEU 38 CA -0.0018 0.0230 0.0116 2200 LEU 38 C -0.0018 0.0201 0.0107 2201 LEU 38 O -0.0030 0.0190 0.0105 2202 LEU 38 CB -0.0038 0.0237 0.0121 2203 LEU 38 CG -0.0054 0.0262 0.0132 2204 LEU 38 CD1 -0.0075 0.0262 0.0135 2205 LEU 38 CD2 -0.0035 0.0287 0.0137 2206 TYR 39 N -0.0005 0.0186 0.0100 2207 TYR 39 CA -0.0001 0.0158 0.0090 2208 TYR 39 C -0.0029 0.0142 0.0089 2209 TYR 39 O -0.0035 0.0129 0.0086 2210 TYR 39 CB 0.0018 0.0151 0.0085 2211 TYR 39 CG 0.0047 0.0160 0.0084 2212 TYR 39 CD1 0.0065 0.0146 0.0077 2213 TYR 39 CD2 0.0058 0.0182 0.0090 2214 TYR 39 CE1 0.0092 0.0154 0.0075 2215 TYR 39 CE2 0.0085 0.0191 0.0088 2216 TYR 39 CZ 0.0102 0.0177 0.0081 2217 TYR 39 OH 0.0128 0.0185 0.0080 2218 VAL 40 N -0.0045 0.0144 0.0092 2219 VAL 40 CA -0.0071 0.0130 0.0092 2220 VAL 40 C -0.0067 0.0101 0.0081 2221 VAL 40 O -0.0081 0.0083 0.0078 2222 VAL 40 CB -0.0090 0.0142 0.0098 2223 VAL 40 CG1 -0.0117 0.0126 0.0097 2224 VAL 40 CG2 -0.0094 0.0170 0.0108 2225 GLY 41 N -0.0029 0.0080 0.0077 2226 GLY 41 CA -0.0024 0.0063 0.0068 2227 GLY 41 C -0.0004 0.0059 0.0060 2228 GLY 41 O 0.0006 0.0054 0.0055 2229 SER 42 N 0.0002 0.0062 0.0060 2230 SER 42 CA 0.0022 0.0063 0.0054 2231 SER 42 C 0.0030 0.0045 0.0044 2232 SER 42 O 0.0046 0.0045 0.0039 2233 SER 42 CB 0.0024 0.0069 0.0056 2234 SER 42 OG 0.0043 0.0069 0.0050 2235 LYS 43 N 0.0018 0.0030 0.0040 2236 LYS 43 CA 0.0022 0.0012 0.0031 2237 LYS 43 C 0.0004 -0.0000 0.0031 2238 LYS 43 O -0.0005 -0.0003 0.0032 2239 LYS 43 CB 0.0037 0.0005 0.0023 2240 LYS 43 CG 0.0044 -0.0013 0.0014 2241 LYS 43 CD 0.0059 -0.0019 0.0006 2242 LYS 43 CE 0.0066 -0.0036 -0.0004 2243 LYS 43 NZ 0.0051 -0.0052 -0.0006 2244 THR 44 N -0.0002 -0.0008 0.0029 2245 THR 44 CA -0.0018 -0.0022 0.0028 2246 THR 44 C -0.0012 -0.0038 0.0019 2247 THR 44 O 0.0002 -0.0036 0.0015 2248 THR 44 CB -0.0035 -0.0015 0.0036 2249 THR 44 OG1 -0.0029 -0.0012 0.0036 2250 THR 44 CG2 -0.0041 0.0002 0.0045 2251 LYS 45 N -0.0010 -0.0040 0.0013 2252 LYS 45 CA -0.0008 -0.0041 0.0005 2253 LYS 45 C -0.0014 -0.0045 0.0005 2254 LYS 45 O -0.0020 -0.0049 0.0003 2255 LYS 45 CB -0.0008 -0.0043 -0.0001 2256 LYS 45 CG -0.0005 -0.0043 -0.0010 2257 LYS 45 CD -0.0004 -0.0044 -0.0016 2258 LYS 45 CE -0.0000 -0.0044 -0.0024 2259 LYS 45 NZ 0.0001 -0.0045 -0.0030 2260 GLU 46 N -0.0012 -0.0043 0.0007 2261 GLU 46 CA -0.0018 -0.0046 0.0008 2262 GLU 46 C -0.0015 -0.0045 0.0005 2263 GLU 46 O -0.0010 -0.0042 0.0007 2264 GLU 46 CB -0.0021 -0.0045 0.0017 2265 GLU 46 CG -0.0015 -0.0040 0.0023 2266 GLU 46 CD -0.0018 -0.0040 0.0032 2267 GLU 46 OE1 -0.0025 -0.0043 0.0033 2268 GLU 46 OE2 -0.0014 -0.0036 0.0037 2269 GLY 47 N -0.0019 -0.0049 -0.0000 2270 GLY 47 CA -0.0017 -0.0049 -0.0004 2271 GLY 47 C -0.0011 -0.0047 -0.0012 2272 GLY 47 O -0.0006 -0.0045 -0.0013 2273 VAL 48 N -0.0012 -0.0049 -0.0017 2274 VAL 48 CA -0.0007 -0.0048 -0.0023 2275 VAL 48 C -0.0010 -0.0052 -0.0031 2276 VAL 48 O -0.0016 -0.0056 -0.0032 2277 VAL 48 CB -0.0005 -0.0046 -0.0021 2278 VAL 48 CG1 0.0000 -0.0045 -0.0028 2279 VAL 48 CG2 -0.0002 -0.0042 -0.0013 2280 VAL 49 N 0.0002 -0.0040 -0.0036 2281 VAL 49 CA 0.0000 -0.0039 -0.0039 2282 VAL 49 C -0.0001 -0.0037 -0.0043 2283 VAL 49 O 0.0001 -0.0034 -0.0043 2284 VAL 49 CB 0.0002 -0.0036 -0.0039 2285 VAL 49 CG1 0.0000 -0.0035 -0.0043 2286 VAL 49 CG2 0.0003 -0.0039 -0.0036 2287 HIS 50 N -0.0004 -0.0038 -0.0046 2288 HIS 50 CA -0.0005 -0.0036 -0.0049 2289 HIS 50 C -0.0008 -0.0036 -0.0053 2290 HIS 50 O -0.0011 -0.0039 -0.0053 2291 HIS 50 CB -0.0006 -0.0037 -0.0048 2292 HIS 50 CG -0.0009 -0.0041 -0.0048 2293 HIS 50 ND1 -0.0012 -0.0042 -0.0051 2294 HIS 50 CD2 -0.0009 -0.0045 -0.0045 2295 HIS 50 CE1 -0.0014 -0.0046 -0.0050 2296 HIS 50 NE2 -0.0012 -0.0047 -0.0046 2297 GLY 51 N -0.0008 -0.0032 -0.0056 2298 GLY 51 CA -0.0011 -0.0032 -0.0060 2299 GLY 51 C -0.0011 -0.0032 -0.0060 2300 GLY 51 O -0.0013 -0.0034 -0.0061 2301 VAL 52 N -0.0008 -0.0029 -0.0060 2302 VAL 52 CA -0.0008 -0.0028 -0.0061 2303 VAL 52 C -0.0008 -0.0024 -0.0064 2304 VAL 52 O -0.0006 -0.0021 -0.0064 2305 VAL 52 CB -0.0005 -0.0028 -0.0057 2306 VAL 52 CG1 -0.0005 -0.0027 -0.0057 2307 VAL 52 CG2 -0.0005 -0.0032 -0.0053 2308 ALA 53 N -0.0006 -0.0012 -0.0063 2309 ALA 53 CA -0.0007 -0.0008 -0.0065 2310 ALA 53 C -0.0005 -0.0005 -0.0066 2311 ALA 53 O -0.0005 -0.0006 -0.0066 2312 ALA 53 CB -0.0012 -0.0007 -0.0065 2313 THR 54 N -0.0003 -0.0002 -0.0067 2314 THR 54 CA 0.0000 0.0000 -0.0068 2315 THR 54 C 0.0000 0.0005 -0.0069 2316 THR 54 O 0.0001 0.0005 -0.0069 2317 THR 54 CB 0.0005 -0.0001 -0.0068 2318 THR 54 OG1 0.0005 -0.0005 -0.0066 2319 THR 54 CG2 0.0008 0.0002 -0.0069 2320 VAL 55 N -0.0001 0.0008 -0.0070 2321 VAL 55 CA -0.0001 0.0012 -0.0071 2322 VAL 55 C 0.0002 0.0014 -0.0072 2323 VAL 55 O 0.0002 0.0014 -0.0072 2324 VAL 55 CB -0.0005 0.0014 -0.0072 2325 VAL 55 CG1 -0.0005 0.0018 -0.0073 2326 VAL 55 CG2 -0.0008 0.0011 -0.0071 2327 ALA 56 N 0.0005 0.0017 -0.0073 2328 ALA 56 CA 0.0008 0.0019 -0.0074 2329 ALA 56 C 0.0008 0.0023 -0.0075 2330 ALA 56 O 0.0010 0.0024 -0.0076 2331 ALA 56 CB 0.0012 0.0017 -0.0074 2332 GLU 57 N 0.0000 0.0023 -0.0072 2333 GLU 57 CA 0.0001 0.0023 -0.0077 2334 GLU 57 C -0.0001 0.0023 -0.0080 2335 GLU 57 O -0.0005 0.0024 -0.0081 2336 GLU 57 CB 0.0000 0.0023 -0.0077 2337 GLU 57 CG 0.0003 0.0022 -0.0074 2338 GLU 57 CD 0.0001 0.0023 -0.0075 2339 GLU 57 OE1 -0.0002 0.0024 -0.0078 2340 GLU 57 OE2 0.0003 0.0022 -0.0073 2341 LYS 58 N 0.0002 0.0022 -0.0083 2342 LYS 58 CA 0.0000 0.0022 -0.0086 2343 LYS 58 C 0.0003 0.0021 -0.0090 2344 LYS 58 O 0.0007 0.0020 -0.0091 2345 LYS 58 CB 0.0001 0.0022 -0.0084 2346 LYS 58 CG -0.0002 0.0023 -0.0079 2347 LYS 58 CD -0.0001 0.0023 -0.0078 2348 LYS 58 CE -0.0004 0.0025 -0.0073 2349 LYS 58 NZ -0.0003 0.0025 -0.0072 2350 THR 59 N 0.0000 0.0021 -0.0094 2351 THR 59 CA 0.0002 0.0020 -0.0099 2352 THR 59 C 0.0003 0.0020 -0.0101 2353 THR 59 O 0.0007 0.0018 -0.0103 2354 THR 59 CB -0.0001 0.0021 -0.0102 2355 THR 59 OG1 -0.0002 0.0022 -0.0099 2356 THR 59 CG2 0.0001 0.0020 -0.0106 2357 LYS 60 N 0.0001 0.0021 -0.0100 2358 LYS 60 CA 0.0002 0.0020 -0.0102 2359 LYS 60 C 0.0000 0.0021 -0.0099 2360 LYS 60 O -0.0004 0.0022 -0.0099 2361 LYS 60 CB 0.0000 0.0020 -0.0107 2362 LYS 60 CG 0.0002 0.0019 -0.0110 2363 LYS 60 CD 0.0000 0.0019 -0.0115 2364 LYS 60 CE 0.0002 0.0019 -0.0118 2365 LYS 60 NZ 0.0001 0.0019 -0.0123 2366 GLU 61 N 0.0005 0.0009 -0.0098 2367 GLU 61 CA 0.0004 0.0008 -0.0092 2368 GLU 61 C 0.0008 0.0009 -0.0090 2369 GLU 61 O 0.0013 0.0011 -0.0090 2370 GLU 61 CB 0.0005 0.0007 -0.0087 2371 GLU 61 CG 0.0005 0.0006 -0.0081 2372 GLU 61 CD 0.0006 0.0005 -0.0076 2373 GLU 61 OE1 0.0007 0.0006 -0.0079 2374 GLU 61 OE2 0.0005 0.0004 -0.0071 2375 GLN 62 N 0.0006 0.0008 -0.0089 2376 GLN 62 CA 0.0009 0.0009 -0.0088 2377 GLN 62 C 0.0007 0.0007 -0.0082 2378 GLN 62 O 0.0003 0.0005 -0.0081 2379 GLN 62 CB 0.0008 0.0010 -0.0093 2380 GLN 62 CG 0.0011 0.0011 -0.0093 2381 GLN 62 CD 0.0010 0.0012 -0.0098 2382 GLN 62 OE1 0.0007 0.0011 -0.0102 2383 GLN 62 NE2 0.0013 0.0013 -0.0098 2384 VAL 63 N 0.0012 0.0008 -0.0078 2385 VAL 63 CA 0.0011 0.0007 -0.0072 2386 VAL 63 C 0.0016 0.0008 -0.0071 2387 VAL 63 O 0.0021 0.0010 -0.0069 2388 VAL 63 CB 0.0012 0.0006 -0.0066 2389 VAL 63 CG1 0.0011 0.0005 -0.0060 2390 VAL 63 CG2 0.0008 0.0004 -0.0067 2391 THR 64 N 0.0014 0.0008 -0.0072 2392 THR 64 CA 0.0018 0.0009 -0.0071 2393 THR 64 C 0.0015 0.0008 -0.0067 2394 THR 64 O 0.0011 0.0006 -0.0068 2395 THR 64 CB 0.0018 0.0011 -0.0077 2396 THR 64 OG1 0.0013 0.0009 -0.0079 2397 THR 64 CG2 0.0020 0.0012 -0.0082 2398 ASN 65 N 0.0015 -0.0012 -0.0062 2399 ASN 65 CA 0.0012 -0.0016 -0.0054 2400 ASN 65 C 0.0019 -0.0012 -0.0049 2401 ASN 65 O 0.0026 -0.0007 -0.0051 2402 ASN 65 CB 0.0009 -0.0020 -0.0046 2403 ASN 65 CG 0.0016 -0.0017 -0.0039 2404 ASN 65 OD1 0.0023 -0.0012 -0.0037 2405 ASN 65 ND2 0.0014 -0.0020 -0.0035 2406 VAL 66 N 0.0016 -0.0015 -0.0044 2407 VAL 66 CA 0.0022 -0.0013 -0.0038 2408 VAL 66 C 0.0020 -0.0017 -0.0028 2409 VAL 66 O 0.0013 -0.0022 -0.0026 2410 VAL 66 CB 0.0022 -0.0012 -0.0042 2411 VAL 66 CG1 0.0023 -0.0009 -0.0053 2412 VAL 66 CG2 0.0016 -0.0017 -0.0039 2413 GLY 67 N 0.0026 -0.0014 -0.0021 2414 GLY 67 CA 0.0025 -0.0017 -0.0010 2415 GLY 67 C 0.0021 -0.0021 -0.0007 2416 GLY 67 O 0.0020 -0.0024 0.0002 2417 GLY 68 N 0.0018 -0.0022 -0.0013 2418 GLY 68 CA 0.0013 -0.0026 -0.0010 2419 GLY 68 C 0.0016 -0.0024 -0.0013 2420 GLY 68 O 0.0022 -0.0018 -0.0017 2421 ALA 69 N 0.0019 -0.0021 -0.0013 2422 ALA 69 CA 0.0021 -0.0019 -0.0014 2423 ALA 69 C 0.0017 -0.0022 -0.0019 2424 ALA 69 O 0.0013 -0.0026 -0.0016 2425 ALA 69 CB 0.0023 -0.0019 -0.0007 2426 VAL 70 N 0.0018 -0.0020 -0.0026 2427 VAL 70 CA 0.0014 -0.0022 -0.0031 2428 VAL 70 C 0.0016 -0.0020 -0.0032 2429 VAL 70 O 0.0021 -0.0016 -0.0033 2430 VAL 70 CB 0.0013 -0.0022 -0.0038 2431 VAL 70 CG1 0.0009 -0.0024 -0.0044 2432 VAL 70 CG2 0.0010 -0.0025 -0.0037 2433 VAL 71 N 0.0012 -0.0024 -0.0031 2434 VAL 71 CA 0.0014 -0.0023 -0.0032 2435 VAL 71 C 0.0010 -0.0025 -0.0040 2436 VAL 71 O 0.0005 -0.0029 -0.0040 2437 VAL 71 CB 0.0012 -0.0025 -0.0026 2438 VAL 71 CG1 0.0013 -0.0024 -0.0028 2439 VAL 71 CG2 0.0016 -0.0023 -0.0019 2440 THR 72 N 0.0012 -0.0021 -0.0045 2441 THR 72 CA 0.0009 -0.0023 -0.0052 2442 THR 72 C 0.0010 -0.0022 -0.0054 2443 THR 72 O 0.0015 -0.0017 -0.0055 2444 THR 72 CB 0.0011 -0.0020 -0.0059 2445 THR 72 OG1 0.0017 -0.0015 -0.0060 2446 THR 72 CG2 0.0010 -0.0021 -0.0058 2447 GLY 73 N 0.0010 -0.0019 -0.0053 2448 GLY 73 CA 0.0009 -0.0019 -0.0055 2449 GLY 73 C 0.0010 -0.0019 -0.0053 2450 GLY 73 O 0.0012 -0.0016 -0.0055 2451 VAL 74 N 0.0010 -0.0021 -0.0050 2452 VAL 74 CA 0.0011 -0.0021 -0.0048 2453 VAL 74 C 0.0008 -0.0023 -0.0049 2454 VAL 74 O 0.0005 -0.0025 -0.0050 2455 VAL 74 CB 0.0013 -0.0022 -0.0043 2456 VAL 74 CG1 0.0015 -0.0021 -0.0042 2457 VAL 74 CG2 0.0010 -0.0026 -0.0041 2458 THR 75 N 0.0009 -0.0022 -0.0049 2459 THR 75 CA 0.0006 -0.0023 -0.0051 2460 THR 75 C 0.0007 -0.0023 -0.0049 2461 THR 75 O 0.0011 -0.0021 -0.0048 2462 THR 75 CB 0.0006 -0.0021 -0.0056 2463 THR 75 OG1 0.0005 -0.0021 -0.0058 2464 THR 75 CG2 0.0002 -0.0022 -0.0058 2465 ALA 76 N 0.0005 -0.0026 -0.0048 2466 ALA 76 CA 0.0005 -0.0027 -0.0046 2467 ALA 76 C 0.0008 -0.0026 -0.0042 2468 ALA 76 O 0.0011 -0.0025 -0.0041 2469 ALA 76 CB 0.0006 -0.0024 -0.0049 2470 VAL 77 N 0.0003 -0.0032 -0.0039 2471 VAL 77 CA 0.0006 -0.0032 -0.0034 2472 VAL 77 C 0.0004 -0.0034 -0.0029 2473 VAL 77 O -0.0001 -0.0037 -0.0029 2474 VAL 77 CB 0.0007 -0.0032 -0.0034 2475 VAL 77 CG1 0.0010 -0.0031 -0.0029 2476 VAL 77 CG2 0.0009 -0.0029 -0.0040 2477 ALA 78 N 0.0007 -0.0034 -0.0025 2478 ALA 78 CA 0.0005 -0.0036 -0.0021 2479 ALA 78 C 0.0009 -0.0035 -0.0015 2480 ALA 78 O 0.0013 -0.0033 -0.0015 2481 ALA 78 CB 0.0003 -0.0037 -0.0022 2482 GLN 79 N 0.0008 -0.0037 -0.0011 2483 GLN 79 CA 0.0012 -0.0036 -0.0006 2484 GLN 79 C 0.0009 -0.0039 -0.0001 2485 GLN 79 O 0.0005 -0.0042 -0.0002 2486 GLN 79 CB 0.0014 -0.0035 -0.0005 2487 GLN 79 CG 0.0010 -0.0038 -0.0004 2488 GLN 79 CD 0.0012 -0.0037 -0.0003 2489 GLN 79 OE1 0.0017 -0.0034 -0.0003 2490 GLN 79 NE2 0.0009 -0.0039 -0.0001 2491 LYS 80 N 0.0012 -0.0039 0.0003 2492 LYS 80 CA 0.0011 -0.0041 0.0009 2493 LYS 80 C 0.0014 -0.0040 0.0013 2494 LYS 80 O 0.0019 -0.0038 0.0012 2495 LYS 80 CB 0.0011 -0.0042 0.0011 2496 LYS 80 CG 0.0008 -0.0045 0.0016 2497 LYS 80 CD 0.0008 -0.0045 0.0018 2498 LYS 80 CE 0.0006 -0.0048 0.0023 2499 LYS 80 NZ 0.0006 -0.0049 0.0025 2500 THR 81 N 0.0015 -0.0046 0.0016 2501 THR 81 CA 0.0019 -0.0046 0.0020 2502 THR 81 C 0.0018 -0.0049 0.0025 2503 THR 81 O 0.0014 -0.0052 0.0026 2504 THR 81 CB 0.0019 -0.0045 0.0019 2505 THR 81 OG1 0.0021 -0.0042 0.0014 2506 THR 81 CG2 0.0023 -0.0045 0.0023 2507 VAL 82 N 0.0021 -0.0050 0.0029 2508 VAL 82 CA 0.0021 -0.0053 0.0034 2509 VAL 82 C 0.0024 -0.0052 0.0036 2510 VAL 82 O 0.0028 -0.0050 0.0037 2511 VAL 82 CB 0.0022 -0.0053 0.0036 2512 VAL 82 CG1 0.0022 -0.0056 0.0041 2513 VAL 82 CG2 0.0018 -0.0054 0.0033 2514 GLU 83 N 0.0022 -0.0055 0.0039 2515 GLU 83 CA 0.0024 -0.0055 0.0042 2516 GLU 83 C 0.0027 -0.0052 0.0039 2517 GLU 83 O 0.0032 -0.0050 0.0040 2518 GLU 83 CB 0.0028 -0.0056 0.0046 2519 GLU 83 CG 0.0025 -0.0059 0.0050 2520 GLU 83 CD 0.0028 -0.0060 0.0055 2521 GLU 83 OE1 0.0033 -0.0058 0.0055 2522 GLU 83 OE2 0.0026 -0.0063 0.0058 2523 GLY 84 N 0.0025 -0.0051 0.0035 2524 GLY 84 CA 0.0027 -0.0048 0.0032 2525 GLY 84 C 0.0023 -0.0048 0.0028 2526 GLY 84 O 0.0018 -0.0050 0.0027 2527 ALA 85 N 0.0024 -0.0048 0.0027 2528 ALA 85 CA 0.0022 -0.0049 0.0024 2529 ALA 85 C 0.0022 -0.0046 0.0020 2530 ALA 85 O 0.0025 -0.0042 0.0019 2531 ALA 85 CB 0.0023 -0.0050 0.0027 2532 GLY 86 N 0.0019 -0.0047 0.0016 2533 GLY 86 CA 0.0019 -0.0044 0.0011 2534 GLY 86 C 0.0017 -0.0044 0.0008 2535 GLY 86 O 0.0013 -0.0047 0.0006 2536 SER 87 N 0.0019 -0.0042 0.0007 2537 SER 87 CA 0.0017 -0.0042 0.0004 2538 SER 87 C 0.0017 -0.0038 -0.0001 2539 SER 87 O 0.0020 -0.0034 -0.0001 2540 SER 87 CB 0.0019 -0.0041 0.0006 2541 SER 87 OG 0.0018 -0.0045 0.0010 2542 ILE 88 N 0.0014 -0.0039 -0.0005 2543 ILE 88 CA 0.0015 -0.0036 -0.0009 2544 ILE 88 C 0.0015 -0.0033 -0.0012 2545 ILE 88 O 0.0018 -0.0029 -0.0013 2546 ILE 88 CB 0.0011 -0.0038 -0.0013 2547 ILE 88 CG1 0.0012 -0.0039 -0.0010 2548 ILE 88 CG2 0.0011 -0.0034 -0.0018 2549 ILE 88 CD1 0.0008 -0.0041 -0.0013 2550 ALA 89 N 0.0015 -0.0036 -0.0015 2551 ALA 89 CA 0.0015 -0.0036 -0.0018 2552 ALA 89 C 0.0012 -0.0039 -0.0011 2553 ALA 89 O 0.0008 -0.0045 -0.0012 2554 ALA 89 CB 0.0012 -0.0039 -0.0026 2555 ALA 90 N 0.0015 -0.0036 -0.0005 2556 ALA 90 CA 0.0014 -0.0038 0.0002 2557 ALA 90 C 0.0015 -0.0035 0.0001 2558 ALA 90 O 0.0019 -0.0030 -0.0002 2559 ALA 90 CB 0.0015 -0.0036 0.0010 2560 ALA 91 N 0.0013 -0.0039 0.0004 2561 ALA 91 CA 0.0014 -0.0037 0.0003 2562 ALA 91 C 0.0012 -0.0041 0.0011 2563 ALA 91 O 0.0008 -0.0047 0.0011 2564 ALA 91 CB 0.0013 -0.0039 -0.0005 2565 THR 92 N 0.0015 -0.0036 0.0016 2566 THR 92 CA 0.0014 -0.0039 0.0023 2567 THR 92 C 0.0015 -0.0036 0.0022 2568 THR 92 O 0.0019 -0.0031 0.0019 2569 THR 92 CB 0.0015 -0.0037 0.0031 2570 THR 92 OG1 0.0020 -0.0029 0.0032 2571 THR 92 CG2 0.0014 -0.0038 0.0032 2572 GLY 93 N 0.0008 -0.0049 0.0027 2573 GLY 93 CA 0.0005 -0.0054 0.0025 2574 GLY 93 C 0.0000 -0.0048 0.0037 2575 GLY 93 O 0.0003 -0.0045 0.0036 2576 PHE 94 N -0.0007 -0.0045 0.0048 2577 PHE 94 CA -0.0013 -0.0039 0.0060 2578 PHE 94 C -0.0014 -0.0030 0.0070 2579 PHE 94 O -0.0017 -0.0034 0.0070 2580 PHE 94 CB -0.0026 -0.0050 0.0064 2581 PHE 94 CG -0.0026 -0.0058 0.0056 2582 PHE 94 CD1 -0.0026 -0.0054 0.0059 2583 PHE 94 CD2 -0.0026 -0.0069 0.0045 2584 PHE 94 CE1 -0.0026 -0.0062 0.0052 2585 PHE 94 CE2 -0.0026 -0.0077 0.0038 2586 PHE 94 CZ -0.0026 -0.0073 0.0041 2587 VAL 95 N -0.0012 -0.0019 0.0078 2588 VAL 95 CA -0.0014 -0.0010 0.0090 2589 VAL 95 C -0.0020 -0.0006 0.0101 2590 VAL 95 O -0.0016 -0.0000 0.0101 2591 VAL 95 CB -0.0003 0.0001 0.0088 2592 VAL 95 CG1 -0.0005 0.0011 0.0101 2593 VAL 95 CG2 0.0003 -0.0002 0.0078 2594 LYS 96 N -0.0031 -0.0008 0.0111 2595 LYS 96 CA -0.0038 -0.0005 0.0122 2596 LYS 96 C -0.0041 0.0004 0.0134 2597 LYS 96 O -0.0038 0.0007 0.0133 2598 LYS 96 CB -0.0050 -0.0017 0.0123 2599 LYS 96 CG -0.0048 -0.0026 0.0113 2600 LYS 96 CD -0.0045 -0.0020 0.0114 2601 LYS 96 CE -0.0043 -0.0029 0.0103 2602 LYS 96 NZ -0.0054 -0.0041 0.0104 2603 LYS 97 N -0.0082 0.0021 0.0155 2604 LYS 97 CA -0.0099 0.0071 0.0175 2605 LYS 97 C -0.0155 0.0069 0.0185 2606 LYS 97 O -0.0171 0.0038 0.0178 2607 LYS 97 CB -0.0066 0.0105 0.0180 2608 LYS 97 CG -0.0078 0.0159 0.0200 2609 LYS 97 CD -0.0065 0.0183 0.0205 2610 LYS 97 CE -0.0078 0.0236 0.0226 2611 LYS 97 NZ -0.0047 0.0266 0.0229 2612 ASP 98 N -0.0184 0.0101 0.0202 2613 ASP 98 CA -0.0236 0.0107 0.0214 2614 ASP 98 C -0.0244 0.0162 0.0233 2615 ASP 98 O -0.0208 0.0193 0.0236 2616 ASP 98 CB -0.0273 0.0079 0.0211 2617 ASP 98 CG -0.0326 0.0069 0.0219 2618 ASP 98 OD1 -0.0336 0.0086 0.0226 2619 ASP 98 OD2 -0.0358 0.0044 0.0217 2620 GLN 99 N -0.0290 0.0176 0.0247 2621 GLN 99 CA -0.0303 0.0227 0.0266 2622 GLN 99 C -0.0300 0.0251 0.0274 2623 GLN 99 O -0.0276 0.0291 0.0282 2624 GLN 99 CB -0.0356 0.0231 0.0278 2625 GLN 99 CG -0.0372 0.0283 0.0299 2626 GLN 99 CD -0.0425 0.0286 0.0310 2627 GLN 99 OE1 -0.0451 0.0248 0.0302 2628 GLN 99 NE2 -0.0441 0.0331 0.0328 2629 VAL 37 N -0.0046 -0.0248 0.0107 2630 VAL 37 CA -0.0052 -0.0231 0.0100 2631 VAL 37 C -0.0027 -0.0220 0.0101 2632 VAL 37 O -0.0024 -0.0211 0.0099 2633 VAL 37 CB -0.0067 -0.0245 0.0102 2634 VAL 37 CG1 -0.0094 -0.0250 0.0099 2635 VAL 37 CG2 -0.0056 -0.0269 0.0112 2636 LEU 38 N -0.0009 -0.0218 0.0104 2637 LEU 38 CA 0.0016 -0.0208 0.0104 2638 LEU 38 C 0.0016 -0.0180 0.0095 2639 LEU 38 O 0.0027 -0.0171 0.0094 2640 LEU 38 CB 0.0034 -0.0214 0.0110 2641 LEU 38 CG 0.0049 -0.0237 0.0120 2642 LEU 38 CD1 0.0069 -0.0237 0.0123 2643 LEU 38 CD2 0.0032 -0.0260 0.0125 2644 TYR 39 N 0.0004 -0.0168 0.0089 2645 TYR 39 CA 0.0000 -0.0142 0.0080 2646 TYR 39 C 0.0025 -0.0127 0.0079 2647 TYR 39 O 0.0031 -0.0114 0.0076 2648 TYR 39 CB -0.0017 -0.0135 0.0074 2649 TYR 39 CG -0.0044 -0.0144 0.0073 2650 TYR 39 CD1 -0.0061 -0.0132 0.0066 2651 TYR 39 CD2 -0.0054 -0.0165 0.0078 2652 TYR 39 CE1 -0.0085 -0.0140 0.0064 2653 TYR 39 CE2 -0.0078 -0.0173 0.0076 2654 TYR 39 CZ -0.0094 -0.0160 0.0069 2655 TYR 39 OH -0.0119 -0.0169 0.0068 2656 VAL 40 N 0.0040 -0.0129 0.0083 2657 VAL 40 CA 0.0064 -0.0115 0.0082 2658 VAL 40 C 0.0060 -0.0089 0.0073 2659 VAL 40 O 0.0072 -0.0072 0.0069 2660 VAL 40 CB 0.0081 -0.0127 0.0089 2661 VAL 40 CG1 0.0106 -0.0112 0.0088 2662 VAL 40 CG2 0.0085 -0.0153 0.0098 2663 GLY 41 N 0.0024 -0.0071 0.0068 2664 GLY 41 CA 0.0020 -0.0055 0.0059 2665 GLY 41 C 0.0001 -0.0052 0.0052 2666 GLY 41 O -0.0008 -0.0048 0.0046 2667 SER 42 N -0.0004 -0.0055 0.0051 2668 SER 42 CA -0.0022 -0.0056 0.0045 2669 SER 42 C -0.0029 -0.0039 0.0035 2670 SER 42 O -0.0044 -0.0040 0.0030 2671 SER 42 CB -0.0024 -0.0060 0.0047 2672 SER 42 OG -0.0041 -0.0061 0.0041 2673 LYS 43 N -0.0019 -0.0025 0.0032 2674 LYS 43 CA -0.0023 -0.0009 0.0023 2675 LYS 43 C -0.0006 0.0003 0.0024 2676 LYS 43 O 0.0002 0.0006 0.0025 2677 LYS 43 CB -0.0036 -0.0002 0.0016 2678 LYS 43 CG -0.0042 0.0014 0.0006 2679 LYS 43 CD -0.0056 0.0020 -0.0001 2680 LYS 43 CE -0.0063 0.0035 -0.0010 2681 LYS 43 NZ -0.0050 0.0050 -0.0013 2682 THR 44 N -0.0000 0.0010 0.0022 2683 THR 44 CA 0.0014 0.0023 0.0021 2684 THR 44 C 0.0008 0.0038 0.0012 2685 THR 44 O -0.0004 0.0035 0.0009 2686 THR 44 CB 0.0029 0.0017 0.0029 2687 THR 44 OG1 0.0024 0.0013 0.0029 2688 THR 44 CG2 0.0035 0.0002 0.0038 2689 LYS 45 N 0.0007 0.0039 0.0007 2690 LYS 45 CA 0.0005 0.0040 -0.0001 2691 LYS 45 C 0.0010 0.0043 -0.0001 2692 LYS 45 O 0.0016 0.0048 -0.0003 2693 LYS 45 CB 0.0005 0.0041 -0.0008 2694 LYS 45 CG 0.0002 0.0041 -0.0016 2695 LYS 45 CD 0.0001 0.0042 -0.0022 2696 LYS 45 CE -0.0003 0.0042 -0.0030 2697 LYS 45 NZ -0.0004 0.0043 -0.0037 2698 GLU 46 N 0.0008 0.0042 0.0001 2699 GLU 46 CA 0.0013 0.0045 0.0003 2700 GLU 46 C 0.0010 0.0044 -0.0000 2701 GLU 46 O 0.0005 0.0040 0.0002 2702 GLU 46 CB 0.0016 0.0044 0.0012 2703 GLU 46 CG 0.0010 0.0039 0.0018 2704 GLU 46 CD 0.0013 0.0039 0.0026 2705 GLU 46 OE1 0.0019 0.0043 0.0027 2706 GLU 46 OE2 0.0009 0.0036 0.0032 2707 GLY 47 N 0.0014 0.0047 -0.0005 2708 GLY 47 CA 0.0012 0.0046 -0.0009 2709 GLY 47 C 0.0007 0.0045 -0.0017 2710 GLY 47 O 0.0002 0.0042 -0.0018 2711 VAL 48 N 0.0008 0.0047 -0.0022 2712 VAL 48 CA 0.0003 0.0045 -0.0028 2713 VAL 48 C 0.0006 0.0049 -0.0036 2714 VAL 48 O 0.0012 0.0053 -0.0037 2715 VAL 48 CB 0.0001 0.0044 -0.0027 2716 VAL 48 CG1 -0.0004 0.0042 -0.0034 2717 VAL 48 CG2 -0.0002 0.0040 -0.0019 2718 VAL 49 N -0.0007 0.0034 -0.0043 2719 VAL 49 CA -0.0005 0.0034 -0.0046 2720 VAL 49 C -0.0004 0.0031 -0.0050 2721 VAL 49 O -0.0006 0.0028 -0.0050 2722 VAL 49 CB -0.0007 0.0031 -0.0045 2723 VAL 49 CG1 -0.0006 0.0029 -0.0049 2724 VAL 49 CG2 -0.0008 0.0034 -0.0042 2725 HIS 50 N -0.0001 0.0033 -0.0053 2726 HIS 50 CA 0.0000 0.0030 -0.0057 2727 HIS 50 C 0.0003 0.0031 -0.0061 2728 HIS 50 O 0.0005 0.0034 -0.0061 2729 HIS 50 CB 0.0001 0.0031 -0.0057 2730 HIS 50 CG 0.0003 0.0036 -0.0057 2731 HIS 50 ND1 0.0006 0.0037 -0.0061 2732 HIS 50 CD2 0.0003 0.0039 -0.0054 2733 HIS 50 CE1 0.0008 0.0041 -0.0060 2734 HIS 50 NE2 0.0006 0.0043 -0.0056 2735 GLY 51 N 0.0003 0.0027 -0.0064 2736 GLY 51 CA 0.0006 0.0027 -0.0068 2737 GLY 51 C 0.0006 0.0027 -0.0068 2738 GLY 51 O 0.0008 0.0030 -0.0068 2739 VAL 52 N 0.0003 0.0023 -0.0067 2740 VAL 52 CA 0.0003 0.0023 -0.0067 2741 VAL 52 C 0.0003 0.0019 -0.0070 2742 VAL 52 O 0.0001 0.0015 -0.0070 2743 VAL 52 CB -0.0000 0.0023 -0.0062 2744 VAL 52 CG1 -0.0001 0.0022 -0.0062 2745 VAL 52 CG2 0.0000 0.0027 -0.0059 2746 ALA 53 N -0.0000 0.0007 -0.0068 2747 ALA 53 CA 0.0001 0.0004 -0.0068 2748 ALA 53 C -0.0002 0.0001 -0.0069 2749 ALA 53 O -0.0002 0.0001 -0.0069 2750 ALA 53 CB 0.0005 0.0003 -0.0068 2751 THR 54 N -0.0003 -0.0001 -0.0070 2752 THR 54 CA -0.0006 -0.0004 -0.0070 2753 THR 54 C -0.0005 -0.0008 -0.0070 2754 THR 54 O -0.0005 -0.0007 -0.0070 2755 THR 54 CB -0.0010 -0.0003 -0.0071 2756 THR 54 OG1 -0.0010 0.0001 -0.0071 2757 THR 54 CG2 -0.0013 -0.0005 -0.0072 2758 VAL 55 N -0.0005 -0.0011 -0.0071 2759 VAL 55 CA -0.0005 -0.0014 -0.0071 2760 VAL 55 C -0.0008 -0.0017 -0.0072 2761 VAL 55 O -0.0008 -0.0017 -0.0072 2762 VAL 55 CB -0.0001 -0.0016 -0.0070 2763 VAL 55 CG1 -0.0001 -0.0020 -0.0071 2764 VAL 55 CG2 0.0002 -0.0014 -0.0070 2765 ALA 56 N -0.0010 -0.0018 -0.0072 2766 ALA 56 CA -0.0013 -0.0021 -0.0073 2767 ALA 56 C -0.0013 -0.0024 -0.0073 2768 ALA 56 O -0.0013 -0.0024 -0.0073 2769 ALA 56 CB -0.0017 -0.0019 -0.0073 2770 GLU 57 N -0.0004 -0.0026 -0.0069 2771 GLU 57 CA -0.0005 -0.0025 -0.0073 2772 GLU 57 C -0.0004 -0.0025 -0.0077 2773 GLU 57 O -0.0000 -0.0027 -0.0077 2774 GLU 57 CB -0.0004 -0.0025 -0.0073 2775 GLU 57 CG -0.0007 -0.0025 -0.0070 2776 GLU 57 CD -0.0006 -0.0025 -0.0070 2777 GLU 57 OE1 -0.0003 -0.0026 -0.0072 2778 GLU 57 OE2 -0.0007 -0.0025 -0.0067 2779 LYS 58 N -0.0006 -0.0024 -0.0079 2780 LYS 58 CA -0.0004 -0.0024 -0.0082 2781 LYS 58 C -0.0006 -0.0023 -0.0086 2782 LYS 58 O -0.0010 -0.0021 -0.0087 2783 LYS 58 CB -0.0005 -0.0024 -0.0081 2784 LYS 58 CG -0.0002 -0.0026 -0.0077 2785 LYS 58 CD -0.0003 -0.0026 -0.0076 2786 LYS 58 CE -0.0001 -0.0027 -0.0073 2787 LYS 58 NZ -0.0001 -0.0027 -0.0072 2788 THR 59 N -0.0004 -0.0024 -0.0089 2789 THR 59 CA -0.0006 -0.0022 -0.0093 2790 THR 59 C -0.0007 -0.0021 -0.0096 2791 THR 59 O -0.0010 -0.0020 -0.0098 2792 THR 59 CB -0.0003 -0.0023 -0.0095 2793 THR 59 OG1 -0.0002 -0.0024 -0.0093 2794 THR 59 CG2 -0.0005 -0.0022 -0.0099 2795 LYS 60 N -0.0005 -0.0023 -0.0096 2796 LYS 60 CA -0.0005 -0.0022 -0.0098 2797 LYS 60 C -0.0004 -0.0023 -0.0096 2798 LYS 60 O -0.0000 -0.0025 -0.0096 2799 LYS 60 CB -0.0004 -0.0022 -0.0102 2800 LYS 60 CG -0.0005 -0.0021 -0.0105 2801 LYS 60 CD -0.0004 -0.0021 -0.0110 2802 LYS 60 CE -0.0005 -0.0020 -0.0112 2803 LYS 60 NZ -0.0004 -0.0020 -0.0117 2804 GLU 61 N -0.0008 -0.0011 -0.0095 2805 GLU 61 CA -0.0007 -0.0009 -0.0089 2806 GLU 61 C -0.0011 -0.0011 -0.0088 2807 GLU 61 O -0.0016 -0.0013 -0.0088 2808 GLU 61 CB -0.0008 -0.0009 -0.0085 2809 GLU 61 CG -0.0008 -0.0007 -0.0079 2810 GLU 61 CD -0.0009 -0.0007 -0.0075 2811 GLU 61 OE1 -0.0010 -0.0008 -0.0078 2812 GLU 61 OE2 -0.0008 -0.0006 -0.0070 2813 GLN 62 N -0.0009 -0.0009 -0.0087 2814 GLN 62 CA -0.0012 -0.0011 -0.0086 2815 GLN 62 C -0.0011 -0.0009 -0.0080 2816 GLN 62 O -0.0006 -0.0007 -0.0079 2817 GLN 62 CB -0.0011 -0.0011 -0.0090 2818 GLN 62 CG -0.0014 -0.0012 -0.0090 2819 GLN 62 CD -0.0013 -0.0013 -0.0095 2820 GLN 62 OE1 -0.0010 -0.0012 -0.0099 2821 GLN 62 NE2 -0.0016 -0.0014 -0.0095 2822 VAL 63 N -0.0015 -0.0010 -0.0076 2823 VAL 63 CA -0.0014 -0.0008 -0.0071 2824 VAL 63 C -0.0018 -0.0010 -0.0070 2825 VAL 63 O -0.0023 -0.0012 -0.0068 2826 VAL 63 CB -0.0015 -0.0007 -0.0066 2827 VAL 63 CG1 -0.0014 -0.0006 -0.0060 2828 VAL 63 CG2 -0.0011 -0.0006 -0.0067 2829 THR 64 N -0.0017 -0.0009 -0.0071 2830 THR 64 CA -0.0020 -0.0011 -0.0070 2831 THR 64 C -0.0018 -0.0009 -0.0066 2832 THR 64 O -0.0014 -0.0008 -0.0067 2833 THR 64 CB -0.0021 -0.0012 -0.0076 2834 THR 64 OG1 -0.0016 -0.0011 -0.0077 2835 THR 64 CG2 -0.0022 -0.0014 -0.0080 2836 ASN 65 N -0.0018 0.0010 -0.0061 2837 ASN 65 CA -0.0015 0.0014 -0.0054 2838 ASN 65 C -0.0021 0.0010 -0.0050 2839 ASN 65 O -0.0028 0.0005 -0.0051 2840 ASN 65 CB -0.0013 0.0017 -0.0046 2841 ASN 65 CG -0.0019 0.0014 -0.0040 2842 ASN 65 OD1 -0.0026 0.0010 -0.0038 2843 ASN 65 ND2 -0.0017 0.0017 -0.0036 2844 VAL 66 N -0.0019 0.0013 -0.0045 2845 VAL 66 CA -0.0024 0.0011 -0.0039 2846 VAL 66 C -0.0022 0.0015 -0.0029 2847 VAL 66 O -0.0016 0.0020 -0.0028 2848 VAL 66 CB -0.0025 0.0010 -0.0042 2849 VAL 66 CG1 -0.0025 0.0007 -0.0053 2850 VAL 66 CG2 -0.0019 0.0015 -0.0039 2851 GLY 67 N -0.0028 0.0012 -0.0022 2852 GLY 67 CA -0.0027 0.0015 -0.0013 2853 GLY 67 C -0.0023 0.0019 -0.0009 2854 GLY 67 O -0.0023 0.0021 -0.0001 2855 GLY 68 N -0.0021 0.0019 -0.0015 2856 GLY 68 CA -0.0016 0.0024 -0.0013 2857 GLY 68 C -0.0019 0.0021 -0.0015 2858 GLY 68 O -0.0024 0.0016 -0.0019 2859 ALA 69 N -0.0022 0.0018 -0.0016 2860 ALA 69 CA -0.0024 0.0016 -0.0017 2861 ALA 69 C -0.0020 0.0019 -0.0021 2862 ALA 69 O -0.0016 0.0024 -0.0018 2863 ALA 69 CB -0.0026 0.0016 -0.0009 2864 VAL 70 N -0.0021 0.0017 -0.0027 2865 VAL 70 CA -0.0017 0.0020 -0.0032 2866 VAL 70 C -0.0019 0.0018 -0.0033 2867 VAL 70 O -0.0023 0.0013 -0.0034 2868 VAL 70 CB -0.0016 0.0019 -0.0039 2869 VAL 70 CG1 -0.0012 0.0022 -0.0045 2870 VAL 70 CG2 -0.0013 0.0022 -0.0038 2871 VAL 71 N -0.0015 0.0021 -0.0032 2872 VAL 71 CA -0.0016 0.0020 -0.0034 2873 VAL 71 C -0.0013 0.0022 -0.0041 2874 VAL 71 O -0.0008 0.0026 -0.0041 2875 VAL 71 CB -0.0015 0.0022 -0.0028 2876 VAL 71 CG1 -0.0016 0.0021 -0.0030 2877 VAL 71 CG2 -0.0019 0.0020 -0.0021 2878 THR 72 N -0.0015 0.0019 -0.0046 2879 THR 72 CA -0.0012 0.0020 -0.0053 2880 THR 72 C -0.0013 0.0019 -0.0054 2881 THR 72 O -0.0018 0.0015 -0.0055 2882 THR 72 CB -0.0014 0.0018 -0.0059 2883 THR 72 OG1 -0.0019 0.0012 -0.0059 2884 THR 72 CG2 -0.0013 0.0019 -0.0058 2885 GLY 73 N -0.0013 0.0017 -0.0054 2886 GLY 73 CA -0.0012 0.0017 -0.0056 2887 GLY 73 C -0.0013 0.0016 -0.0054 2888 GLY 73 O -0.0015 0.0014 -0.0056 2889 VAL 74 N -0.0013 0.0019 -0.0051 2890 VAL 74 CA -0.0014 0.0019 -0.0049 2891 VAL 74 C -0.0011 0.0020 -0.0051 2892 VAL 74 O -0.0008 0.0022 -0.0052 2893 VAL 74 CB -0.0015 0.0020 -0.0045 2894 VAL 74 CG1 -0.0018 0.0018 -0.0043 2895 VAL 74 CG2 -0.0013 0.0023 -0.0043 2896 THR 75 N -0.0012 0.0019 -0.0051 2897 THR 75 CA -0.0009 0.0021 -0.0053 2898 THR 75 C -0.0010 0.0021 -0.0051 2899 THR 75 O -0.0013 0.0019 -0.0051 2900 THR 75 CB -0.0008 0.0019 -0.0058 2901 THR 75 OG1 -0.0008 0.0018 -0.0060 2902 THR 75 CG2 -0.0005 0.0020 -0.0060 2903 ALA 76 N -0.0008 0.0024 -0.0051 2904 ALA 76 CA -0.0008 0.0024 -0.0049 2905 ALA 76 C -0.0011 0.0024 -0.0045 2906 ALA 76 O -0.0013 0.0022 -0.0045 2907 ALA 76 CB -0.0008 0.0022 -0.0052 2908 VAL 77 N -0.0006 0.0030 -0.0043 2909 VAL 77 CA -0.0009 0.0029 -0.0037 2910 VAL 77 C -0.0007 0.0032 -0.0033 2911 VAL 77 O -0.0002 0.0035 -0.0032 2912 VAL 77 CB -0.0009 0.0029 -0.0037 2913 VAL 77 CG1 -0.0013 0.0029 -0.0032 2914 VAL 77 CG2 -0.0011 0.0026 -0.0042 2915 ALA 78 N -0.0010 0.0031 -0.0029 2916 ALA 78 CA -0.0008 0.0034 -0.0024 2917 ALA 78 C -0.0012 0.0033 -0.0019 2918 ALA 78 O -0.0015 0.0031 -0.0019 2919 ALA 78 CB -0.0006 0.0035 -0.0026 2920 GLN 79 N -0.0011 0.0035 -0.0015 2921 GLN 79 CA -0.0015 0.0034 -0.0010 2922 GLN 79 C -0.0012 0.0037 -0.0005 2923 GLN 79 O -0.0008 0.0040 -0.0005 2924 GLN 79 CB -0.0017 0.0033 -0.0008 2925 GLN 79 CG -0.0013 0.0036 -0.0007 2926 GLN 79 CD -0.0015 0.0035 -0.0005 2927 GLN 79 OE1 -0.0020 0.0032 -0.0005 2928 GLN 79 NE2 -0.0012 0.0037 -0.0004 2929 LYS 80 N -0.0015 0.0036 -0.0000 2930 LYS 80 CA -0.0013 0.0039 0.0005 2931 LYS 80 C -0.0017 0.0038 0.0010 2932 LYS 80 O -0.0021 0.0035 0.0009 2933 LYS 80 CB -0.0013 0.0039 0.0007 2934 LYS 80 CG -0.0011 0.0043 0.0012 2935 LYS 80 CD -0.0011 0.0043 0.0013 2936 LYS 80 CE -0.0009 0.0046 0.0018 2937 LYS 80 NZ -0.0009 0.0047 0.0021 2938 THR 81 N -0.0018 0.0044 0.0013 2939 THR 81 CA -0.0021 0.0044 0.0017 2940 THR 81 C -0.0020 0.0047 0.0022 2941 THR 81 O -0.0016 0.0050 0.0022 2942 THR 81 CB -0.0021 0.0043 0.0016 2943 THR 81 OG1 -0.0023 0.0040 0.0011 2944 THR 81 CG2 -0.0025 0.0043 0.0020 2945 VAL 82 N -0.0023 0.0047 0.0025 2946 VAL 82 CA -0.0023 0.0050 0.0030 2947 VAL 82 C -0.0026 0.0050 0.0033 2948 VAL 82 O -0.0030 0.0047 0.0034 2949 VAL 82 CB -0.0024 0.0051 0.0032 2950 VAL 82 CG1 -0.0024 0.0053 0.0038 2951 VAL 82 CG2 -0.0020 0.0051 0.0030 2952 GLU 83 N -0.0024 0.0052 0.0036 2953 GLU 83 CA -0.0027 0.0052 0.0039 2954 GLU 83 C -0.0029 0.0049 0.0036 2955 GLU 83 O -0.0034 0.0047 0.0037 2956 GLU 83 CB -0.0030 0.0053 0.0043 2957 GLU 83 CG -0.0027 0.0056 0.0047 2958 GLU 83 CD -0.0030 0.0057 0.0051 2959 GLU 83 OE1 -0.0035 0.0055 0.0052 2960 GLU 83 OE2 -0.0028 0.0060 0.0054 2961 GLY 84 N -0.0027 0.0049 0.0032 2962 GLY 84 CA -0.0029 0.0046 0.0030 2963 GLY 84 C -0.0025 0.0046 0.0026 2964 GLY 84 O -0.0021 0.0048 0.0025 2965 ALA 85 N -0.0027 0.0046 0.0025 2966 ALA 85 CA -0.0024 0.0047 0.0022 2967 ALA 85 C -0.0024 0.0043 0.0017 2968 ALA 85 O -0.0027 0.0040 0.0017 2969 ALA 85 CB -0.0025 0.0048 0.0024 2970 GLY 86 N -0.0021 0.0045 0.0013 2971 GLY 86 CA -0.0021 0.0042 0.0008 2972 GLY 86 C -0.0019 0.0042 0.0005 2973 GLY 86 O -0.0016 0.0045 0.0004 2974 SER 87 N -0.0021 0.0039 0.0004 2975 SER 87 CA -0.0019 0.0040 0.0001 2976 SER 87 C -0.0020 0.0036 -0.0003 2977 SER 87 O -0.0023 0.0032 -0.0003 2978 SER 87 CB -0.0021 0.0039 0.0004 2979 SER 87 OG -0.0020 0.0043 0.0008 2980 ILE 88 N -0.0017 0.0037 -0.0007 2981 ILE 88 CA -0.0017 0.0034 -0.0012 2982 ILE 88 C -0.0018 0.0031 -0.0014 2983 ILE 88 O -0.0020 0.0027 -0.0015 2984 ILE 88 CB -0.0014 0.0035 -0.0015 2985 ILE 88 CG1 -0.0014 0.0037 -0.0013 2986 ILE 88 CG2 -0.0014 0.0032 -0.0020 2987 ILE 88 CD1 -0.0010 0.0039 -0.0015 2988 ALA 89 N -0.0017 0.0033 -0.0017 2989 ALA 89 CA -0.0017 0.0033 -0.0020 2990 ALA 89 C -0.0015 0.0036 -0.0014 2991 ALA 89 O -0.0011 0.0042 -0.0014 2992 ALA 89 CB -0.0014 0.0036 -0.0028 2993 ALA 90 N -0.0018 0.0032 -0.0008 2994 ALA 90 CA -0.0016 0.0035 -0.0001 2995 ALA 90 C -0.0018 0.0032 -0.0002 2996 ALA 90 O -0.0022 0.0027 -0.0005 2997 ALA 90 CB -0.0018 0.0033 0.0006 2998 ALA 91 N -0.0016 0.0036 0.0001 2999 ALA 91 CA -0.0017 0.0034 -0.0000 3000 ALA 91 C -0.0015 0.0037 0.0007 3001 ALA 91 O -0.0011 0.0043 0.0007 3002 ALA 91 CB -0.0015 0.0035 -0.0008 3003 THR 92 N -0.0018 0.0033 0.0011 3004 THR 92 CA -0.0017 0.0035 0.0018 3005 THR 92 C -0.0019 0.0032 0.0017 3006 THR 92 O -0.0022 0.0027 0.0014 3007 THR 92 CB -0.0019 0.0033 0.0026 3008 THR 92 OG1 -0.0023 0.0026 0.0026 3009 THR 92 CG2 -0.0017 0.0035 0.0027 3010 GLY 93 N -0.0012 0.0045 0.0022 3011 GLY 93 CA -0.0010 0.0050 0.0020 3012 GLY 93 C -0.0004 0.0043 0.0031 3013 GLY 93 O -0.0007 0.0041 0.0031 3014 PHE 94 N 0.0003 0.0041 0.0042 3015 PHE 94 CA 0.0009 0.0035 0.0053 3016 PHE 94 C 0.0010 0.0027 0.0062 3017 PHE 94 O 0.0013 0.0030 0.0063 3018 PHE 94 CB 0.0021 0.0046 0.0057 3019 PHE 94 CG 0.0021 0.0054 0.0049 3020 PHE 94 CD1 0.0021 0.0050 0.0053 3021 PHE 94 CD2 0.0021 0.0064 0.0039 3022 PHE 94 CE1 0.0021 0.0057 0.0046 3023 PHE 94 CE2 0.0021 0.0072 0.0033 3024 PHE 94 CZ 0.0021 0.0068 0.0036 3025 VAL 95 N 0.0008 0.0016 0.0070 3026 VAL 95 CA 0.0011 0.0007 0.0081 3027 VAL 95 C 0.0017 0.0003 0.0091 3028 VAL 95 O 0.0013 -0.0002 0.0091 3029 VAL 95 CB -0.0000 -0.0004 0.0079 3030 VAL 95 CG1 0.0002 -0.0014 0.0091 3031 VAL 95 CG2 -0.0006 -0.0001 0.0070 3032 LYS 96 N 0.0027 0.0005 0.0100 3033 LYS 96 CA 0.0034 0.0002 0.0111 3034 LYS 96 C 0.0037 -0.0007 0.0122 3035 LYS 96 O 0.0034 -0.0010 0.0122 3036 LYS 96 CB 0.0045 0.0014 0.0112 3037 LYS 96 CG 0.0044 0.0022 0.0102 3038 LYS 96 CD 0.0041 0.0017 0.0104 3039 LYS 96 CE 0.0039 0.0026 0.0094 3040 LYS 96 NZ 0.0049 0.0037 0.0095 3041 LYS 97 N 0.0077 -0.0024 0.0142 3042 LYS 97 CA 0.0094 -0.0072 0.0161 3043 LYS 97 C 0.0148 -0.0069 0.0170 3044 LYS 97 O 0.0164 -0.0039 0.0164 3045 LYS 97 CB 0.0063 -0.0105 0.0166 3046 LYS 97 CG 0.0075 -0.0157 0.0185 3047 LYS 97 CD 0.0062 -0.0180 0.0190 3048 LYS 97 CE 0.0075 -0.0232 0.0209 3049 LYS 97 NZ 0.0046 -0.0261 0.0212 3050 ASP 98 N 0.0177 -0.0100 0.0186 3051 ASP 98 CA 0.0228 -0.0106 0.0197 3052 ASP 98 C 0.0235 -0.0159 0.0216 3053 ASP 98 O 0.0201 -0.0189 0.0219 3054 ASP 98 CB 0.0262 -0.0078 0.0195 3055 ASP 98 CG 0.0314 -0.0068 0.0202 3056 ASP 98 OD1 0.0324 -0.0084 0.0209 3057 ASP 98 OD2 0.0345 -0.0044 0.0200 3058 GLN 99 N 0.0280 -0.0172 0.0228 3059 GLN 99 CA 0.0294 -0.0222 0.0247 3060 GLN 99 C 0.0290 -0.0245 0.0254 3061 GLN 99 O 0.0268 -0.0284 0.0262 3062 GLN 99 CB 0.0345 -0.0225 0.0258 3063 GLN 99 CG 0.0361 -0.0276 0.0277 3064 GLN 99 CD 0.0413 -0.0278 0.0287 3065 GLN 99 OE1 0.0437 -0.0241 0.0280 3066 GLN 99 NE2 0.0429 -0.0321 0.0304 3067 VAL 37 N -0.0064 -0.0261 0.0107 3068 VAL 37 CA -0.0070 -0.0245 0.0101 3069 VAL 37 C -0.0046 -0.0233 0.0101 3070 VAL 37 O -0.0043 -0.0225 0.0099 3071 VAL 37 CB -0.0085 -0.0259 0.0103 3072 VAL 37 CG1 -0.0112 -0.0263 0.0100 3073 VAL 37 CG2 -0.0074 -0.0283 0.0113 3074 LEU 38 N -0.0028 -0.0231 0.0104 3075 LEU 38 CA -0.0003 -0.0221 0.0104 3076 LEU 38 C -0.0003 -0.0193 0.0095 3077 LEU 38 O 0.0007 -0.0184 0.0094 3078 LEU 38 CB 0.0016 -0.0226 0.0109 3079 LEU 38 CG 0.0031 -0.0249 0.0119 3080 LEU 38 CD1 0.0050 -0.0249 0.0122 3081 LEU 38 CD2 0.0014 -0.0273 0.0124 3082 TYR 39 N -0.0016 -0.0181 0.0089 3083 TYR 39 CA -0.0020 -0.0155 0.0080 3084 TYR 39 C 0.0005 -0.0140 0.0079 3085 TYR 39 O 0.0011 -0.0127 0.0076 3086 TYR 39 CB -0.0037 -0.0149 0.0075 3087 TYR 39 CG -0.0064 -0.0158 0.0074 3088 TYR 39 CD1 -0.0081 -0.0146 0.0067 3089 TYR 39 CD2 -0.0073 -0.0178 0.0079 3090 TYR 39 CE1 -0.0105 -0.0154 0.0066 3091 TYR 39 CE2 -0.0098 -0.0187 0.0078 3092 TYR 39 CZ -0.0114 -0.0174 0.0071 3093 TYR 39 OH -0.0138 -0.0183 0.0070 3094 VAL 40 N 0.0020 -0.0142 0.0082 3095 VAL 40 CA 0.0044 -0.0127 0.0082 3096 VAL 40 C 0.0040 -0.0101 0.0072 3097 VAL 40 O 0.0052 -0.0085 0.0069 3098 VAL 40 CB 0.0061 -0.0138 0.0088 3099 VAL 40 CG1 0.0086 -0.0124 0.0087 3100 VAL 40 CG2 0.0066 -0.0164 0.0097 3101 GLY 41 N 0.0006 -0.0084 0.0065 3102 GLY 41 CA 0.0001 -0.0068 0.0056 3103 GLY 41 C -0.0018 -0.0064 0.0051 3104 GLY 41 O -0.0028 -0.0059 0.0046 3105 SER 42 N -0.0023 -0.0069 0.0052 3106 SER 42 CA -0.0042 -0.0069 0.0048 3107 SER 42 C -0.0049 -0.0053 0.0039 3108 SER 42 O -0.0065 -0.0052 0.0035 3109 SER 42 CB -0.0043 -0.0076 0.0051 3110 SER 42 OG -0.0062 -0.0077 0.0047 3111 LYS 43 N -0.0039 -0.0039 0.0035 3112 LYS 43 CA -0.0043 -0.0022 0.0026 3113 LYS 43 C -0.0026 -0.0011 0.0024 3114 LYS 43 O -0.0018 -0.0010 0.0026 3115 LYS 43 CB -0.0057 -0.0016 0.0020 3116 LYS 43 CG -0.0064 0.0000 0.0011 3117 LYS 43 CD -0.0078 0.0006 0.0005 3118 LYS 43 CE -0.0085 0.0022 -0.0003 3119 LYS 43 NZ -0.0071 0.0036 -0.0007 3120 THR 44 N -0.0021 -0.0003 0.0022 3121 THR 44 CA -0.0006 0.0010 0.0019 3122 THR 44 C -0.0012 0.0025 0.0010 3123 THR 44 O -0.0025 0.0025 0.0008 3124 THR 44 CB 0.0010 0.0004 0.0025 3125 THR 44 OG1 0.0005 0.0003 0.0025 3126 THR 44 CG2 0.0016 -0.0012 0.0034 3127 LYS 45 N -0.0010 0.0031 0.0005 3128 LYS 45 CA -0.0012 0.0031 -0.0001 3129 LYS 45 C -0.0007 0.0034 -0.0002 3130 LYS 45 O -0.0002 0.0037 -0.0004 3131 LYS 45 CB -0.0012 0.0033 -0.0007 3132 LYS 45 CG -0.0014 0.0033 -0.0014 3133 LYS 45 CD -0.0015 0.0033 -0.0019 3134 LYS 45 CE -0.0018 0.0033 -0.0027 3135 LYS 45 NZ -0.0019 0.0034 -0.0032 3136 GLU 46 N -0.0009 0.0033 -0.0001 3137 GLU 46 CA -0.0005 0.0035 -0.0000 3138 GLU 46 C -0.0007 0.0034 -0.0003 3139 GLU 46 O -0.0012 0.0031 -0.0002 3140 GLU 46 CB -0.0002 0.0035 0.0008 3141 GLU 46 CG -0.0007 0.0031 0.0013 3142 GLU 46 CD -0.0005 0.0031 0.0020 3143 GLU 46 OE1 0.0001 0.0034 0.0021 3144 GLU 46 OE2 -0.0008 0.0028 0.0025 3145 GLY 47 N -0.0004 0.0037 -0.0008 3146 GLY 47 CA -0.0006 0.0037 -0.0012 3147 GLY 47 C -0.0011 0.0035 -0.0018 3148 GLY 47 O -0.0015 0.0033 -0.0020 3149 VAL 48 N -0.0009 0.0037 -0.0022 3150 VAL 48 CA -0.0014 0.0035 -0.0027 3151 VAL 48 C -0.0011 0.0038 -0.0034 3152 VAL 48 O -0.0005 0.0041 -0.0035 3153 VAL 48 CB -0.0015 0.0034 -0.0026 3154 VAL 48 CG1 -0.0020 0.0033 -0.0031 3155 VAL 48 CG2 -0.0018 0.0031 -0.0019 3156 VAL 49 N -0.0014 0.0029 -0.0042 3157 VAL 49 CA -0.0012 0.0028 -0.0046 3158 VAL 49 C -0.0011 0.0026 -0.0049 3159 VAL 49 O -0.0014 0.0023 -0.0049 3160 VAL 49 CB -0.0014 0.0026 -0.0046 3161 VAL 49 CG1 -0.0013 0.0024 -0.0050 3162 VAL 49 CG2 -0.0015 0.0028 -0.0043 3163 HIS 50 N -0.0008 0.0028 -0.0052 3164 HIS 50 CA -0.0007 0.0025 -0.0055 3165 HIS 50 C -0.0004 0.0026 -0.0059 3166 HIS 50 O -0.0002 0.0029 -0.0059 3167 HIS 50 CB -0.0007 0.0027 -0.0054 3168 HIS 50 CG -0.0004 0.0031 -0.0054 3169 HIS 50 ND1 -0.0001 0.0032 -0.0057 3170 HIS 50 CD2 -0.0004 0.0034 -0.0051 3171 HIS 50 CE1 0.0001 0.0035 -0.0056 3172 HIS 50 NE2 -0.0000 0.0037 -0.0052 3173 GLY 51 N -0.0004 0.0022 -0.0062 3174 GLY 51 CA -0.0002 0.0022 -0.0066 3175 GLY 51 C -0.0001 0.0022 -0.0067 3176 GLY 51 O 0.0001 0.0024 -0.0067 3177 VAL 52 N -0.0004 0.0018 -0.0067 3178 VAL 52 CA -0.0004 0.0018 -0.0067 3179 VAL 52 C -0.0004 0.0014 -0.0070 3180 VAL 52 O -0.0006 0.0011 -0.0071 3181 VAL 52 CB -0.0007 0.0018 -0.0063 3182 VAL 52 CG1 -0.0008 0.0017 -0.0064 3183 VAL 52 CG2 -0.0007 0.0021 -0.0060 3184 ALA 53 N -0.0001 0.0009 -0.0070 3185 ALA 53 CA -0.0001 0.0006 -0.0070 3186 ALA 53 C -0.0003 0.0003 -0.0070 3187 ALA 53 O -0.0004 0.0003 -0.0071 3188 ALA 53 CB 0.0003 0.0005 -0.0070 3189 THR 54 N -0.0004 0.0001 -0.0071 3190 THR 54 CA -0.0007 -0.0001 -0.0071 3191 THR 54 C -0.0006 -0.0005 -0.0071 3192 THR 54 O -0.0006 -0.0005 -0.0071 3193 THR 54 CB -0.0010 -0.0000 -0.0071 3194 THR 54 OG1 -0.0011 0.0003 -0.0072 3195 THR 54 CG2 -0.0013 -0.0003 -0.0072 3196 VAL 55 N -0.0006 -0.0008 -0.0071 3197 VAL 55 CA -0.0005 -0.0011 -0.0071 3198 VAL 55 C -0.0008 -0.0013 -0.0072 3199 VAL 55 O -0.0009 -0.0013 -0.0072 3200 VAL 55 CB -0.0002 -0.0012 -0.0071 3201 VAL 55 CG1 -0.0002 -0.0016 -0.0071 3202 VAL 55 CG2 0.0001 -0.0010 -0.0070 3203 ALA 56 N -0.0010 -0.0015 -0.0072 3204 ALA 56 CA -0.0013 -0.0017 -0.0072 3205 ALA 56 C -0.0012 -0.0020 -0.0072 3206 ALA 56 O -0.0013 -0.0020 -0.0072 3207 ALA 56 CB -0.0016 -0.0015 -0.0073 3208 GLU 57 N -0.0008 -0.0020 -0.0071 3209 GLU 57 CA -0.0009 -0.0022 -0.0074 3210 GLU 57 C -0.0009 -0.0023 -0.0078 3211 GLU 57 O -0.0006 -0.0025 -0.0079 3212 GLU 57 CB -0.0006 -0.0023 -0.0074 3213 GLU 57 CG -0.0006 -0.0021 -0.0070 3214 GLU 57 CD -0.0003 -0.0023 -0.0070 3215 GLU 57 OE1 -0.0001 -0.0026 -0.0073 3216 GLU 57 OE2 -0.0003 -0.0022 -0.0068 3217 LYS 58 N -0.0013 -0.0022 -0.0080 3218 LYS 58 CA -0.0013 -0.0024 -0.0084 3219 LYS 58 C -0.0015 -0.0024 -0.0088 3220 LYS 58 O -0.0019 -0.0022 -0.0088 3221 LYS 58 CB -0.0015 -0.0022 -0.0083 3222 LYS 58 CG -0.0013 -0.0022 -0.0080 3223 LYS 58 CD -0.0015 -0.0020 -0.0079 3224 LYS 58 CE -0.0013 -0.0020 -0.0076 3225 LYS 58 NZ -0.0015 -0.0019 -0.0075 3226 THR 59 N -0.0013 -0.0027 -0.0091 3227 THR 59 CA -0.0015 -0.0027 -0.0094 3228 THR 59 C -0.0018 -0.0027 -0.0097 3229 THR 59 O -0.0021 -0.0026 -0.0099 3230 THR 59 CB -0.0012 -0.0030 -0.0096 3231 THR 59 OG1 -0.0009 -0.0030 -0.0093 3232 THR 59 CG2 -0.0013 -0.0031 -0.0100 3233 LYS 60 N -0.0017 -0.0027 -0.0097 3234 LYS 60 CA -0.0020 -0.0027 -0.0100 3235 LYS 60 C -0.0020 -0.0026 -0.0098 3236 LYS 60 O -0.0017 -0.0028 -0.0098 3237 LYS 60 CB -0.0020 -0.0029 -0.0104 3238 LYS 60 CG -0.0023 -0.0029 -0.0107 3239 LYS 60 CD -0.0023 -0.0031 -0.0112 3240 LYS 60 CE -0.0026 -0.0030 -0.0114 3241 LYS 60 NZ -0.0025 -0.0033 -0.0119 3242 GLU 61 N -0.0024 -0.0021 -0.0096 3243 GLU 61 CA -0.0024 -0.0019 -0.0091 3244 GLU 61 C -0.0029 -0.0020 -0.0089 3245 GLU 61 O -0.0034 -0.0022 -0.0089 3246 GLU 61 CB -0.0025 -0.0018 -0.0086 3247 GLU 61 CG -0.0025 -0.0016 -0.0080 3248 GLU 61 CD -0.0026 -0.0014 -0.0076 3249 GLU 61 OE1 -0.0026 -0.0015 -0.0078 3250 GLU 61 OE2 -0.0026 -0.0013 -0.0071 3251 GLN 62 N -0.0027 -0.0019 -0.0088 3252 GLN 62 CA -0.0031 -0.0021 -0.0088 3253 GLN 62 C -0.0031 -0.0018 -0.0082 3254 GLN 62 O -0.0026 -0.0016 -0.0081 3255 GLN 62 CB -0.0030 -0.0022 -0.0092 3256 GLN 62 CG -0.0034 -0.0024 -0.0092 3257 GLN 62 CD -0.0034 -0.0025 -0.0097 3258 GLN 62 OE1 -0.0030 -0.0025 -0.0101 3259 GLN 62 NE2 -0.0037 -0.0027 -0.0097 3260 VAL 63 N -0.0035 -0.0019 -0.0078 3261 VAL 63 CA -0.0035 -0.0017 -0.0073 3262 VAL 63 C -0.0040 -0.0019 -0.0072 3263 VAL 63 O -0.0045 -0.0020 -0.0070 3264 VAL 63 CB -0.0035 -0.0015 -0.0068 3265 VAL 63 CG1 -0.0035 -0.0013 -0.0062 3266 VAL 63 CG2 -0.0031 -0.0014 -0.0069 3267 THR 64 N -0.0039 -0.0019 -0.0073 3268 THR 64 CA -0.0043 -0.0020 -0.0073 3269 THR 64 C -0.0042 -0.0018 -0.0069 3270 THR 64 O -0.0038 -0.0017 -0.0071 3271 THR 64 CB -0.0044 -0.0023 -0.0079 3272 THR 64 OG1 -0.0039 -0.0021 -0.0080 3273 THR 64 CG2 -0.0044 -0.0024 -0.0083 3274 ASN 65 N -0.0044 -0.0009 -0.0064 3275 ASN 65 CA -0.0041 -0.0005 -0.0056 3276 ASN 65 C -0.0047 -0.0008 -0.0053 3277 ASN 65 O -0.0054 -0.0013 -0.0054 3278 ASN 65 CB -0.0039 -0.0002 -0.0049 3279 ASN 65 CG -0.0045 -0.0004 -0.0042 3280 ASN 65 OD1 -0.0051 -0.0009 -0.0041 3281 ASN 65 ND2 -0.0043 -0.0002 -0.0038 3282 VAL 66 N -0.0045 -0.0006 -0.0048 3283 VAL 66 CA -0.0050 -0.0008 -0.0043 3284 VAL 66 C -0.0048 -0.0004 -0.0033 3285 VAL 66 O -0.0041 0.0001 -0.0032 3286 VAL 66 CB -0.0050 -0.0009 -0.0047 3287 VAL 66 CG1 -0.0051 -0.0012 -0.0057 3288 VAL 66 CG2 -0.0044 -0.0004 -0.0044 3289 GLY 67 N -0.0054 -0.0007 -0.0027 3290 GLY 67 CA -0.0053 -0.0004 -0.0017 3291 GLY 67 C -0.0049 -0.0000 -0.0013 3292 GLY 67 O -0.0048 0.0002 -0.0005 3293 GLY 68 N -0.0046 0.0000 -0.0019 3294 GLY 68 CA -0.0042 0.0004 -0.0016 3295 GLY 68 C -0.0045 0.0002 -0.0018 3296 GLY 68 O -0.0050 -0.0003 -0.0022 3297 ALA 69 N -0.0045 0.0001 -0.0017 3298 ALA 69 CA -0.0046 -0.0001 -0.0018 3299 ALA 69 C -0.0041 0.0002 -0.0022 3300 ALA 69 O -0.0037 0.0007 -0.0020 3301 ALA 69 CB -0.0048 -0.0000 -0.0011 3302 VAL 70 N -0.0042 -0.0000 -0.0028 3303 VAL 70 CA -0.0037 0.0002 -0.0033 3304 VAL 70 C -0.0038 0.0001 -0.0034 3305 VAL 70 O -0.0043 -0.0003 -0.0035 3306 VAL 70 CB -0.0036 0.0001 -0.0040 3307 VAL 70 CG1 -0.0032 0.0003 -0.0046 3308 VAL 70 CG2 -0.0034 0.0003 -0.0040 3309 VAL 71 N -0.0035 0.0005 -0.0033 3310 VAL 71 CA -0.0035 0.0004 -0.0034 3311 VAL 71 C -0.0031 0.0006 -0.0041 3312 VAL 71 O -0.0026 0.0010 -0.0041 3313 VAL 71 CB -0.0034 0.0007 -0.0028 3314 VAL 71 CG1 -0.0034 0.0007 -0.0030 3315 VAL 71 CG2 -0.0038 0.0005 -0.0022 3316 THR 72 N -0.0033 0.0002 -0.0046 3317 THR 72 CA -0.0029 0.0003 -0.0053 3318 THR 72 C -0.0029 0.0002 -0.0054 3319 THR 72 O -0.0034 -0.0002 -0.0055 3320 THR 72 CB -0.0030 -0.0000 -0.0059 3321 THR 72 OG1 -0.0036 -0.0005 -0.0060 3322 THR 72 CG2 -0.0030 0.0001 -0.0058 3323 GLY 73 N -0.0026 0.0005 -0.0055 3324 GLY 73 CA -0.0024 0.0005 -0.0057 3325 GLY 73 C -0.0025 0.0005 -0.0055 3326 GLY 73 O -0.0027 0.0003 -0.0057 3327 VAL 74 N -0.0025 0.0009 -0.0051 3328 VAL 74 CA -0.0026 0.0009 -0.0049 3329 VAL 74 C -0.0022 0.0011 -0.0051 3330 VAL 74 O -0.0019 0.0014 -0.0052 3331 VAL 74 CB -0.0029 0.0011 -0.0044 3332 VAL 74 CG1 -0.0032 0.0009 -0.0043 3333 VAL 74 CG2 -0.0025 0.0016 -0.0042 3334 THR 75 N -0.0022 0.0011 -0.0052 3335 THR 75 CA -0.0019 0.0012 -0.0054 3336 THR 75 C -0.0020 0.0013 -0.0051 3337 THR 75 O -0.0023 0.0011 -0.0050 3338 THR 75 CB -0.0018 0.0009 -0.0059 3339 THR 75 OG1 -0.0017 0.0008 -0.0061 3340 THR 75 CG2 -0.0014 0.0011 -0.0061 3341 ALA 76 N -0.0017 0.0017 -0.0050 3342 ALA 76 CA -0.0017 0.0018 -0.0049 3343 ALA 76 C -0.0020 0.0018 -0.0044 3344 ALA 76 O -0.0023 0.0017 -0.0044 3345 ALA 76 CB -0.0017 0.0016 -0.0052 3346 VAL 77 N -0.0020 0.0021 -0.0042 3347 VAL 77 CA -0.0023 0.0020 -0.0037 3348 VAL 77 C -0.0021 0.0024 -0.0032 3349 VAL 77 O -0.0017 0.0027 -0.0032 3350 VAL 77 CB -0.0024 0.0020 -0.0037 3351 VAL 77 CG1 -0.0027 0.0019 -0.0031 3352 VAL 77 CG2 -0.0025 0.0017 -0.0041 3353 ALA 78 N -0.0024 0.0023 -0.0029 3354 ALA 78 CA -0.0022 0.0026 -0.0025 3355 ALA 78 C -0.0026 0.0024 -0.0019 3356 ALA 78 O -0.0029 0.0022 -0.0019 3357 ALA 78 CB -0.0020 0.0026 -0.0026 3358 GLN 79 N -0.0025 0.0026 -0.0015 3359 GLN 79 CA -0.0029 0.0026 -0.0010 3360 GLN 79 C -0.0027 0.0029 -0.0005 3361 GLN 79 O -0.0022 0.0032 -0.0006 3362 GLN 79 CB -0.0031 0.0024 -0.0008 3363 GLN 79 CG -0.0028 0.0027 -0.0007 3364 GLN 79 CD -0.0030 0.0026 -0.0005 3365 GLN 79 OE1 -0.0034 0.0023 -0.0005 3366 GLN 79 NE2 -0.0028 0.0029 -0.0004 3367 LYS 80 N -0.0029 0.0028 -0.0001 3368 LYS 80 CA -0.0028 0.0031 0.0004 3369 LYS 80 C -0.0031 0.0030 0.0009 3370 LYS 80 O -0.0035 0.0027 0.0008 3371 LYS 80 CB -0.0028 0.0032 0.0005 3372 LYS 80 CG -0.0025 0.0035 0.0010 3373 LYS 80 CD -0.0025 0.0036 0.0012 3374 LYS 80 CE -0.0023 0.0039 0.0017 3375 LYS 80 NZ -0.0023 0.0040 0.0019 3376 THR 81 N -0.0032 0.0035 0.0013 3377 THR 81 CA -0.0036 0.0035 0.0017 3378 THR 81 C -0.0035 0.0039 0.0021 3379 THR 81 O -0.0031 0.0041 0.0022 3380 THR 81 CB -0.0036 0.0034 0.0015 3381 THR 81 OG1 -0.0038 0.0031 0.0011 3382 THR 81 CG2 -0.0040 0.0034 0.0019 3383 VAL 82 N -0.0038 0.0039 0.0025 3384 VAL 82 CA -0.0038 0.0042 0.0030 3385 VAL 82 C -0.0041 0.0042 0.0033 3386 VAL 82 O -0.0046 0.0039 0.0033 3387 VAL 82 CB -0.0039 0.0043 0.0032 3388 VAL 82 CG1 -0.0039 0.0046 0.0038 3389 VAL 82 CG2 -0.0035 0.0043 0.0030 3390 GLU 83 N -0.0039 0.0044 0.0035 3391 GLU 83 CA -0.0042 0.0044 0.0038 3392 GLU 83 C -0.0045 0.0041 0.0035 3393 GLU 83 O -0.0049 0.0039 0.0036 3394 GLU 83 CB -0.0045 0.0045 0.0043 3395 GLU 83 CG -0.0043 0.0049 0.0046 3396 GLU 83 CD -0.0046 0.0050 0.0051 3397 GLU 83 OE1 -0.0050 0.0047 0.0051 3398 GLU 83 OE2 -0.0044 0.0053 0.0054 3399 GLY 84 N -0.0042 0.0040 0.0031 3400 GLY 84 CA -0.0044 0.0037 0.0028 3401 GLY 84 C -0.0040 0.0037 0.0024 3402 GLY 84 O -0.0036 0.0039 0.0024 3403 ALA 85 N -0.0041 0.0035 0.0023 3404 ALA 85 CA -0.0039 0.0036 0.0021 3405 ALA 85 C -0.0039 0.0032 0.0016 3406 ALA 85 O -0.0042 0.0029 0.0016 3407 ALA 85 CB -0.0040 0.0036 0.0023 3408 GLY 86 N -0.0035 0.0033 0.0012 3409 GLY 86 CA -0.0035 0.0030 0.0008 3410 GLY 86 C -0.0033 0.0030 0.0004 3411 GLY 86 O -0.0030 0.0033 0.0003 3412 SER 87 N -0.0035 0.0027 0.0004 3413 SER 87 CA -0.0033 0.0027 0.0001 3414 SER 87 C -0.0033 0.0023 -0.0004 3415 SER 87 O -0.0036 0.0019 -0.0004 3416 SER 87 CB -0.0035 0.0026 0.0003 3417 SER 87 OG -0.0035 0.0030 0.0007 3418 ILE 88 N -0.0030 0.0024 -0.0008 3419 ILE 88 CA -0.0030 0.0021 -0.0012 3420 ILE 88 C -0.0031 0.0018 -0.0014 3421 ILE 88 O -0.0033 0.0014 -0.0015 3422 ILE 88 CB -0.0026 0.0022 -0.0015 3423 ILE 88 CG1 -0.0026 0.0024 -0.0013 3424 ILE 88 CG2 -0.0026 0.0019 -0.0020 3425 ILE 88 CD1 -0.0023 0.0027 -0.0015 3426 ALA 89 N -0.0030 0.0015 -0.0016 3427 ALA 89 CA -0.0030 0.0013 -0.0020 3428 ALA 89 C -0.0029 0.0017 -0.0014 3429 ALA 89 O -0.0024 0.0022 -0.0015 3430 ALA 89 CB -0.0026 0.0016 -0.0029 3431 ALA 90 N -0.0033 0.0013 -0.0007 3432 ALA 90 CA -0.0032 0.0016 -0.0001 3433 ALA 90 C -0.0035 0.0012 -0.0002 3434 ALA 90 O -0.0039 0.0005 -0.0006 3435 ALA 90 CB -0.0035 0.0015 0.0008 3436 ALA 91 N -0.0033 0.0015 0.0001 3437 ALA 91 CA -0.0035 0.0012 -0.0001 3438 ALA 91 C -0.0034 0.0015 0.0006 3439 ALA 91 O -0.0030 0.0021 0.0007 3440 ALA 91 CB -0.0033 0.0013 -0.0010 3441 THR 92 N -0.0039 0.0011 0.0011 3442 THR 92 CA -0.0038 0.0013 0.0018 3443 THR 92 C -0.0041 0.0009 0.0017 3444 THR 92 O -0.0045 0.0003 0.0013 3445 THR 92 CB -0.0041 0.0012 0.0027 3446 THR 92 OG1 -0.0047 0.0005 0.0028 3447 THR 92 CG2 -0.0039 0.0015 0.0029 3448 GLY 93 N -0.0038 0.0015 0.0019 3449 GLY 93 CA -0.0036 0.0019 0.0016 3450 GLY 93 C -0.0033 0.0014 0.0026 3451 GLY 93 O -0.0037 0.0012 0.0025 3452 PHE 94 N -0.0026 0.0012 0.0037 3453 PHE 94 CA -0.0022 0.0008 0.0048 3454 PHE 94 C -0.0021 0.0001 0.0059 3455 PHE 94 O -0.0017 0.0003 0.0060 3456 PHE 94 CB -0.0010 0.0016 0.0050 3457 PHE 94 CG -0.0011 0.0023 0.0041 3458 PHE 94 CD1 -0.0013 0.0019 0.0043 3459 PHE 94 CD2 -0.0009 0.0032 0.0030 3460 PHE 94 CE1 -0.0013 0.0025 0.0034 3461 PHE 94 CE2 -0.0010 0.0038 0.0022 3462 PHE 94 CZ -0.0012 0.0034 0.0024 3463 VAL 95 N -0.0025 -0.0009 0.0067 3464 VAL 95 CA -0.0023 -0.0016 0.0079 3465 VAL 95 C -0.0018 -0.0019 0.0088 3466 VAL 95 O -0.0024 -0.0024 0.0087 3467 VAL 95 CB -0.0033 -0.0025 0.0079 3468 VAL 95 CG1 -0.0031 -0.0033 0.0092 3469 VAL 95 CG2 -0.0037 -0.0022 0.0071 3470 LYS 96 N -0.0008 -0.0017 0.0097 3471 LYS 96 CA -0.0003 -0.0019 0.0107 3472 LYS 96 C -0.0000 -0.0026 0.0119 3473 LYS 96 O -0.0002 -0.0029 0.0120 3474 LYS 96 CB 0.0008 -0.0009 0.0106 3475 LYS 96 CG 0.0006 -0.0003 0.0095 3476 LYS 96 CD 0.0001 -0.0007 0.0095 3477 LYS 96 CE -0.0001 -0.0000 0.0083 3478 LYS 96 NZ 0.0010 0.0010 0.0083 3479 LYS 97 N 0.0033 -0.0040 0.0136 3480 LYS 97 CA 0.0050 -0.0086 0.0155 3481 LYS 97 C 0.0101 -0.0083 0.0164 3482 LYS 97 O 0.0115 -0.0054 0.0157 3483 LYS 97 CB 0.0019 -0.0118 0.0160 3484 LYS 97 CG 0.0031 -0.0167 0.0179 3485 LYS 97 CD 0.0020 -0.0190 0.0184 3486 LYS 97 CE 0.0033 -0.0239 0.0204 3487 LYS 97 NZ 0.0004 -0.0267 0.0208 3488 ASP 98 N 0.0129 -0.0112 0.0179 3489 ASP 98 CA 0.0178 -0.0117 0.0190 3490 ASP 98 C 0.0185 -0.0168 0.0209 3491 ASP 98 O 0.0153 -0.0196 0.0212 3492 ASP 98 CB 0.0211 -0.0090 0.0187 3493 ASP 98 CG 0.0261 -0.0080 0.0193 3494 ASP 98 OD1 0.0269 -0.0095 0.0200 3495 ASP 98 OD2 0.0290 -0.0057 0.0191 3496 GLN 99 N 0.0229 -0.0179 0.0221 3497 GLN 99 CA 0.0242 -0.0227 0.0239 3498 GLN 99 C 0.0240 -0.0249 0.0246 3499 GLN 99 O 0.0218 -0.0286 0.0255 3500 GLN 99 CB 0.0291 -0.0229 0.0249 3501 GLN 99 CG 0.0307 -0.0277 0.0269 3502 GLN 99 CD 0.0355 -0.0279 0.0279 3503 GLN 99 OE1 0.0379 -0.0243 0.0271 3504 GLN 99 NE2 0.0371 -0.0320 0.0295 3505 VAL 37 N -0.0079 -0.0274 0.0109 3506 VAL 37 CA -0.0086 -0.0259 0.0103 3507 VAL 37 C -0.0061 -0.0247 0.0103 3508 VAL 37 O -0.0058 -0.0239 0.0100 3509 VAL 37 CB -0.0101 -0.0273 0.0105 3510 VAL 37 CG1 -0.0127 -0.0278 0.0102 3511 VAL 37 CG2 -0.0089 -0.0298 0.0114 3512 LEU 38 N -0.0043 -0.0245 0.0105 3513 LEU 38 CA -0.0018 -0.0234 0.0105 3514 LEU 38 C -0.0019 -0.0206 0.0096 3515 LEU 38 O -0.0009 -0.0197 0.0095 3516 LEU 38 CB 0.0001 -0.0239 0.0109 3517 LEU 38 CG 0.0017 -0.0262 0.0119 3518 LEU 38 CD1 0.0036 -0.0262 0.0122 3519 LEU 38 CD2 0.0000 -0.0285 0.0124 3520 TYR 39 N -0.0031 -0.0193 0.0090 3521 TYR 39 CA -0.0036 -0.0167 0.0081 3522 TYR 39 C -0.0011 -0.0152 0.0080 3523 TYR 39 O -0.0005 -0.0140 0.0077 3524 TYR 39 CB -0.0053 -0.0161 0.0077 3525 TYR 39 CG -0.0080 -0.0171 0.0076 3526 TYR 39 CD1 -0.0097 -0.0158 0.0069 3527 TYR 39 CD2 -0.0089 -0.0192 0.0081 3528 TYR 39 CE1 -0.0122 -0.0167 0.0068 3529 TYR 39 CE2 -0.0114 -0.0200 0.0080 3530 TYR 39 CZ -0.0130 -0.0188 0.0074 3531 TYR 39 OH -0.0155 -0.0196 0.0073 3532 VAL 40 N 0.0005 -0.0153 0.0083 3533 VAL 40 CA 0.0028 -0.0139 0.0082 3534 VAL 40 C 0.0024 -0.0112 0.0073 3535 VAL 40 O 0.0035 -0.0096 0.0069 3536 VAL 40 CB 0.0046 -0.0149 0.0088 3537 VAL 40 CG1 0.0071 -0.0134 0.0087 3538 VAL 40 CG2 0.0051 -0.0176 0.0097 3539 GLY 41 N -0.0009 -0.0095 0.0065 3540 GLY 41 CA -0.0014 -0.0078 0.0057 3541 GLY 41 C -0.0034 -0.0075 0.0052 3542 GLY 41 O -0.0044 -0.0069 0.0047 3543 SER 42 N -0.0039 -0.0080 0.0053 3544 SER 42 CA -0.0058 -0.0081 0.0050 3545 SER 42 C -0.0067 -0.0063 0.0041 3546 SER 42 O -0.0082 -0.0062 0.0038 3547 SER 42 CB -0.0060 -0.0088 0.0053 3548 SER 42 OG -0.0079 -0.0089 0.0051 3549 LYS 43 N -0.0056 -0.0050 0.0037 3550 LYS 43 CA -0.0061 -0.0032 0.0028 3551 LYS 43 C -0.0043 -0.0021 0.0026 3552 LYS 43 O -0.0034 -0.0020 0.0027 3553 LYS 43 CB -0.0075 -0.0026 0.0023 3554 LYS 43 CG -0.0082 -0.0009 0.0014 3555 LYS 43 CD -0.0097 -0.0004 0.0009 3556 LYS 43 CE -0.0105 0.0013 0.0000 3557 LYS 43 NZ -0.0091 0.0027 -0.0004 3558 THR 44 N -0.0037 -0.0012 0.0023 3559 THR 44 CA -0.0022 0.0001 0.0020 3560 THR 44 C -0.0029 0.0018 0.0011 3561 THR 44 O -0.0042 0.0017 0.0009 3562 THR 44 CB -0.0006 -0.0004 0.0025 3563 THR 44 OG1 -0.0011 -0.0005 0.0024 3564 THR 44 CG2 0.0001 -0.0021 0.0033 3565 LYS 45 N -0.0023 0.0025 0.0005 3566 LYS 45 CA -0.0025 0.0026 -0.0001 3567 LYS 45 C -0.0021 0.0028 -0.0002 3568 LYS 45 O -0.0016 0.0031 -0.0004 3569 LYS 45 CB -0.0025 0.0027 -0.0006 3570 LYS 45 CG -0.0027 0.0027 -0.0012 3571 LYS 45 CD -0.0028 0.0028 -0.0017 3572 LYS 45 CE -0.0031 0.0028 -0.0023 3573 LYS 45 NZ -0.0032 0.0028 -0.0027 3574 GLU 46 N -0.0022 0.0027 -0.0002 3575 GLU 46 CA -0.0018 0.0029 -0.0001 3576 GLU 46 C -0.0020 0.0029 -0.0004 3577 GLU 46 O -0.0025 0.0026 -0.0003 3578 GLU 46 CB -0.0016 0.0029 0.0006 3579 GLU 46 CG -0.0021 0.0026 0.0010 3580 GLU 46 CD -0.0018 0.0025 0.0017 3581 GLU 46 OE1 -0.0013 0.0028 0.0018 3582 GLU 46 OE2 -0.0021 0.0023 0.0021 3583 GLY 47 N -0.0018 0.0031 -0.0009 3584 GLY 47 CA -0.0020 0.0031 -0.0012 3585 GLY 47 C -0.0024 0.0030 -0.0018 3586 GLY 47 O -0.0028 0.0029 -0.0019 3587 VAL 48 N -0.0023 0.0032 -0.0021 3588 VAL 48 CA -0.0027 0.0031 -0.0025 3589 VAL 48 C -0.0024 0.0033 -0.0031 3590 VAL 48 O -0.0019 0.0036 -0.0032 3591 VAL 48 CB -0.0028 0.0029 -0.0023 3592 VAL 48 CG1 -0.0032 0.0028 -0.0028 3593 VAL 48 CG2 -0.0030 0.0027 -0.0017 3594 VAL 49 N -0.0023 0.0028 -0.0039 3595 VAL 49 CA -0.0021 0.0026 -0.0043 3596 VAL 49 C -0.0020 0.0024 -0.0046 3597 VAL 49 O -0.0022 0.0021 -0.0046 3598 VAL 49 CB -0.0023 0.0024 -0.0043 3599 VAL 49 CG1 -0.0021 0.0022 -0.0047 3600 VAL 49 CG2 -0.0023 0.0026 -0.0040 3601 HIS 50 N -0.0016 0.0026 -0.0049 3602 HIS 50 CA -0.0015 0.0023 -0.0052 3603 HIS 50 C -0.0012 0.0023 -0.0056 3604 HIS 50 O -0.0009 0.0026 -0.0057 3605 HIS 50 CB -0.0015 0.0025 -0.0051 3606 HIS 50 CG -0.0011 0.0029 -0.0051 3607 HIS 50 ND1 -0.0008 0.0030 -0.0054 3608 HIS 50 CD2 -0.0011 0.0033 -0.0047 3609 HIS 50 CE1 -0.0006 0.0034 -0.0052 3610 HIS 50 NE2 -0.0008 0.0036 -0.0048 3611 GLY 51 N -0.0012 0.0020 -0.0060 3612 GLY 51 CA -0.0009 0.0019 -0.0064 3613 GLY 51 C -0.0008 0.0019 -0.0065 3614 GLY 51 O -0.0006 0.0021 -0.0065 3615 VAL 52 N -0.0011 0.0015 -0.0065 3616 VAL 52 CA -0.0011 0.0014 -0.0066 3617 VAL 52 C -0.0012 0.0010 -0.0069 3618 VAL 52 O -0.0014 0.0007 -0.0070 3619 VAL 52 CB -0.0015 0.0014 -0.0062 3620 VAL 52 CG1 -0.0015 0.0013 -0.0063 3621 VAL 52 CG2 -0.0014 0.0018 -0.0058 3622 ALA 53 N -0.0004 0.0009 -0.0070 3623 ALA 53 CA -0.0004 0.0006 -0.0070 3624 ALA 53 C -0.0006 0.0004 -0.0070 3625 ALA 53 O -0.0006 0.0004 -0.0070 3626 ALA 53 CB -0.0000 0.0005 -0.0069 3627 THR 54 N -0.0007 0.0001 -0.0070 3628 THR 54 CA -0.0009 -0.0001 -0.0071 3629 THR 54 C -0.0009 -0.0004 -0.0071 3630 THR 54 O -0.0008 -0.0004 -0.0071 3631 THR 54 CB -0.0013 0.0000 -0.0071 3632 THR 54 OG1 -0.0013 0.0003 -0.0071 3633 THR 54 CG2 -0.0015 -0.0002 -0.0071 3634 VAL 55 N -0.0008 -0.0007 -0.0071 3635 VAL 55 CA -0.0008 -0.0010 -0.0071 3636 VAL 55 C -0.0010 -0.0012 -0.0072 3637 VAL 55 O -0.0011 -0.0012 -0.0072 3638 VAL 55 CB -0.0005 -0.0011 -0.0071 3639 VAL 55 CG1 -0.0004 -0.0015 -0.0071 3640 VAL 55 CG2 -0.0002 -0.0009 -0.0071 3641 ALA 56 N -0.0012 -0.0013 -0.0072 3642 ALA 56 CA -0.0015 -0.0016 -0.0072 3643 ALA 56 C -0.0014 -0.0019 -0.0072 3644 ALA 56 O -0.0015 -0.0019 -0.0072 3645 ALA 56 CB -0.0018 -0.0014 -0.0072 3646 GLU 57 N -0.0012 -0.0021 -0.0071 3647 GLU 57 CA -0.0013 -0.0024 -0.0075 3648 GLU 57 C -0.0014 -0.0027 -0.0079 3649 GLU 57 O -0.0011 -0.0029 -0.0080 3650 GLU 57 CB -0.0008 -0.0026 -0.0075 3651 GLU 57 CG -0.0006 -0.0024 -0.0071 3652 GLU 57 CD -0.0001 -0.0026 -0.0072 3653 GLU 57 OE1 0.0001 -0.0030 -0.0074 3654 GLU 57 OE2 0.0000 -0.0025 -0.0069 3655 LYS 58 N -0.0020 -0.0027 -0.0081 3656 LYS 58 CA -0.0022 -0.0029 -0.0085 3657 LYS 58 C -0.0024 -0.0031 -0.0089 3658 LYS 58 O -0.0029 -0.0030 -0.0089 3659 LYS 58 CB -0.0026 -0.0026 -0.0084 3660 LYS 58 CG -0.0023 -0.0023 -0.0080 3661 LYS 58 CD -0.0028 -0.0021 -0.0079 3662 LYS 58 CE -0.0025 -0.0018 -0.0075 3663 LYS 58 NZ -0.0029 -0.0016 -0.0074 3664 THR 59 N -0.0022 -0.0035 -0.0092 3665 THR 59 CA -0.0024 -0.0038 -0.0096 3666 THR 59 C -0.0029 -0.0038 -0.0099 3667 THR 59 O -0.0033 -0.0039 -0.0101 3668 THR 59 CB -0.0020 -0.0042 -0.0098 3669 THR 59 OG1 -0.0015 -0.0042 -0.0096 3670 THR 59 CG2 -0.0021 -0.0045 -0.0102 3671 LYS 60 N -0.0030 -0.0038 -0.0099 3672 LYS 60 CA -0.0035 -0.0038 -0.0101 3673 LYS 60 C -0.0036 -0.0035 -0.0099 3674 LYS 60 O -0.0033 -0.0036 -0.0099 3675 LYS 60 CB -0.0035 -0.0042 -0.0106 3676 LYS 60 CG -0.0041 -0.0042 -0.0109 3677 LYS 60 CD -0.0041 -0.0046 -0.0114 3678 LYS 60 CE -0.0046 -0.0046 -0.0117 3679 LYS 60 NZ -0.0046 -0.0051 -0.0121 3680 GLU 61 N -0.0042 -0.0033 -0.0098 3681 GLU 61 CA -0.0042 -0.0030 -0.0092 3682 GLU 61 C -0.0048 -0.0032 -0.0091 3683 GLU 61 O -0.0053 -0.0034 -0.0090 3684 GLU 61 CB -0.0043 -0.0028 -0.0087 3685 GLU 61 CG -0.0043 -0.0025 -0.0081 3686 GLU 61 CD -0.0043 -0.0023 -0.0077 3687 GLU 61 OE1 -0.0043 -0.0024 -0.0078 3688 GLU 61 OE2 -0.0044 -0.0021 -0.0071 3689 GLN 62 N -0.0047 -0.0031 -0.0090 3690 GLN 62 CA -0.0052 -0.0033 -0.0089 3691 GLN 62 C -0.0052 -0.0030 -0.0083 3692 GLN 62 O -0.0047 -0.0028 -0.0083 3693 GLN 62 CB -0.0051 -0.0035 -0.0094 3694 GLN 62 CG -0.0056 -0.0037 -0.0094 3695 GLN 62 CD -0.0055 -0.0039 -0.0100 3696 GLN 62 OE1 -0.0051 -0.0040 -0.0103 3697 GLN 62 NE2 -0.0060 -0.0041 -0.0100 3698 VAL 63 N -0.0057 -0.0030 -0.0079 3699 VAL 63 CA -0.0057 -0.0027 -0.0074 3700 VAL 63 C -0.0063 -0.0029 -0.0073 3701 VAL 63 O -0.0068 -0.0030 -0.0072 3702 VAL 63 CB -0.0057 -0.0024 -0.0069 3703 VAL 63 CG1 -0.0058 -0.0022 -0.0063 3704 VAL 63 CG2 -0.0052 -0.0023 -0.0069 3705 THR 64 N -0.0063 -0.0029 -0.0075 3706 THR 64 CA -0.0068 -0.0031 -0.0075 3707 THR 64 C -0.0067 -0.0029 -0.0071 3708 THR 64 O -0.0063 -0.0029 -0.0072 3709 THR 64 CB -0.0069 -0.0035 -0.0081 3710 THR 64 OG1 -0.0064 -0.0034 -0.0083 3711 THR 64 CG2 -0.0068 -0.0037 -0.0085 3712 ASN 65 N -0.0070 -0.0025 -0.0065 3713 ASN 65 CA -0.0067 -0.0022 -0.0058 3714 ASN 65 C -0.0073 -0.0025 -0.0055 3715 ASN 65 O -0.0080 -0.0029 -0.0056 3716 ASN 65 CB -0.0064 -0.0018 -0.0051 3717 ASN 65 CG -0.0071 -0.0021 -0.0044 3718 ASN 65 OD1 -0.0077 -0.0024 -0.0043 3719 ASN 65 ND2 -0.0068 -0.0018 -0.0040 3720 VAL 66 N -0.0071 -0.0022 -0.0051 3721 VAL 66 CA -0.0076 -0.0024 -0.0046 3722 VAL 66 C -0.0074 -0.0021 -0.0037 3723 VAL 66 O -0.0067 -0.0016 -0.0036 3724 VAL 66 CB -0.0076 -0.0026 -0.0051 3725 VAL 66 CG1 -0.0076 -0.0028 -0.0060 3726 VAL 66 CG2 -0.0070 -0.0021 -0.0048 3727 GLY 67 N -0.0080 -0.0023 -0.0031 3728 GLY 67 CA -0.0079 -0.0020 -0.0022 3729 GLY 67 C -0.0075 -0.0017 -0.0018 3730 GLY 67 O -0.0074 -0.0014 -0.0010 3731 GLY 68 N -0.0072 -0.0016 -0.0022 3732 GLY 68 CA -0.0068 -0.0013 -0.0019 3733 GLY 68 C -0.0070 -0.0015 -0.0021 3734 GLY 68 O -0.0076 -0.0019 -0.0024 3735 ALA 69 N -0.0069 -0.0015 -0.0019 3736 ALA 69 CA -0.0070 -0.0016 -0.0020 3737 ALA 69 C -0.0064 -0.0013 -0.0023 3738 ALA 69 O -0.0060 -0.0008 -0.0021 3739 ALA 69 CB -0.0072 -0.0014 -0.0012 3740 VAL 70 N -0.0064 -0.0015 -0.0030 3741 VAL 70 CA -0.0059 -0.0013 -0.0034 3742 VAL 70 C -0.0060 -0.0014 -0.0035 3743 VAL 70 O -0.0064 -0.0018 -0.0036 3744 VAL 70 CB -0.0057 -0.0015 -0.0042 3745 VAL 70 CG1 -0.0052 -0.0013 -0.0046 3746 VAL 70 CG2 -0.0056 -0.0014 -0.0041 3747 VAL 71 N -0.0055 -0.0010 -0.0034 3748 VAL 71 CA -0.0055 -0.0010 -0.0035 3749 VAL 71 C -0.0050 -0.0009 -0.0041 3750 VAL 71 O -0.0045 -0.0005 -0.0042 3751 VAL 71 CB -0.0054 -0.0006 -0.0028 3752 VAL 71 CG1 -0.0053 -0.0006 -0.0030 3753 VAL 71 CG2 -0.0059 -0.0007 -0.0022 3754 THR 72 N -0.0051 -0.0012 -0.0046 3755 THR 72 CA -0.0047 -0.0012 -0.0053 3756 THR 72 C -0.0047 -0.0012 -0.0054 3757 THR 72 O -0.0051 -0.0016 -0.0055 3758 THR 72 CB -0.0048 -0.0016 -0.0059 3759 THR 72 OG1 -0.0054 -0.0021 -0.0060 3760 THR 72 CG2 -0.0049 -0.0016 -0.0058 3761 GLY 73 N -0.0041 -0.0007 -0.0055 3762 GLY 73 CA -0.0038 -0.0006 -0.0057 3763 GLY 73 C -0.0039 -0.0005 -0.0055 3764 GLY 73 O -0.0040 -0.0008 -0.0057 3765 VAL 74 N -0.0039 -0.0001 -0.0051 3766 VAL 74 CA -0.0040 0.0000 -0.0049 3767 VAL 74 C -0.0035 0.0003 -0.0050 3768 VAL 74 O -0.0031 0.0005 -0.0052 3769 VAL 74 CB -0.0043 0.0003 -0.0043 3770 VAL 74 CG1 -0.0048 0.0001 -0.0042 3771 VAL 74 CG2 -0.0040 0.0008 -0.0041 3772 THR 75 N -0.0035 0.0003 -0.0051 3773 THR 75 CA -0.0030 0.0005 -0.0053 3774 THR 75 C -0.0031 0.0007 -0.0050 3775 THR 75 O -0.0035 0.0004 -0.0049 3776 THR 75 CB -0.0028 0.0001 -0.0058 3777 THR 75 OG1 -0.0027 -0.0001 -0.0060 3778 THR 75 CG2 -0.0023 0.0003 -0.0060 3779 ALA 76 N -0.0027 0.0011 -0.0049 3780 ALA 76 CA -0.0027 0.0013 -0.0047 3781 ALA 76 C -0.0031 0.0014 -0.0042 3782 ALA 76 O -0.0034 0.0013 -0.0042 3783 ALA 76 CB -0.0026 0.0010 -0.0051 3784 VAL 77 N -0.0033 0.0014 -0.0041 3785 VAL 77 CA -0.0037 0.0013 -0.0036 3786 VAL 77 C -0.0035 0.0017 -0.0031 3787 VAL 77 O -0.0031 0.0020 -0.0031 3788 VAL 77 CB -0.0038 0.0013 -0.0035 3789 VAL 77 CG1 -0.0041 0.0012 -0.0030 3790 VAL 77 CG2 -0.0039 0.0010 -0.0040 3791 ALA 78 N -0.0038 0.0016 -0.0028 3792 ALA 78 CA -0.0036 0.0019 -0.0024 3793 ALA 78 C -0.0040 0.0018 -0.0019 3794 ALA 78 O -0.0043 0.0016 -0.0018 3795 ALA 78 CB -0.0034 0.0020 -0.0025 3796 GLN 79 N -0.0039 0.0020 -0.0014 3797 GLN 79 CA -0.0043 0.0019 -0.0010 3798 GLN 79 C -0.0041 0.0022 -0.0005 3799 GLN 79 O -0.0037 0.0025 -0.0006 3800 GLN 79 CB -0.0045 0.0018 -0.0008 3801 GLN 79 CG -0.0042 0.0021 -0.0007 3802 GLN 79 CD -0.0045 0.0019 -0.0005 3803 GLN 79 OE1 -0.0049 0.0016 -0.0005 3804 GLN 79 NE2 -0.0042 0.0022 -0.0004 3805 LYS 80 N -0.0044 0.0022 -0.0001 3806 LYS 80 CA -0.0042 0.0025 0.0004 3807 LYS 80 C -0.0046 0.0024 0.0008 3808 LYS 80 O -0.0050 0.0021 0.0008 3809 LYS 80 CB -0.0042 0.0026 0.0005 3810 LYS 80 CG -0.0040 0.0029 0.0010 3811 LYS 80 CD -0.0040 0.0030 0.0011 3812 LYS 80 CE -0.0037 0.0033 0.0016 3813 LYS 80 NZ -0.0037 0.0034 0.0018 3814 THR 81 N -0.0048 0.0028 0.0013 3815 THR 81 CA -0.0052 0.0028 0.0016 3816 THR 81 C -0.0050 0.0032 0.0021 3817 THR 81 O -0.0046 0.0035 0.0022 3818 THR 81 CB -0.0052 0.0027 0.0015 3819 THR 81 OG1 -0.0053 0.0024 0.0010 3820 THR 81 CG2 -0.0056 0.0027 0.0018 3821 VAL 82 N -0.0054 0.0033 0.0025 3822 VAL 82 CA -0.0054 0.0036 0.0030 3823 VAL 82 C -0.0058 0.0036 0.0032 3824 VAL 82 O -0.0062 0.0033 0.0032 3825 VAL 82 CB -0.0055 0.0037 0.0032 3826 VAL 82 CG1 -0.0055 0.0040 0.0037 3827 VAL 82 CG2 -0.0051 0.0038 0.0030 3828 GLU 83 N -0.0056 0.0038 0.0034 3829 GLU 83 CA -0.0059 0.0038 0.0037 3830 GLU 83 C -0.0062 0.0034 0.0034 3831 GLU 83 O -0.0066 0.0033 0.0035 3832 GLU 83 CB -0.0062 0.0039 0.0042 3833 GLU 83 CG -0.0059 0.0043 0.0045 3834 GLU 83 CD -0.0063 0.0044 0.0050 3835 GLU 83 OE1 -0.0068 0.0042 0.0050 3836 GLU 83 OE2 -0.0061 0.0047 0.0053 3837 GLY 84 N -0.0059 0.0033 0.0030 3838 GLY 84 CA -0.0061 0.0030 0.0027 3839 GLY 84 C -0.0057 0.0030 0.0023 3840 GLY 84 O -0.0053 0.0032 0.0022 3841 ALA 85 N -0.0058 0.0028 0.0022 3842 ALA 85 CA -0.0056 0.0028 0.0019 3843 ALA 85 C -0.0056 0.0024 0.0015 3844 ALA 85 O -0.0059 0.0021 0.0014 3845 ALA 85 CB -0.0058 0.0028 0.0021 3846 GLY 86 N -0.0052 0.0025 0.0011 3847 GLY 86 CA -0.0051 0.0022 0.0007 3848 GLY 86 C -0.0049 0.0021 0.0004 3849 GLY 86 O -0.0046 0.0024 0.0002 3850 SER 87 N -0.0051 0.0018 0.0003 3851 SER 87 CA -0.0049 0.0017 -0.0000 3852 SER 87 C -0.0049 0.0013 -0.0004 3853 SER 87 O -0.0052 0.0010 -0.0005 3854 SER 87 CB -0.0052 0.0016 0.0002 3855 SER 87 OG -0.0052 0.0020 0.0006 3856 ILE 88 N -0.0046 0.0014 -0.0008 3857 ILE 88 CA -0.0045 0.0011 -0.0012 3858 ILE 88 C -0.0046 0.0007 -0.0014 3859 ILE 88 O -0.0049 0.0004 -0.0015 3860 ILE 88 CB -0.0041 0.0013 -0.0015 3861 ILE 88 CG1 -0.0041 0.0015 -0.0012 3862 ILE 88 CG2 -0.0041 0.0009 -0.0019 3863 ILE 88 CD1 -0.0037 0.0017 -0.0014 3864 ALA 89 N -0.0045 0.0002 -0.0016 3865 ALA 89 CA -0.0046 -0.0001 -0.0020 3866 ALA 89 C -0.0046 0.0003 -0.0013 3867 ALA 89 O -0.0041 0.0008 -0.0014 3868 ALA 89 CB -0.0041 0.0001 -0.0028 3869 ALA 90 N -0.0051 -0.0001 -0.0007 3870 ALA 90 CA -0.0052 0.0002 -0.0001 3871 ALA 90 C -0.0055 -0.0004 -0.0002 3872 ALA 90 O -0.0058 -0.0010 -0.0006 3873 ALA 90 CB -0.0055 0.0002 0.0008 3874 ALA 91 N -0.0054 -0.0001 0.0000 3875 ALA 91 CA -0.0057 -0.0005 -0.0001 3876 ALA 91 C -0.0057 -0.0002 0.0006 3877 ALA 91 O -0.0052 0.0005 0.0007 3878 ALA 91 CB -0.0053 -0.0005 -0.0010 3879 THR 92 N -0.0062 -0.0006 0.0011 3880 THR 92 CA -0.0063 -0.0004 0.0018 3881 THR 92 C -0.0066 -0.0009 0.0016 3882 THR 92 O -0.0070 -0.0016 0.0013 3883 THR 92 CB -0.0067 -0.0004 0.0027 3884 THR 92 OG1 -0.0073 -0.0012 0.0027 3885 THR 92 CG2 -0.0064 0.0000 0.0028 3886 GLY 93 N -0.0065 -0.0005 0.0018 3887 GLY 93 CA -0.0065 -0.0002 0.0013 3888 GLY 93 C -0.0063 -0.0006 0.0023 3889 GLY 93 O -0.0068 -0.0009 0.0020 3890 PHE 94 N -0.0056 -0.0008 0.0034 3891 PHE 94 CA -0.0053 -0.0011 0.0044 3892 PHE 94 C -0.0052 -0.0017 0.0056 3893 PHE 94 O -0.0047 -0.0015 0.0058 3894 PHE 94 CB -0.0042 -0.0004 0.0045 3895 PHE 94 CG -0.0043 0.0002 0.0035 3896 PHE 94 CD1 -0.0046 -0.0001 0.0036 3897 PHE 94 CD2 -0.0040 0.0010 0.0024 3898 PHE 94 CE1 -0.0047 0.0003 0.0027 3899 PHE 94 CE2 -0.0041 0.0014 0.0015 3900 PHE 94 CZ -0.0045 0.0011 0.0016 3901 VAL 95 N -0.0057 -0.0025 0.0064 3902 VAL 95 CA -0.0055 -0.0031 0.0076 3903 VAL 95 C -0.0052 -0.0034 0.0085 3904 VAL 95 O -0.0059 -0.0039 0.0084 3905 VAL 95 CB -0.0065 -0.0040 0.0078 3906 VAL 95 CG1 -0.0063 -0.0046 0.0091 3907 VAL 95 CG2 -0.0067 -0.0037 0.0070 3908 LYS 96 N -0.0042 -0.0032 0.0094 3909 LYS 96 CA -0.0038 -0.0034 0.0103 3910 LYS 96 C -0.0036 -0.0040 0.0116 3911 LYS 96 O -0.0037 -0.0042 0.0118 3912 LYS 96 CB -0.0028 -0.0025 0.0101 3913 LYS 96 CG -0.0030 -0.0020 0.0089 3914 LYS 96 CD -0.0036 -0.0024 0.0088 3915 LYS 96 CE -0.0038 -0.0018 0.0076 3916 LYS 96 NZ -0.0027 -0.0010 0.0074 3917 LYS 97 N -0.0006 -0.0055 0.0132 3918 LYS 97 CA 0.0010 -0.0098 0.0151 3919 LYS 97 C 0.0058 -0.0094 0.0158 3920 LYS 97 O 0.0071 -0.0067 0.0151 3921 LYS 97 CB -0.0019 -0.0127 0.0156 3922 LYS 97 CG -0.0007 -0.0174 0.0174 3923 LYS 97 CD -0.0017 -0.0195 0.0180 3924 LYS 97 CE -0.0004 -0.0241 0.0199 3925 LYS 97 NZ -0.0032 -0.0267 0.0203 3926 ASP 98 N 0.0085 -0.0121 0.0173 3927 ASP 98 CA 0.0131 -0.0125 0.0183 3928 ASP 98 C 0.0138 -0.0173 0.0202 3929 ASP 98 O 0.0108 -0.0200 0.0206 3930 ASP 98 CB 0.0163 -0.0100 0.0180 3931 ASP 98 CG 0.0208 -0.0090 0.0185 3932 ASP 98 OD1 0.0216 -0.0104 0.0192 3933 ASP 98 OD2 0.0237 -0.0068 0.0183 3934 GLN 99 N 0.0179 -0.0183 0.0213 3935 GLN 99 CA 0.0191 -0.0227 0.0231 3936 GLN 99 C 0.0191 -0.0248 0.0239 3937 GLN 99 O 0.0171 -0.0283 0.0247 3938 GLN 99 CB 0.0238 -0.0229 0.0241 3939 GLN 99 CG 0.0253 -0.0273 0.0259 3940 GLN 99 CD 0.0298 -0.0274 0.0268 3941 GLN 99 OE1 0.0320 -0.0241 0.0261 3942 GLN 99 NE2 0.0313 -0.0312 0.0285 3943 VAL 37 N -0.0095 -0.0284 0.0109 3944 VAL 37 CA -0.0102 -0.0269 0.0103 3945 VAL 37 C -0.0077 -0.0257 0.0103 3946 VAL 37 O -0.0075 -0.0249 0.0101 3947 VAL 37 CB -0.0117 -0.0284 0.0106 3948 VAL 37 CG1 -0.0144 -0.0288 0.0104 3949 VAL 37 CG2 -0.0105 -0.0308 0.0115 3950 LEU 38 N -0.0059 -0.0254 0.0105 3951 LEU 38 CA -0.0034 -0.0243 0.0105 3952 LEU 38 C -0.0035 -0.0215 0.0096 3953 LEU 38 O -0.0025 -0.0206 0.0094 3954 LEU 38 CB -0.0015 -0.0248 0.0109 3955 LEU 38 CG 0.0001 -0.0271 0.0118 3956 LEU 38 CD1 0.0021 -0.0271 0.0121 3957 LEU 38 CD2 -0.0015 -0.0295 0.0123 3958 TYR 39 N -0.0048 -0.0202 0.0090 3959 TYR 39 CA -0.0053 -0.0176 0.0081 3960 TYR 39 C -0.0028 -0.0160 0.0080 3961 TYR 39 O -0.0023 -0.0148 0.0077 3962 TYR 39 CB -0.0071 -0.0171 0.0077 3963 TYR 39 CG -0.0098 -0.0180 0.0077 3964 TYR 39 CD1 -0.0115 -0.0167 0.0070 3965 TYR 39 CD2 -0.0107 -0.0202 0.0082 3966 TYR 39 CE1 -0.0140 -0.0176 0.0070 3967 TYR 39 CE2 -0.0132 -0.0210 0.0081 3968 TYR 39 CZ -0.0148 -0.0197 0.0075 3969 TYR 39 OH -0.0173 -0.0206 0.0074 3970 VAL 40 N -0.0012 -0.0161 0.0082 3971 VAL 40 CA 0.0012 -0.0146 0.0081 3972 VAL 40 C 0.0006 -0.0119 0.0072 3973 VAL 40 O 0.0018 -0.0103 0.0069 3974 VAL 40 CB 0.0030 -0.0157 0.0087 3975 VAL 40 CG1 0.0055 -0.0141 0.0085 3976 VAL 40 CG2 0.0035 -0.0183 0.0096 3977 GLY 41 N -0.0025 -0.0103 0.0065 3978 GLY 41 CA -0.0030 -0.0086 0.0056 3979 GLY 41 C -0.0050 -0.0083 0.0052 3980 GLY 41 O -0.0060 -0.0076 0.0048 3981 SER 42 N -0.0055 -0.0088 0.0054 3982 SER 42 CA -0.0075 -0.0089 0.0051 3983 SER 42 C -0.0084 -0.0071 0.0042 3984 SER 42 O -0.0100 -0.0070 0.0039 3985 SER 42 CB -0.0077 -0.0097 0.0055 3986 SER 42 OG -0.0096 -0.0098 0.0052 3987 LYS 43 N -0.0073 -0.0058 0.0038 3988 LYS 43 CA -0.0078 -0.0040 0.0029 3989 LYS 43 C -0.0060 -0.0028 0.0026 3990 LYS 43 O -0.0052 -0.0028 0.0028 3991 LYS 43 CB -0.0093 -0.0034 0.0024 3992 LYS 43 CG -0.0100 -0.0017 0.0016 3993 LYS 43 CD -0.0116 -0.0012 0.0011 3994 LYS 43 CE -0.0124 0.0005 0.0002 3995 LYS 43 NZ -0.0109 0.0020 -0.0002 3996 THR 44 N -0.0055 -0.0019 0.0023 3997 THR 44 CA -0.0039 -0.0006 0.0020 3998 THR 44 C -0.0046 0.0011 0.0011 3999 THR 44 O -0.0060 0.0011 0.0009 4000 THR 44 CB -0.0022 -0.0011 0.0024 4001 THR 44 OG1 -0.0028 -0.0011 0.0023 4002 THR 44 CG2 -0.0015 -0.0028 0.0033 4003 LYS 45 N -0.0036 0.0021 0.0004 4004 LYS 45 CA -0.0038 0.0021 -0.0001 4005 LYS 45 C -0.0034 0.0024 -0.0002 4006 LYS 45 O -0.0030 0.0026 -0.0004 4007 LYS 45 CB -0.0038 0.0022 -0.0005 4008 LYS 45 CG -0.0040 0.0023 -0.0011 4009 LYS 45 CD -0.0041 0.0023 -0.0015 4010 LYS 45 CE -0.0044 0.0024 -0.0021 4011 LYS 45 NZ -0.0045 0.0024 -0.0024 4012 GLU 46 N -0.0035 0.0023 -0.0002 4013 GLU 46 CA -0.0031 0.0025 -0.0002 4014 GLU 46 C -0.0033 0.0024 -0.0004 4015 GLU 46 O -0.0037 0.0022 -0.0003 4016 GLU 46 CB -0.0029 0.0024 0.0005 4017 GLU 46 CG -0.0033 0.0021 0.0009 4018 GLU 46 CD -0.0031 0.0021 0.0014 4019 GLU 46 OE1 -0.0026 0.0023 0.0015 4020 GLU 46 OE2 -0.0034 0.0018 0.0018 4021 GLY 47 N -0.0031 0.0027 -0.0009 4022 GLY 47 CA -0.0033 0.0027 -0.0012 4023 GLY 47 C -0.0036 0.0026 -0.0017 4024 GLY 47 O -0.0040 0.0025 -0.0018 4025 VAL 48 N -0.0036 0.0027 -0.0019 4026 VAL 48 CA -0.0039 0.0026 -0.0023 4027 VAL 48 C -0.0037 0.0029 -0.0029 4028 VAL 48 O -0.0033 0.0031 -0.0029 4029 VAL 48 CB -0.0041 0.0025 -0.0021 4030 VAL 48 CG1 -0.0045 0.0024 -0.0025 4031 VAL 48 CG2 -0.0043 0.0023 -0.0016 4032 VAL 49 N -0.0032 0.0026 -0.0035 4033 VAL 49 CA -0.0030 0.0024 -0.0040 4034 VAL 49 C -0.0028 0.0022 -0.0043 4035 VAL 49 O -0.0031 0.0019 -0.0043 4036 VAL 49 CB -0.0032 0.0021 -0.0040 4037 VAL 49 CG1 -0.0030 0.0019 -0.0045 4038 VAL 49 CG2 -0.0033 0.0023 -0.0037 4039 HIS 50 N -0.0024 0.0023 -0.0046 4040 HIS 50 CA -0.0023 0.0021 -0.0049 4041 HIS 50 C -0.0019 0.0021 -0.0054 4042 HIS 50 O -0.0016 0.0024 -0.0054 4043 HIS 50 CB -0.0022 0.0023 -0.0048 4044 HIS 50 CG -0.0019 0.0027 -0.0047 4045 HIS 50 ND1 -0.0015 0.0028 -0.0051 4046 HIS 50 CD2 -0.0019 0.0031 -0.0044 4047 HIS 50 CE1 -0.0013 0.0033 -0.0049 4048 HIS 50 NE2 -0.0015 0.0035 -0.0045 4049 GLY 51 N -0.0019 0.0017 -0.0057 4050 GLY 51 CA -0.0016 0.0016 -0.0061 4051 GLY 51 C -0.0015 0.0015 -0.0063 4052 GLY 51 O -0.0012 0.0018 -0.0063 4053 VAL 52 N -0.0019 0.0012 -0.0063 4054 VAL 52 CA -0.0019 0.0010 -0.0064 4055 VAL 52 C -0.0019 0.0006 -0.0068 4056 VAL 52 O -0.0021 0.0003 -0.0068 4057 VAL 52 CB -0.0023 0.0010 -0.0060 4058 VAL 52 CG1 -0.0023 0.0008 -0.0061 4059 VAL 52 CG2 -0.0022 0.0015 -0.0056 4060 ALA 53 N -0.0008 0.0008 -0.0068 4061 ALA 53 CA -0.0007 0.0005 -0.0069 4062 ALA 53 C -0.0009 0.0003 -0.0069 4063 ALA 53 O -0.0010 0.0003 -0.0069 4064 ALA 53 CB -0.0004 0.0004 -0.0068 4065 THR 54 N -0.0010 0.0001 -0.0069 4066 THR 54 CA -0.0013 -0.0002 -0.0070 4067 THR 54 C -0.0012 -0.0005 -0.0070 4068 THR 54 O -0.0012 -0.0005 -0.0070 4069 THR 54 CB -0.0016 -0.0001 -0.0070 4070 THR 54 OG1 -0.0016 0.0002 -0.0070 4071 THR 54 CG2 -0.0018 -0.0003 -0.0070 4072 VAL 55 N -0.0012 -0.0007 -0.0070 4073 VAL 55 CA -0.0011 -0.0010 -0.0071 4074 VAL 55 C -0.0014 -0.0012 -0.0071 4075 VAL 55 O -0.0014 -0.0012 -0.0071 4076 VAL 55 CB -0.0008 -0.0012 -0.0071 4077 VAL 55 CG1 -0.0008 -0.0015 -0.0071 4078 VAL 55 CG2 -0.0006 -0.0010 -0.0070 4079 ALA 56 N -0.0016 -0.0014 -0.0072 4080 ALA 56 CA -0.0018 -0.0016 -0.0072 4081 ALA 56 C -0.0018 -0.0019 -0.0072 4082 ALA 56 O -0.0018 -0.0019 -0.0072 4083 ALA 56 CB -0.0021 -0.0015 -0.0072 4084 GLU 57 N -0.0017 -0.0023 -0.0071 4085 GLU 57 CA -0.0017 -0.0028 -0.0075 4086 GLU 57 C -0.0020 -0.0032 -0.0079 4087 GLU 57 O -0.0017 -0.0034 -0.0080 4088 GLU 57 CB -0.0010 -0.0031 -0.0075 4089 GLU 57 CG -0.0007 -0.0028 -0.0072 4090 GLU 57 CD -0.0000 -0.0031 -0.0072 4091 GLU 57 OE1 0.0003 -0.0036 -0.0074 4092 GLU 57 OE2 0.0003 -0.0029 -0.0069 4093 LYS 58 N -0.0027 -0.0032 -0.0082 4094 LYS 58 CA -0.0031 -0.0035 -0.0086 4095 LYS 58 C -0.0034 -0.0040 -0.0090 4096 LYS 58 O -0.0039 -0.0038 -0.0091 4097 LYS 58 CB -0.0037 -0.0031 -0.0084 4098 LYS 58 CG -0.0034 -0.0027 -0.0080 4099 LYS 58 CD -0.0040 -0.0023 -0.0079 4100 LYS 58 CE -0.0037 -0.0019 -0.0075 4101 LYS 58 NZ -0.0043 -0.0015 -0.0074 4102 THR 59 N -0.0031 -0.0045 -0.0094 4103 THR 59 CA -0.0033 -0.0050 -0.0098 4104 THR 59 C -0.0041 -0.0051 -0.0101 4105 THR 59 O -0.0045 -0.0052 -0.0103 4106 THR 59 CB -0.0028 -0.0056 -0.0101 4107 THR 59 OG1 -0.0021 -0.0055 -0.0098 4108 THR 59 CG2 -0.0030 -0.0061 -0.0105 4109 LYS 60 N -0.0043 -0.0050 -0.0101 4110 LYS 60 CA -0.0050 -0.0050 -0.0103 4111 LYS 60 C -0.0052 -0.0046 -0.0101 4112 LYS 60 O -0.0049 -0.0047 -0.0101 4113 LYS 60 CB -0.0051 -0.0056 -0.0109 4114 LYS 60 CG -0.0058 -0.0057 -0.0112 4115 LYS 60 CD -0.0059 -0.0063 -0.0117 4116 LYS 60 CE -0.0066 -0.0064 -0.0120 4117 LYS 60 NZ -0.0067 -0.0070 -0.0125 4118 GLU 61 N -0.0058 -0.0045 -0.0099 4119 GLU 61 CA -0.0060 -0.0042 -0.0093 4120 GLU 61 C -0.0066 -0.0044 -0.0092 4121 GLU 61 O -0.0072 -0.0045 -0.0092 4122 GLU 61 CB -0.0060 -0.0039 -0.0088 4123 GLU 61 CG -0.0061 -0.0035 -0.0082 4124 GLU 61 CD -0.0061 -0.0032 -0.0077 4125 GLU 61 OE1 -0.0060 -0.0033 -0.0079 4126 GLU 61 OE2 -0.0062 -0.0029 -0.0072 4127 GLN 62 N -0.0066 -0.0043 -0.0091 4128 GLN 62 CA -0.0072 -0.0045 -0.0091 4129 GLN 62 C -0.0072 -0.0041 -0.0085 4130 GLN 62 O -0.0068 -0.0039 -0.0085 4131 GLN 62 CB -0.0071 -0.0048 -0.0097 4132 GLN 62 CG -0.0077 -0.0050 -0.0097 4133 GLN 62 CD -0.0076 -0.0054 -0.0102 4134 GLN 62 OE1 -0.0071 -0.0055 -0.0106 4135 GLN 62 NE2 -0.0082 -0.0056 -0.0103 4136 VAL 63 N -0.0078 -0.0041 -0.0081 4137 VAL 63 CA -0.0079 -0.0037 -0.0076 4138 VAL 63 C -0.0086 -0.0040 -0.0075 4139 VAL 63 O -0.0091 -0.0040 -0.0074 4140 VAL 63 CB -0.0079 -0.0034 -0.0070 4141 VAL 63 CG1 -0.0081 -0.0031 -0.0065 4142 VAL 63 CG2 -0.0072 -0.0032 -0.0071 4143 THR 64 N -0.0086 -0.0041 -0.0077 4144 THR 64 CA -0.0092 -0.0043 -0.0077 4145 THR 64 C -0.0092 -0.0040 -0.0073 4146 THR 64 O -0.0088 -0.0040 -0.0075 4147 THR 64 CB -0.0093 -0.0047 -0.0083 4148 THR 64 OG1 -0.0088 -0.0047 -0.0085 4149 THR 64 CG2 -0.0092 -0.0050 -0.0088 4150 ASN 65 N -0.0095 -0.0040 -0.0067 4151 ASN 65 CA -0.0092 -0.0037 -0.0061 4152 ASN 65 C -0.0098 -0.0040 -0.0058 4153 ASN 65 O -0.0105 -0.0044 -0.0059 4154 ASN 65 CB -0.0090 -0.0034 -0.0053 4155 ASN 65 CG -0.0096 -0.0036 -0.0046 4156 ASN 65 OD1 -0.0102 -0.0039 -0.0045 4157 ASN 65 ND2 -0.0094 -0.0033 -0.0042 4158 VAL 66 N -0.0096 -0.0038 -0.0055 4159 VAL 66 CA -0.0101 -0.0040 -0.0050 4160 VAL 66 C -0.0099 -0.0036 -0.0041 4161 VAL 66 O -0.0093 -0.0032 -0.0040 4162 VAL 66 CB -0.0102 -0.0041 -0.0055 4163 VAL 66 CG1 -0.0102 -0.0044 -0.0064 4164 VAL 66 CG2 -0.0096 -0.0037 -0.0053 4165 GLY 67 N -0.0105 -0.0038 -0.0035 4166 GLY 67 CA -0.0104 -0.0035 -0.0027 4167 GLY 67 C -0.0101 -0.0032 -0.0022 4168 GLY 67 O -0.0100 -0.0030 -0.0015 4169 GLY 68 N -0.0098 -0.0031 -0.0026 4170 GLY 68 CA -0.0093 -0.0028 -0.0023 4171 GLY 68 C -0.0096 -0.0030 -0.0024 4172 GLY 68 O -0.0101 -0.0034 -0.0027 4173 ALA 69 N -0.0093 -0.0029 -0.0021 4174 ALA 69 CA -0.0094 -0.0029 -0.0022 4175 ALA 69 C -0.0087 -0.0026 -0.0026 4176 ALA 69 O -0.0083 -0.0021 -0.0023 4177 ALA 69 CB -0.0096 -0.0027 -0.0015 4178 VAL 70 N -0.0086 -0.0029 -0.0032 4179 VAL 70 CA -0.0080 -0.0027 -0.0036 4180 VAL 70 C -0.0080 -0.0027 -0.0036 4181 VAL 70 O -0.0085 -0.0032 -0.0037 4182 VAL 70 CB -0.0079 -0.0030 -0.0043 4183 VAL 70 CG1 -0.0073 -0.0028 -0.0048 4184 VAL 70 CG2 -0.0078 -0.0029 -0.0043 4185 VAL 71 N -0.0076 -0.0023 -0.0035 4186 VAL 71 CA -0.0075 -0.0022 -0.0036 4187 VAL 71 C -0.0069 -0.0022 -0.0042 4188 VAL 71 O -0.0064 -0.0018 -0.0042 4189 VAL 71 CB -0.0074 -0.0018 -0.0029 4190 VAL 71 CG1 -0.0072 -0.0017 -0.0030 4191 VAL 71 CG2 -0.0080 -0.0019 -0.0023 4192 THR 72 N -0.0070 -0.0025 -0.0047 4193 THR 72 CA -0.0065 -0.0025 -0.0053 4194 THR 72 C -0.0064 -0.0025 -0.0054 4195 THR 72 O -0.0068 -0.0029 -0.0055 4196 THR 72 CB -0.0066 -0.0030 -0.0060 4197 THR 72 OG1 -0.0071 -0.0035 -0.0060 4198 THR 72 CG2 -0.0067 -0.0031 -0.0059 4199 GLY 73 N -0.0055 -0.0018 -0.0055 4200 GLY 73 CA -0.0051 -0.0017 -0.0057 4201 GLY 73 C -0.0052 -0.0016 -0.0055 4202 GLY 73 O -0.0053 -0.0019 -0.0057 4203 VAL 74 N -0.0053 -0.0011 -0.0050 4204 VAL 74 CA -0.0054 -0.0009 -0.0048 4205 VAL 74 C -0.0047 -0.0006 -0.0050 4206 VAL 74 O -0.0043 -0.0004 -0.0051 4207 VAL 74 CB -0.0057 -0.0005 -0.0043 4208 VAL 74 CG1 -0.0063 -0.0008 -0.0041 4209 VAL 74 CG2 -0.0054 0.0001 -0.0040 4210 THR 75 N -0.0047 -0.0005 -0.0050 4211 THR 75 CA -0.0041 -0.0003 -0.0052 4212 THR 75 C -0.0042 -0.0000 -0.0049 4213 THR 75 O -0.0046 -0.0002 -0.0048 4214 THR 75 CB -0.0039 -0.0007 -0.0057 4215 THR 75 OG1 -0.0038 -0.0010 -0.0060 4216 THR 75 CG2 -0.0032 -0.0005 -0.0059 4217 ALA 76 N -0.0038 0.0005 -0.0047 4218 ALA 76 CA -0.0037 0.0008 -0.0045 4219 ALA 76 C -0.0043 0.0009 -0.0041 4220 ALA 76 O -0.0045 0.0008 -0.0040 4221 ALA 76 CB -0.0036 0.0005 -0.0049 4222 VAL 77 N -0.0047 0.0007 -0.0039 4223 VAL 77 CA -0.0050 0.0007 -0.0035 4224 VAL 77 C -0.0048 0.0010 -0.0030 4225 VAL 77 O -0.0045 0.0013 -0.0030 4226 VAL 77 CB -0.0051 0.0006 -0.0034 4227 VAL 77 CG1 -0.0055 0.0006 -0.0029 4228 VAL 77 CG2 -0.0053 0.0003 -0.0039 4229 ALA 78 N -0.0051 0.0009 -0.0027 4230 ALA 78 CA -0.0049 0.0012 -0.0023 4231 ALA 78 C -0.0053 0.0012 -0.0018 4232 ALA 78 O -0.0056 0.0010 -0.0018 4233 ALA 78 CB -0.0047 0.0013 -0.0024 4234 GLN 79 N -0.0053 0.0013 -0.0014 4235 GLN 79 CA -0.0057 0.0013 -0.0009 4236 GLN 79 C -0.0055 0.0016 -0.0005 4237 GLN 79 O -0.0051 0.0019 -0.0006 4238 GLN 79 CB -0.0059 0.0012 -0.0008 4239 GLN 79 CG -0.0056 0.0014 -0.0007 4240 GLN 79 CD -0.0059 0.0013 -0.0005 4241 GLN 79 OE1 -0.0063 0.0010 -0.0006 4242 GLN 79 NE2 -0.0057 0.0015 -0.0004 4243 LYS 80 N -0.0057 0.0016 -0.0001 4244 LYS 80 CA -0.0056 0.0019 0.0004 4245 LYS 80 C -0.0060 0.0018 0.0008 4246 LYS 80 O -0.0064 0.0015 0.0007 4247 LYS 80 CB -0.0056 0.0020 0.0005 4248 LYS 80 CG -0.0054 0.0024 0.0009 4249 LYS 80 CD -0.0053 0.0024 0.0011 4250 LYS 80 CE -0.0052 0.0028 0.0016 4251 LYS 80 NZ -0.0051 0.0029 0.0017 4252 THR 81 N -0.0063 0.0022 0.0012 4253 THR 81 CA -0.0067 0.0022 0.0015 4254 THR 81 C -0.0066 0.0026 0.0020 4255 THR 81 O -0.0062 0.0029 0.0021 4256 THR 81 CB -0.0068 0.0021 0.0014 4257 THR 81 OG1 -0.0069 0.0017 0.0009 4258 THR 81 CG2 -0.0072 0.0021 0.0017 4259 VAL 82 N -0.0069 0.0027 0.0024 4260 VAL 82 CA -0.0069 0.0030 0.0029 4261 VAL 82 C -0.0073 0.0030 0.0031 4262 VAL 82 O -0.0078 0.0027 0.0031 4263 VAL 82 CB -0.0070 0.0032 0.0031 4264 VAL 82 CG1 -0.0071 0.0035 0.0036 4265 VAL 82 CG2 -0.0066 0.0032 0.0029 4266 GLU 83 N -0.0072 0.0032 0.0033 4267 GLU 83 CA -0.0075 0.0032 0.0036 4268 GLU 83 C -0.0078 0.0028 0.0033 4269 GLU 83 O -0.0083 0.0027 0.0034 4270 GLU 83 CB -0.0079 0.0034 0.0040 4271 GLU 83 CG -0.0076 0.0038 0.0044 4272 GLU 83 CD -0.0079 0.0039 0.0049 4273 GLU 83 OE1 -0.0084 0.0037 0.0049 4274 GLU 83 OE2 -0.0077 0.0042 0.0052 4275 GLY 84 N -0.0075 0.0027 0.0029 4276 GLY 84 CA -0.0077 0.0024 0.0026 4277 GLY 84 C -0.0073 0.0023 0.0022 4278 GLY 84 O -0.0069 0.0025 0.0021 4279 ALA 85 N -0.0075 0.0022 0.0020 4280 ALA 85 CA -0.0073 0.0021 0.0017 4281 ALA 85 C -0.0072 0.0017 0.0013 4282 ALA 85 O -0.0075 0.0014 0.0013 4283 ALA 85 CB -0.0075 0.0021 0.0019 4284 GLY 86 N -0.0068 0.0018 0.0010 4285 GLY 86 CA -0.0068 0.0014 0.0006 4286 GLY 86 C -0.0065 0.0014 0.0003 4287 GLY 86 O -0.0062 0.0016 0.0001 4288 SER 87 N -0.0068 0.0010 0.0002 4289 SER 87 CA -0.0066 0.0009 -0.0001 4290 SER 87 C -0.0065 0.0005 -0.0005 4291 SER 87 O -0.0068 0.0001 -0.0005 4292 SER 87 CB -0.0068 0.0008 0.0000 4293 SER 87 OG -0.0068 0.0012 0.0004 4294 ILE 88 N -0.0061 0.0006 -0.0008 4295 ILE 88 CA -0.0061 0.0002 -0.0012 4296 ILE 88 C -0.0062 -0.0001 -0.0015 4297 ILE 88 O -0.0064 -0.0005 -0.0015 4298 ILE 88 CB -0.0056 0.0004 -0.0015 4299 ILE 88 CG1 -0.0056 0.0007 -0.0012 4300 ILE 88 CG2 -0.0055 0.0001 -0.0019 4301 ILE 88 CD1 -0.0052 0.0009 -0.0014 4302 ALA 89 N -0.0061 -0.0008 -0.0016 4303 ALA 89 CA -0.0062 -0.0012 -0.0020 4304 ALA 89 C -0.0063 -0.0009 -0.0014 4305 ALA 89 O -0.0059 -0.0004 -0.0015 4306 ALA 89 CB -0.0056 -0.0011 -0.0029 4307 ALA 90 N -0.0069 -0.0012 -0.0008 4308 ALA 90 CA -0.0071 -0.0010 -0.0002 4309 ALA 90 C -0.0075 -0.0016 -0.0003 4310 ALA 90 O -0.0078 -0.0023 -0.0007 4311 ALA 90 CB -0.0075 -0.0008 0.0007 4312 ALA 91 N -0.0075 -0.0014 -0.0001 4313 ALA 91 CA -0.0078 -0.0019 -0.0003 4314 ALA 91 C -0.0079 -0.0016 0.0004 4315 ALA 91 O -0.0075 -0.0010 0.0005 4316 ALA 91 CB -0.0074 -0.0021 -0.0012 4317 THR 92 N -0.0086 -0.0021 0.0009 4318 THR 92 CA -0.0088 -0.0018 0.0016 4319 THR 92 C -0.0091 -0.0025 0.0014 4320 THR 92 O -0.0095 -0.0032 0.0010 4321 THR 92 CB -0.0092 -0.0018 0.0025 4322 THR 92 OG1 -0.0098 -0.0025 0.0025 4323 THR 92 CG2 -0.0089 -0.0012 0.0027 4324 GLY 93 N -0.0092 -0.0021 0.0015 4325 GLY 93 CA -0.0093 -0.0019 0.0009 4326 GLY 93 C -0.0092 -0.0023 0.0019 4327 GLY 93 O -0.0098 -0.0026 0.0016 4328 PHE 94 N -0.0086 -0.0024 0.0030 4329 PHE 94 CA -0.0084 -0.0027 0.0040 4330 PHE 94 C -0.0083 -0.0032 0.0052 4331 PHE 94 O -0.0077 -0.0029 0.0055 4332 PHE 94 CB -0.0073 -0.0020 0.0040 4333 PHE 94 CG -0.0074 -0.0016 0.0029 4334 PHE 94 CD1 -0.0079 -0.0019 0.0030 4335 PHE 94 CD2 -0.0071 -0.0009 0.0019 4336 PHE 94 CE1 -0.0080 -0.0016 0.0020 4337 PHE 94 CE2 -0.0072 -0.0005 0.0009 4338 PHE 94 CZ -0.0076 -0.0009 0.0010 4339 VAL 95 N -0.0088 -0.0039 0.0060 4340 VAL 95 CA -0.0087 -0.0044 0.0073 4341 VAL 95 C -0.0085 -0.0047 0.0081 4342 VAL 95 O -0.0093 -0.0051 0.0080 4343 VAL 95 CB -0.0096 -0.0052 0.0075 4344 VAL 95 CG1 -0.0095 -0.0057 0.0089 4345 VAL 95 CG2 -0.0097 -0.0049 0.0068 4346 LYS 96 N -0.0076 -0.0044 0.0090 4347 LYS 96 CA -0.0073 -0.0046 0.0098 4348 LYS 96 C -0.0071 -0.0051 0.0112 4349 LYS 96 O -0.0071 -0.0052 0.0115 4350 LYS 96 CB -0.0063 -0.0038 0.0096 4351 LYS 96 CG -0.0065 -0.0034 0.0083 4352 LYS 96 CD -0.0072 -0.0038 0.0082 4353 LYS 96 CE -0.0074 -0.0034 0.0070 4354 LYS 96 NZ -0.0063 -0.0026 0.0067 4355 LYS 97 N -0.0046 -0.0066 0.0128 4356 LYS 97 CA -0.0030 -0.0106 0.0146 4357 LYS 97 C 0.0015 -0.0102 0.0153 4358 LYS 97 O 0.0026 -0.0076 0.0146 4359 LYS 97 CB -0.0057 -0.0133 0.0151 4360 LYS 97 CG -0.0046 -0.0177 0.0169 4361 LYS 97 CD -0.0055 -0.0197 0.0175 4362 LYS 97 CE -0.0042 -0.0239 0.0193 4363 LYS 97 NZ -0.0068 -0.0264 0.0197 4364 ASP 98 N 0.0040 -0.0127 0.0167 4365 ASP 98 CA 0.0083 -0.0130 0.0177 4366 ASP 98 C 0.0091 -0.0174 0.0195 4367 ASP 98 O 0.0062 -0.0200 0.0199 4368 ASP 98 CB 0.0113 -0.0106 0.0174 4369 ASP 98 CG 0.0156 -0.0096 0.0178 4370 ASP 98 OD1 0.0163 -0.0109 0.0184 4371 ASP 98 OD2 0.0183 -0.0076 0.0176 4372 GLN 99 N 0.0129 -0.0183 0.0205 4373 GLN 99 CA 0.0141 -0.0224 0.0223 4374 GLN 99 C 0.0141 -0.0244 0.0230 4375 GLN 99 O 0.0123 -0.0277 0.0239 4376 GLN 99 CB 0.0184 -0.0225 0.0232 4377 GLN 99 CG 0.0198 -0.0267 0.0250 4378 GLN 99 CD 0.0240 -0.0267 0.0258 4379 GLN 99 OE1 0.0260 -0.0236 0.0250 4380 GLN 99 NE2 0.0255 -0.0302 0.0274 4381 VAL 37 N -0.0112 -0.0295 0.0111 4382 VAL 37 CA -0.0119 -0.0280 0.0105 4383 VAL 37 C -0.0094 -0.0268 0.0105 4384 VAL 37 O -0.0092 -0.0261 0.0103 4385 VAL 37 CB -0.0134 -0.0296 0.0108 4386 VAL 37 CG1 -0.0162 -0.0301 0.0107 4387 VAL 37 CG2 -0.0122 -0.0321 0.0117 4388 LEU 38 N -0.0075 -0.0265 0.0106 4389 LEU 38 CA -0.0050 -0.0254 0.0105 4390 LEU 38 C -0.0052 -0.0226 0.0097 4391 LEU 38 O -0.0042 -0.0217 0.0095 4392 LEU 38 CB -0.0030 -0.0258 0.0109 4393 LEU 38 CG -0.0014 -0.0281 0.0118 4394 LEU 38 CD1 0.0006 -0.0282 0.0121 4395 LEU 38 CD2 -0.0030 -0.0306 0.0124 4396 TYR 39 N -0.0065 -0.0212 0.0091 4397 TYR 39 CA -0.0070 -0.0186 0.0082 4398 TYR 39 C -0.0045 -0.0170 0.0080 4399 TYR 39 O -0.0040 -0.0158 0.0077 4400 TYR 39 CB -0.0088 -0.0181 0.0079 4401 TYR 39 CG -0.0116 -0.0190 0.0078 4402 TYR 39 CD1 -0.0133 -0.0177 0.0072 4403 TYR 39 CD2 -0.0125 -0.0213 0.0084 4404 TYR 39 CE1 -0.0159 -0.0186 0.0072 4405 TYR 39 CE2 -0.0150 -0.0221 0.0084 4406 TYR 39 CZ -0.0167 -0.0208 0.0078 4407 TYR 39 OH -0.0192 -0.0217 0.0077 4408 VAL 40 N -0.0029 -0.0170 0.0082 4409 VAL 40 CA -0.0005 -0.0155 0.0081 4410 VAL 40 C -0.0010 -0.0127 0.0072 4411 VAL 40 O 0.0001 -0.0111 0.0068 4412 VAL 40 CB 0.0014 -0.0165 0.0086 4413 VAL 40 CG1 0.0039 -0.0149 0.0084 4414 VAL 40 CG2 0.0019 -0.0192 0.0095 4415 GLY 41 N -0.0041 -0.0112 0.0065 4416 GLY 41 CA -0.0047 -0.0094 0.0056 4417 GLY 41 C -0.0067 -0.0091 0.0053 4418 GLY 41 O -0.0078 -0.0084 0.0049 4419 SER 42 N -0.0072 -0.0097 0.0055 4420 SER 42 CA -0.0092 -0.0098 0.0053 4421 SER 42 C -0.0101 -0.0080 0.0045 4422 SER 42 O -0.0118 -0.0079 0.0042 4423 SER 42 CB -0.0094 -0.0107 0.0057 4424 SER 42 OG -0.0114 -0.0108 0.0056 4425 LYS 43 N -0.0091 -0.0067 0.0040 4426 LYS 43 CA -0.0096 -0.0049 0.0031 4427 LYS 43 C -0.0078 -0.0037 0.0028 4428 LYS 43 O -0.0069 -0.0037 0.0029 4429 LYS 43 CB -0.0112 -0.0043 0.0027 4430 LYS 43 CG -0.0119 -0.0025 0.0019 4431 LYS 43 CD -0.0135 -0.0021 0.0015 4432 LYS 43 CE -0.0143 -0.0003 0.0006 4433 LYS 43 NZ -0.0129 0.0012 0.0001 4434 THR 44 N -0.0072 -0.0027 0.0024 4435 THR 44 CA -0.0057 -0.0014 0.0020 4436 THR 44 C -0.0065 0.0004 0.0012 4437 THR 44 O -0.0078 0.0004 0.0010 4438 THR 44 CB -0.0040 -0.0018 0.0024 4439 THR 44 OG1 -0.0045 -0.0018 0.0023 4440 THR 44 CG2 -0.0032 -0.0036 0.0033 4441 LYS 45 N -0.0051 0.0015 0.0005 4442 LYS 45 CA -0.0052 0.0016 -0.0000 4443 LYS 45 C -0.0049 0.0018 -0.0001 4444 LYS 45 O -0.0045 0.0020 -0.0003 4445 LYS 45 CB -0.0053 0.0017 -0.0004 4446 LYS 45 CG -0.0055 0.0017 -0.0009 4447 LYS 45 CD -0.0056 0.0018 -0.0012 4448 LYS 45 CE -0.0058 0.0018 -0.0017 4449 LYS 45 NZ -0.0059 0.0019 -0.0021 4450 GLU 46 N -0.0050 0.0017 -0.0001 4451 GLU 46 CA -0.0046 0.0019 -0.0001 4452 GLU 46 C -0.0048 0.0019 -0.0004 4453 GLU 46 O -0.0051 0.0017 -0.0002 4454 GLU 46 CB -0.0044 0.0018 0.0005 4455 GLU 46 CG -0.0048 0.0016 0.0008 4456 GLU 46 CD -0.0045 0.0015 0.0014 4457 GLU 46 OE1 -0.0041 0.0017 0.0015 4458 GLU 46 OE2 -0.0048 0.0013 0.0017 4459 GLY 47 N -0.0045 0.0021 -0.0007 4460 GLY 47 CA -0.0047 0.0021 -0.0011 4461 GLY 47 C -0.0050 0.0021 -0.0015 4462 GLY 47 O -0.0054 0.0020 -0.0016 4463 VAL 48 N -0.0050 0.0022 -0.0017 4464 VAL 48 CA -0.0053 0.0021 -0.0021 4465 VAL 48 C -0.0052 0.0023 -0.0026 4466 VAL 48 O -0.0047 0.0025 -0.0026 4467 VAL 48 CB -0.0055 0.0020 -0.0019 4468 VAL 48 CG1 -0.0059 0.0019 -0.0022 4469 VAL 48 CG2 -0.0057 0.0018 -0.0014 4470 VAL 49 N -0.0042 0.0021 -0.0030 4471 VAL 49 CA -0.0040 0.0020 -0.0035 4472 VAL 49 C -0.0038 0.0017 -0.0039 4473 VAL 49 O -0.0041 0.0014 -0.0039 4474 VAL 49 CB -0.0042 0.0016 -0.0036 4475 VAL 49 CG1 -0.0040 0.0014 -0.0041 4476 VAL 49 CG2 -0.0043 0.0019 -0.0033 4477 HIS 50 N -0.0034 0.0019 -0.0042 4478 HIS 50 CA -0.0032 0.0016 -0.0045 4479 HIS 50 C -0.0028 0.0016 -0.0050 4480 HIS 50 O -0.0024 0.0019 -0.0050 4481 HIS 50 CB -0.0032 0.0019 -0.0043 4482 HIS 50 CG -0.0028 0.0023 -0.0043 4483 HIS 50 ND1 -0.0024 0.0024 -0.0046 4484 HIS 50 CD2 -0.0028 0.0028 -0.0039 4485 HIS 50 CE1 -0.0021 0.0029 -0.0044 4486 HIS 50 NE2 -0.0023 0.0031 -0.0040 4487 GLY 51 N -0.0028 0.0012 -0.0053 4488 GLY 51 CA -0.0024 0.0011 -0.0058 4489 GLY 51 C -0.0024 0.0010 -0.0059 4490 GLY 51 O -0.0021 0.0013 -0.0060 4491 VAL 52 N -0.0027 0.0006 -0.0060 4492 VAL 52 CA -0.0027 0.0005 -0.0061 4493 VAL 52 C -0.0028 -0.0000 -0.0065 4494 VAL 52 O -0.0030 -0.0004 -0.0066 4495 VAL 52 CB -0.0032 0.0004 -0.0057 4496 VAL 52 CG1 -0.0032 0.0002 -0.0058 4497 VAL 52 CG2 -0.0031 0.0009 -0.0053 4498 ALA 53 N -0.0014 0.0006 -0.0066 4499 ALA 53 CA -0.0013 0.0003 -0.0067 4500 ALA 53 C -0.0014 0.0001 -0.0067 4501 ALA 53 O -0.0015 0.0001 -0.0067 4502 ALA 53 CB -0.0010 0.0003 -0.0067 4503 THR 54 N -0.0016 -0.0001 -0.0068 4504 THR 54 CA -0.0017 -0.0003 -0.0068 4505 THR 54 C -0.0017 -0.0006 -0.0069 4506 THR 54 O -0.0017 -0.0006 -0.0069 4507 THR 54 CB -0.0021 -0.0002 -0.0068 4508 THR 54 OG1 -0.0021 0.0000 -0.0068 4509 THR 54 CG2 -0.0022 -0.0004 -0.0069 4510 VAL 55 N -0.0016 -0.0008 -0.0069 4511 VAL 55 CA -0.0016 -0.0011 -0.0070 4512 VAL 55 C -0.0018 -0.0012 -0.0070 4513 VAL 55 O -0.0018 -0.0012 -0.0070 4514 VAL 55 CB -0.0013 -0.0012 -0.0070 4515 VAL 55 CG1 -0.0013 -0.0015 -0.0071 4516 VAL 55 CG2 -0.0011 -0.0010 -0.0070 4517 ALA 56 N -0.0020 -0.0014 -0.0071 4518 ALA 56 CA -0.0022 -0.0016 -0.0071 4519 ALA 56 C -0.0022 -0.0019 -0.0072 4520 ALA 56 O -0.0023 -0.0019 -0.0072 4521 ALA 56 CB -0.0025 -0.0015 -0.0071 4522 GLU 57 N -0.0023 -0.0024 -0.0070 4523 GLU 57 CA -0.0023 -0.0031 -0.0075 4524 GLU 57 C -0.0028 -0.0036 -0.0079 4525 GLU 57 O -0.0024 -0.0039 -0.0080 4526 GLU 57 CB -0.0014 -0.0035 -0.0075 4527 GLU 57 CG -0.0009 -0.0031 -0.0071 4528 GLU 57 CD -0.0000 -0.0035 -0.0071 4529 GLU 57 OE1 0.0002 -0.0041 -0.0074 4530 GLU 57 OE2 0.0004 -0.0032 -0.0068 4531 LYS 58 N -0.0036 -0.0037 -0.0082 4532 LYS 58 CA -0.0041 -0.0041 -0.0086 4533 LYS 58 C -0.0044 -0.0048 -0.0091 4534 LYS 58 O -0.0050 -0.0046 -0.0092 4535 LYS 58 CB -0.0049 -0.0036 -0.0085 4536 LYS 58 CG -0.0046 -0.0030 -0.0080 4537 LYS 58 CD -0.0054 -0.0025 -0.0079 4538 LYS 58 CE -0.0051 -0.0019 -0.0075 4539 LYS 58 NZ -0.0058 -0.0014 -0.0074 4540 THR 59 N -0.0041 -0.0055 -0.0095 4541 THR 59 CA -0.0044 -0.0061 -0.0099 4542 THR 59 C -0.0053 -0.0062 -0.0103 4543 THR 59 O -0.0057 -0.0064 -0.0105 4544 THR 59 CB -0.0037 -0.0068 -0.0102 4545 THR 59 OG1 -0.0029 -0.0067 -0.0099 4546 THR 59 CG2 -0.0039 -0.0075 -0.0107 4547 LYS 60 N -0.0056 -0.0061 -0.0103 4548 LYS 60 CA -0.0065 -0.0061 -0.0105 4549 LYS 60 C -0.0069 -0.0056 -0.0103 4550 LYS 60 O -0.0065 -0.0057 -0.0102 4551 LYS 60 CB -0.0067 -0.0069 -0.0111 4552 LYS 60 CG -0.0076 -0.0070 -0.0114 4553 LYS 60 CD -0.0077 -0.0079 -0.0120 4554 LYS 60 CE -0.0086 -0.0080 -0.0123 4555 LYS 60 NZ -0.0087 -0.0088 -0.0129 4556 GLU 61 N -0.0076 -0.0057 -0.0100 4557 GLU 61 CA -0.0078 -0.0053 -0.0094 4558 GLU 61 C -0.0086 -0.0055 -0.0093 4559 GLU 61 O -0.0091 -0.0056 -0.0093 4560 GLU 61 CB -0.0078 -0.0049 -0.0089 4561 GLU 61 CG -0.0080 -0.0044 -0.0082 4562 GLU 61 CD -0.0080 -0.0040 -0.0077 4563 GLU 61 OE1 -0.0078 -0.0041 -0.0078 4564 GLU 61 OE2 -0.0081 -0.0036 -0.0071 4565 GLN 62 N -0.0086 -0.0054 -0.0093 4566 GLN 62 CA -0.0093 -0.0056 -0.0093 4567 GLN 62 C -0.0094 -0.0052 -0.0087 4568 GLN 62 O -0.0089 -0.0050 -0.0086 4569 GLN 62 CB -0.0092 -0.0061 -0.0099 4570 GLN 62 CG -0.0099 -0.0063 -0.0099 4571 GLN 62 CD -0.0098 -0.0068 -0.0105 4572 GLN 62 OE1 -0.0093 -0.0069 -0.0109 4573 GLN 62 NE2 -0.0104 -0.0070 -0.0106 4574 VAL 63 N -0.0100 -0.0051 -0.0083 4575 VAL 63 CA -0.0102 -0.0047 -0.0077 4576 VAL 63 C -0.0110 -0.0050 -0.0077 4577 VAL 63 O -0.0116 -0.0050 -0.0075 4578 VAL 63 CB -0.0102 -0.0043 -0.0071 4579 VAL 63 CG1 -0.0104 -0.0039 -0.0065 4580 VAL 63 CG2 -0.0094 -0.0040 -0.0071 4581 THR 64 N -0.0110 -0.0051 -0.0079 4582 THR 64 CA -0.0118 -0.0054 -0.0079 4583 THR 64 C -0.0118 -0.0051 -0.0075 4584 THR 64 O -0.0114 -0.0051 -0.0077 4585 THR 64 CB -0.0118 -0.0059 -0.0086 4586 THR 64 OG1 -0.0113 -0.0059 -0.0088 4587 THR 64 CG2 -0.0116 -0.0062 -0.0090 4588 ASN 65 N -0.0121 -0.0055 -0.0068 4589 ASN 65 CA -0.0119 -0.0052 -0.0062 4590 ASN 65 C -0.0125 -0.0055 -0.0060 4591 ASN 65 O -0.0131 -0.0058 -0.0062 4592 ASN 65 CB -0.0116 -0.0049 -0.0055 4593 ASN 65 CG -0.0122 -0.0050 -0.0048 4594 ASN 65 OD1 -0.0129 -0.0053 -0.0047 4595 ASN 65 ND2 -0.0120 -0.0048 -0.0043 4596 VAL 66 N -0.0122 -0.0053 -0.0057 4597 VAL 66 CA -0.0128 -0.0055 -0.0054 4598 VAL 66 C -0.0126 -0.0051 -0.0045 4599 VAL 66 O -0.0120 -0.0048 -0.0043 4600 VAL 66 CB -0.0128 -0.0056 -0.0059 4601 VAL 66 CG1 -0.0128 -0.0059 -0.0068 4602 VAL 66 CG2 -0.0123 -0.0053 -0.0057 4603 GLY 67 N -0.0132 -0.0053 -0.0039 4604 GLY 67 CA -0.0131 -0.0050 -0.0031 4605 GLY 67 C -0.0127 -0.0047 -0.0026 4606 GLY 67 O -0.0127 -0.0045 -0.0019 4607 GLY 68 N -0.0125 -0.0046 -0.0030 4608 GLY 68 CA -0.0120 -0.0043 -0.0026 4609 GLY 68 C -0.0123 -0.0044 -0.0026 4610 GLY 68 O -0.0128 -0.0048 -0.0030 4611 ALA 69 N -0.0119 -0.0043 -0.0023 4612 ALA 69 CA -0.0119 -0.0043 -0.0024 4613 ALA 69 C -0.0111 -0.0040 -0.0027 4614 ALA 69 O -0.0108 -0.0035 -0.0025 4615 ALA 69 CB -0.0122 -0.0040 -0.0017 4616 VAL 70 N -0.0110 -0.0044 -0.0033 4617 VAL 70 CA -0.0103 -0.0041 -0.0037 4618 VAL 70 C -0.0103 -0.0041 -0.0037 4619 VAL 70 O -0.0107 -0.0045 -0.0039 4620 VAL 70 CB -0.0101 -0.0045 -0.0045 4621 VAL 70 CG1 -0.0094 -0.0043 -0.0049 4622 VAL 70 CG2 -0.0101 -0.0045 -0.0044 4623 VAL 71 N -0.0097 -0.0036 -0.0036 4624 VAL 71 CA -0.0096 -0.0035 -0.0037 4625 VAL 71 C -0.0089 -0.0035 -0.0043 4626 VAL 71 O -0.0084 -0.0031 -0.0043 4627 VAL 71 CB -0.0095 -0.0029 -0.0030 4628 VAL 71 CG1 -0.0093 -0.0028 -0.0032 4629 VAL 71 CG2 -0.0102 -0.0030 -0.0024 4630 THR 72 N -0.0089 -0.0038 -0.0048 4631 THR 72 CA -0.0084 -0.0038 -0.0054 4632 THR 72 C -0.0082 -0.0038 -0.0055 4633 THR 72 O -0.0085 -0.0041 -0.0055 4634 THR 72 CB -0.0084 -0.0044 -0.0060 4635 THR 72 OG1 -0.0090 -0.0049 -0.0061 4636 THR 72 CG2 -0.0086 -0.0045 -0.0060 4637 GLY 73 N -0.0070 -0.0029 -0.0055 4638 GLY 73 CA -0.0065 -0.0028 -0.0057 4639 GLY 73 C -0.0067 -0.0026 -0.0054 4640 GLY 73 O -0.0067 -0.0029 -0.0057 4641 VAL 74 N -0.0067 -0.0020 -0.0050 4642 VAL 74 CA -0.0068 -0.0018 -0.0047 4643 VAL 74 C -0.0061 -0.0014 -0.0049 4644 VAL 74 O -0.0056 -0.0012 -0.0050 4645 VAL 74 CB -0.0072 -0.0013 -0.0042 4646 VAL 74 CG1 -0.0078 -0.0017 -0.0041 4647 VAL 74 CG2 -0.0069 -0.0007 -0.0039 4648 THR 75 N -0.0060 -0.0014 -0.0049 4649 THR 75 CA -0.0054 -0.0011 -0.0050 4650 THR 75 C -0.0054 -0.0008 -0.0047 4651 THR 75 O -0.0059 -0.0010 -0.0046 4652 THR 75 CB -0.0051 -0.0016 -0.0056 4653 THR 75 OG1 -0.0050 -0.0019 -0.0059 4654 THR 75 CG2 -0.0044 -0.0013 -0.0058 4655 ALA 76 N -0.0050 -0.0002 -0.0046 4656 ALA 76 CA -0.0049 0.0002 -0.0043 4657 ALA 76 C -0.0055 0.0003 -0.0038 4658 ALA 76 O -0.0058 0.0003 -0.0037 4659 ALA 76 CB -0.0047 -0.0002 -0.0047 4660 VAL 77 N -0.0061 -0.0001 -0.0037 4661 VAL 77 CA -0.0064 -0.0001 -0.0032 4662 VAL 77 C -0.0063 0.0002 -0.0028 4663 VAL 77 O -0.0059 0.0005 -0.0028 4664 VAL 77 CB -0.0065 -0.0002 -0.0032 4665 VAL 77 CG1 -0.0069 -0.0002 -0.0028 4666 VAL 77 CG2 -0.0067 -0.0005 -0.0037 4667 ALA 78 N -0.0065 0.0002 -0.0025 4668 ALA 78 CA -0.0064 0.0005 -0.0021 4669 ALA 78 C -0.0067 0.0005 -0.0017 4670 ALA 78 O -0.0070 0.0003 -0.0017 4671 ALA 78 CB -0.0061 0.0006 -0.0022 4672 GLN 79 N -0.0068 0.0006 -0.0013 4673 GLN 79 CA -0.0071 0.0006 -0.0009 4674 GLN 79 C -0.0069 0.0009 -0.0005 4675 GLN 79 O -0.0065 0.0012 -0.0005 4676 GLN 79 CB -0.0074 0.0005 -0.0008 4677 GLN 79 CG -0.0071 0.0007 -0.0007 4678 GLN 79 CD -0.0074 0.0006 -0.0006 4679 GLN 79 OE1 -0.0078 0.0003 -0.0006 4680 GLN 79 NE2 -0.0072 0.0008 -0.0005 4681 LYS 80 N -0.0072 0.0009 -0.0001 4682 LYS 80 CA -0.0071 0.0013 0.0003 4683 LYS 80 C -0.0075 0.0012 0.0007 4684 LYS 80 O -0.0078 0.0009 0.0007 4685 LYS 80 CB -0.0070 0.0014 0.0005 4686 LYS 80 CG -0.0069 0.0017 0.0009 4687 LYS 80 CD -0.0068 0.0018 0.0011 4688 LYS 80 CE -0.0066 0.0022 0.0015 4689 LYS 80 NZ -0.0066 0.0023 0.0017 4690 THR 81 N -0.0078 0.0015 0.0011 4691 THR 81 CA -0.0082 0.0015 0.0015 4692 THR 81 C -0.0081 0.0020 0.0019 4693 THR 81 O -0.0078 0.0022 0.0020 4694 THR 81 CB -0.0083 0.0014 0.0013 4695 THR 81 OG1 -0.0084 0.0010 0.0009 4696 THR 81 CG2 -0.0088 0.0014 0.0017 4697 VAL 82 N -0.0085 0.0020 0.0023 4698 VAL 82 CA -0.0085 0.0024 0.0028 4699 VAL 82 C -0.0089 0.0024 0.0030 4700 VAL 82 O -0.0094 0.0021 0.0030 4701 VAL 82 CB -0.0086 0.0025 0.0030 4702 VAL 82 CG1 -0.0087 0.0029 0.0035 4703 VAL 82 CG2 -0.0081 0.0026 0.0028 4704 GLU 83 N -0.0088 0.0026 0.0032 4705 GLU 83 CA -0.0092 0.0026 0.0035 4706 GLU 83 C -0.0095 0.0022 0.0032 4707 GLU 83 O -0.0099 0.0020 0.0033 4708 GLU 83 CB -0.0095 0.0028 0.0040 4709 GLU 83 CG -0.0092 0.0032 0.0043 4710 GLU 83 CD -0.0096 0.0033 0.0048 4711 GLU 83 OE1 -0.0101 0.0031 0.0048 4712 GLU 83 OE2 -0.0094 0.0037 0.0051 4713 GLY 84 N -0.0092 0.0021 0.0028 4714 GLY 84 CA -0.0094 0.0017 0.0025 4715 GLY 84 C -0.0090 0.0016 0.0021 4716 GLY 84 O -0.0085 0.0018 0.0021 4717 ALA 85 N -0.0093 0.0015 0.0019 4718 ALA 85 CA -0.0090 0.0014 0.0016 4719 ALA 85 C -0.0089 0.0010 0.0012 4720 ALA 85 O -0.0092 0.0007 0.0012 4721 ALA 85 CB -0.0093 0.0014 0.0018 4722 GLY 86 N -0.0085 0.0011 0.0009 4723 GLY 86 CA -0.0084 0.0007 0.0005 4724 GLY 86 C -0.0082 0.0006 0.0002 4725 GLY 86 O -0.0078 0.0008 0.0001 4726 SER 87 N -0.0084 0.0002 0.0001 4727 SER 87 CA -0.0082 0.0001 -0.0002 4728 SER 87 C -0.0082 -0.0004 -0.0006 4729 SER 87 O -0.0085 -0.0007 -0.0006 4730 SER 87 CB -0.0085 -0.0001 -0.0000 4731 SER 87 OG -0.0086 0.0003 0.0003 4732 ILE 88 N -0.0078 -0.0003 -0.0009 4733 ILE 88 CA -0.0077 -0.0006 -0.0013 4734 ILE 88 C -0.0077 -0.0010 -0.0015 4735 ILE 88 O -0.0080 -0.0014 -0.0016 4736 ILE 88 CB -0.0072 -0.0004 -0.0015 4737 ILE 88 CG1 -0.0072 -0.0001 -0.0013 4738 ILE 88 CG2 -0.0071 -0.0008 -0.0019 4739 ILE 88 CD1 -0.0068 0.0001 -0.0015 4740 ALA 89 N -0.0078 -0.0017 -0.0017 4741 ALA 89 CA -0.0079 -0.0023 -0.0021 4742 ALA 89 C -0.0081 -0.0020 -0.0015 4743 ALA 89 O -0.0077 -0.0015 -0.0016 4744 ALA 89 CB -0.0072 -0.0022 -0.0030 4745 ALA 90 N -0.0088 -0.0023 -0.0009 4746 ALA 90 CA -0.0091 -0.0021 -0.0003 4747 ALA 90 C -0.0096 -0.0029 -0.0005 4748 ALA 90 O -0.0099 -0.0036 -0.0008 4749 ALA 90 CB -0.0096 -0.0018 0.0006 4750 ALA 91 N -0.0096 -0.0027 -0.0002 4751 ALA 91 CA -0.0100 -0.0033 -0.0004 4752 ALA 91 C -0.0103 -0.0030 0.0003 4753 ALA 91 O -0.0099 -0.0024 0.0004 4754 ALA 91 CB -0.0095 -0.0036 -0.0013 4755 THR 92 N -0.0110 -0.0035 0.0008 4756 THR 92 CA -0.0114 -0.0033 0.0014 4757 THR 92 C -0.0118 -0.0040 0.0012 4758 THR 92 O -0.0121 -0.0048 0.0009 4759 THR 92 CB -0.0119 -0.0031 0.0023 4760 THR 92 OG1 -0.0125 -0.0038 0.0024 4761 THR 92 CG2 -0.0115 -0.0024 0.0025 4762 GLY 93 N -0.0121 -0.0038 0.0012 4763 GLY 93 CA -0.0122 -0.0037 0.0006 4764 GLY 93 C -0.0123 -0.0041 0.0015 4765 GLY 93 O -0.0129 -0.0044 0.0012 4766 PHE 94 N -0.0117 -0.0041 0.0027 4767 PHE 94 CA -0.0116 -0.0044 0.0037 4768 PHE 94 C -0.0115 -0.0047 0.0049 4769 PHE 94 O -0.0108 -0.0044 0.0052 4770 PHE 94 CB -0.0106 -0.0037 0.0036 4771 PHE 94 CG -0.0107 -0.0034 0.0025 4772 PHE 94 CD1 -0.0112 -0.0038 0.0026 4773 PHE 94 CD2 -0.0103 -0.0028 0.0014 4774 PHE 94 CE1 -0.0113 -0.0035 0.0015 4775 PHE 94 CE2 -0.0104 -0.0025 0.0004 4776 PHE 94 CZ -0.0109 -0.0028 0.0004 4777 VAL 95 N -0.0121 -0.0054 0.0058 4778 VAL 95 CA -0.0120 -0.0058 0.0071 4779 VAL 95 C -0.0119 -0.0061 0.0079 4780 VAL 95 O -0.0127 -0.0065 0.0077 4781 VAL 95 CB -0.0129 -0.0065 0.0073 4782 VAL 95 CG1 -0.0128 -0.0069 0.0088 4783 VAL 95 CG2 -0.0129 -0.0062 0.0066 4784 LYS 96 N -0.0110 -0.0058 0.0088 4785 LYS 96 CA -0.0109 -0.0060 0.0096 4786 LYS 96 C -0.0107 -0.0063 0.0110 4787 LYS 96 O -0.0106 -0.0064 0.0113 4788 LYS 96 CB -0.0099 -0.0052 0.0093 4789 LYS 96 CG -0.0100 -0.0049 0.0080 4790 LYS 96 CD -0.0109 -0.0054 0.0079 4791 LYS 96 CE -0.0110 -0.0050 0.0066 4792 LYS 96 NZ -0.0100 -0.0043 0.0063 4793 LYS 97 N -0.0087 -0.0080 0.0125 4794 LYS 97 CA -0.0072 -0.0116 0.0142 4795 LYS 97 C -0.0030 -0.0112 0.0149 4796 LYS 97 O -0.0020 -0.0088 0.0141 4797 LYS 97 CB -0.0098 -0.0143 0.0148 4798 LYS 97 CG -0.0087 -0.0183 0.0166 4799 LYS 97 CD -0.0094 -0.0202 0.0172 4800 LYS 97 CE -0.0082 -0.0241 0.0190 4801 LYS 97 NZ -0.0107 -0.0264 0.0194 4802 ASP 98 N -0.0005 -0.0136 0.0163 4803 ASP 98 CA 0.0035 -0.0138 0.0171 4804 ASP 98 C 0.0042 -0.0179 0.0189 4805 ASP 98 O 0.0016 -0.0203 0.0194 4806 ASP 98 CB 0.0064 -0.0116 0.0168 4807 ASP 98 CG 0.0104 -0.0106 0.0172 4808 ASP 98 OD1 0.0109 -0.0118 0.0178 4809 ASP 98 OD2 0.0129 -0.0087 0.0169 4810 GLN 99 N 0.0078 -0.0187 0.0200 4811 GLN 99 CA 0.0090 -0.0225 0.0217 4812 GLN 99 C 0.0091 -0.0244 0.0225 4813 GLN 99 O 0.0074 -0.0275 0.0234 4814 GLN 99 CB 0.0130 -0.0226 0.0225 4815 GLN 99 CG 0.0143 -0.0265 0.0243 4816 GLN 99 CD 0.0183 -0.0264 0.0251 4817 GLN 99 OE1 0.0201 -0.0235 0.0242 4818 GLN 99 NE2 0.0196 -0.0297 0.0266 4819 VAL 37 N -0.0127 -0.0308 0.0113 4820 VAL 37 CA -0.0134 -0.0293 0.0108 4821 VAL 37 C -0.0109 -0.0280 0.0107 4822 VAL 37 O -0.0107 -0.0273 0.0105 4823 VAL 37 CB -0.0149 -0.0309 0.0111 4824 VAL 37 CG1 -0.0177 -0.0314 0.0110 4825 VAL 37 CG2 -0.0136 -0.0334 0.0120 4826 LEU 38 N -0.0090 -0.0276 0.0108 4827 LEU 38 CA -0.0064 -0.0265 0.0107 4828 LEU 38 C -0.0066 -0.0237 0.0099 4829 LEU 38 O -0.0056 -0.0227 0.0097 4830 LEU 38 CB -0.0044 -0.0269 0.0111 4831 LEU 38 CG -0.0027 -0.0292 0.0120 4832 LEU 38 CD1 -0.0006 -0.0293 0.0122 4833 LEU 38 CD2 -0.0043 -0.0317 0.0125 4834 TYR 39 N -0.0080 -0.0223 0.0093 4835 TYR 39 CA -0.0085 -0.0196 0.0084 4836 TYR 39 C -0.0060 -0.0179 0.0082 4837 TYR 39 O -0.0055 -0.0167 0.0079 4838 TYR 39 CB -0.0104 -0.0191 0.0081 4839 TYR 39 CG -0.0132 -0.0201 0.0081 4840 TYR 39 CD1 -0.0150 -0.0188 0.0075 4841 TYR 39 CD2 -0.0141 -0.0224 0.0087 4842 TYR 39 CE1 -0.0176 -0.0197 0.0075 4843 TYR 39 CE2 -0.0167 -0.0233 0.0087 4844 TYR 39 CZ -0.0184 -0.0220 0.0081 4845 TYR 39 OH -0.0209 -0.0229 0.0081 4846 VAL 40 N -0.0044 -0.0179 0.0084 4847 VAL 40 CA -0.0020 -0.0163 0.0082 4848 VAL 40 C -0.0026 -0.0135 0.0073 4849 VAL 40 O -0.0014 -0.0119 0.0069 4850 VAL 40 CB -0.0001 -0.0173 0.0087 4851 VAL 40 CG1 0.0025 -0.0157 0.0084 4852 VAL 40 CG2 0.0006 -0.0201 0.0096 4853 GLY 41 N -0.0058 -0.0116 0.0062 4854 GLY 41 CA -0.0064 -0.0098 0.0054 4855 GLY 41 C -0.0084 -0.0095 0.0053 4856 GLY 41 O -0.0095 -0.0086 0.0049 4857 SER 42 N -0.0090 -0.0102 0.0056 4858 SER 42 CA -0.0110 -0.0103 0.0057 4859 SER 42 C -0.0119 -0.0085 0.0049 4860 SER 42 O -0.0136 -0.0082 0.0048 4861 SER 42 CB -0.0112 -0.0114 0.0062 4862 SER 42 OG -0.0131 -0.0116 0.0062 4863 LYS 43 N -0.0109 -0.0073 0.0043 4864 LYS 43 CA -0.0114 -0.0054 0.0035 4865 LYS 43 C -0.0096 -0.0044 0.0030 4866 LYS 43 O -0.0087 -0.0046 0.0031 4867 LYS 43 CB -0.0130 -0.0050 0.0033 4868 LYS 43 CG -0.0138 -0.0031 0.0025 4869 LYS 43 CD -0.0154 -0.0027 0.0024 4870 LYS 43 CE -0.0162 -0.0009 0.0016 4871 LYS 43 NZ -0.0148 0.0005 0.0009 4872 THR 44 N -0.0091 -0.0032 0.0025 4873 THR 44 CA -0.0075 -0.0020 0.0019 4874 THR 44 C -0.0083 -0.0001 0.0011 4875 THR 44 O -0.0097 0.0001 0.0010 4876 THR 44 CB -0.0058 -0.0023 0.0021 4877 THR 44 OG1 -0.0064 -0.0021 0.0020 4878 THR 44 CG2 -0.0050 -0.0042 0.0029 4879 LYS 45 N -0.0067 0.0009 0.0008 4880 LYS 45 CA -0.0068 0.0010 0.0004 4881 LYS 45 C -0.0065 0.0011 0.0001 4882 LYS 45 O -0.0061 0.0012 0.0000 4883 LYS 45 CB -0.0068 0.0011 0.0002 4884 LYS 45 CG -0.0070 0.0011 -0.0003 4885 LYS 45 CD -0.0071 0.0012 -0.0004 4886 LYS 45 CE -0.0073 0.0013 -0.0009 4887 LYS 45 NZ -0.0074 0.0013 -0.0010 4888 GLU 46 N -0.0066 0.0011 0.0001 4889 GLU 46 CA -0.0062 0.0012 -0.0000 4890 GLU 46 C -0.0064 0.0013 -0.0004 4891 GLU 46 O -0.0067 0.0012 -0.0003 4892 GLU 46 CB -0.0061 0.0011 0.0004 4893 GLU 46 CG -0.0064 0.0010 0.0007 4894 GLU 46 CD -0.0062 0.0009 0.0011 4895 GLU 46 OE1 -0.0058 0.0009 0.0012 4896 GLU 46 OE2 -0.0064 0.0008 0.0014 4897 GLY 47 N -0.0062 0.0014 -0.0007 4898 GLY 47 CA -0.0063 0.0014 -0.0011 4899 GLY 47 C -0.0067 0.0015 -0.0013 4900 GLY 47 O -0.0070 0.0015 -0.0015 4901 VAL 48 N -0.0066 0.0015 -0.0014 4902 VAL 48 CA -0.0069 0.0015 -0.0017 4903 VAL 48 C -0.0067 0.0017 -0.0021 4904 VAL 48 O -0.0064 0.0017 -0.0021 4905 VAL 48 CB -0.0070 0.0014 -0.0014 4906 VAL 48 CG1 -0.0074 0.0014 -0.0016 4907 VAL 48 CG2 -0.0072 0.0013 -0.0010 4908 VAL 49 N -0.0056 0.0011 -0.0026 4909 VAL 49 CA -0.0053 0.0009 -0.0031 4910 VAL 49 C -0.0051 0.0007 -0.0034 4911 VAL 49 O -0.0054 0.0004 -0.0034 4912 VAL 49 CB -0.0055 0.0006 -0.0032 4913 VAL 49 CG1 -0.0053 0.0003 -0.0036 4914 VAL 49 CG2 -0.0056 0.0008 -0.0029 4915 HIS 50 N -0.0047 0.0008 -0.0037 4916 HIS 50 CA -0.0045 0.0006 -0.0040 4917 HIS 50 C -0.0041 0.0006 -0.0044 4918 HIS 50 O -0.0037 0.0009 -0.0044 4919 HIS 50 CB -0.0045 0.0009 -0.0038 4920 HIS 50 CG -0.0041 0.0013 -0.0037 4921 HIS 50 ND1 -0.0036 0.0014 -0.0040 4922 HIS 50 CD2 -0.0041 0.0017 -0.0033 4923 HIS 50 CE1 -0.0034 0.0019 -0.0038 4924 HIS 50 NE2 -0.0036 0.0021 -0.0034 4925 GLY 51 N -0.0041 0.0002 -0.0048 4926 GLY 51 CA -0.0037 0.0001 -0.0052 4927 GLY 51 C -0.0037 -0.0000 -0.0054 4928 GLY 51 O -0.0033 0.0002 -0.0055 4929 VAL 52 N -0.0040 -0.0004 -0.0055 4930 VAL 52 CA -0.0040 -0.0006 -0.0056 4931 VAL 52 C -0.0040 -0.0011 -0.0061 4932 VAL 52 O -0.0043 -0.0014 -0.0061 4933 VAL 52 CB -0.0044 -0.0006 -0.0053 4934 VAL 52 CG1 -0.0045 -0.0008 -0.0054 4935 VAL 52 CG2 -0.0044 -0.0002 -0.0048 4936 ALA 53 N -0.0023 -0.0001 -0.0061 4937 ALA 53 CA -0.0023 -0.0002 -0.0062 4938 ALA 53 C -0.0023 -0.0004 -0.0063 4939 ALA 53 O -0.0023 -0.0004 -0.0063 4940 ALA 53 CB -0.0021 -0.0003 -0.0061 4941 THR 54 N -0.0025 -0.0004 -0.0064 4942 THR 54 CA -0.0025 -0.0006 -0.0066 4943 THR 54 C -0.0025 -0.0007 -0.0067 4944 THR 54 O -0.0026 -0.0006 -0.0067 4945 THR 54 CB -0.0027 -0.0005 -0.0067 4946 THR 54 OG1 -0.0027 -0.0004 -0.0066 4947 THR 54 CG2 -0.0028 -0.0007 -0.0068 4948 VAL 55 N -0.0025 -0.0009 -0.0068 4949 VAL 55 CA -0.0025 -0.0010 -0.0069 4950 VAL 55 C -0.0026 -0.0012 -0.0070 4951 VAL 55 O -0.0025 -0.0012 -0.0070 4952 VAL 55 CB -0.0023 -0.0011 -0.0068 4953 VAL 55 CG1 -0.0023 -0.0013 -0.0069 4954 VAL 55 CG2 -0.0022 -0.0010 -0.0066 4955 ALA 56 N -0.0027 -0.0012 -0.0071 4956 ALA 56 CA -0.0028 -0.0013 -0.0073 4957 ALA 56 C -0.0028 -0.0015 -0.0074 4958 ALA 56 O -0.0029 -0.0014 -0.0074 4959 ALA 56 CB -0.0030 -0.0012 -0.0073 4960 GLU 57 N -0.0032 -0.0022 -0.0068 4961 GLU 57 CA -0.0032 -0.0030 -0.0073 4962 GLU 57 C -0.0038 -0.0037 -0.0078 4963 GLU 57 O -0.0035 -0.0040 -0.0079 4964 GLU 57 CB -0.0022 -0.0035 -0.0072 4965 GLU 57 CG -0.0016 -0.0030 -0.0068 4966 GLU 57 CD -0.0005 -0.0035 -0.0068 4967 GLU 57 OE1 -0.0002 -0.0042 -0.0071 4968 GLU 57 OE2 0.0000 -0.0031 -0.0064 4969 LYS 58 N -0.0047 -0.0038 -0.0081 4970 LYS 58 CA -0.0054 -0.0043 -0.0086 4971 LYS 58 C -0.0058 -0.0051 -0.0091 4972 LYS 58 O -0.0064 -0.0049 -0.0092 4973 LYS 58 CB -0.0064 -0.0036 -0.0085 4974 LYS 58 CG -0.0061 -0.0029 -0.0080 4975 LYS 58 CD -0.0070 -0.0023 -0.0079 4976 LYS 58 CE -0.0067 -0.0017 -0.0075 4977 LYS 58 NZ -0.0076 -0.0010 -0.0074 4978 THR 59 N -0.0054 -0.0059 -0.0095 4979 THR 59 CA -0.0057 -0.0067 -0.0100 4980 THR 59 C -0.0068 -0.0068 -0.0104 4981 THR 59 O -0.0073 -0.0071 -0.0106 4982 THR 59 CB -0.0049 -0.0076 -0.0102 4983 THR 59 OG1 -0.0039 -0.0074 -0.0099 4984 THR 59 CG2 -0.0051 -0.0084 -0.0107 4985 LYS 60 N -0.0072 -0.0067 -0.0104 4986 LYS 60 CA -0.0083 -0.0067 -0.0107 4987 LYS 60 C -0.0087 -0.0061 -0.0105 4988 LYS 60 O -0.0084 -0.0062 -0.0104 4989 LYS 60 CB -0.0085 -0.0077 -0.0113 4990 LYS 60 CG -0.0096 -0.0079 -0.0117 4991 LYS 60 CD -0.0097 -0.0089 -0.0123 4992 LYS 60 CE -0.0108 -0.0090 -0.0127 4993 LYS 60 NZ -0.0110 -0.0100 -0.0132 4994 GLU 61 N -0.0096 -0.0066 -0.0099 4995 GLU 61 CA -0.0098 -0.0061 -0.0092 4996 GLU 61 C -0.0107 -0.0063 -0.0092 4997 GLU 61 O -0.0113 -0.0065 -0.0092 4998 GLU 61 CB -0.0098 -0.0056 -0.0086 4999 GLU 61 CG -0.0100 -0.0052 -0.0079 5000 GLU 61 CD -0.0100 -0.0047 -0.0073 5001 GLU 61 OE1 -0.0098 -0.0047 -0.0074 5002 GLU 61 OE2 -0.0102 -0.0042 -0.0067 5003 GLN 62 N -0.0107 -0.0063 -0.0092 5004 GLN 62 CA -0.0115 -0.0065 -0.0093 5005 GLN 62 C -0.0116 -0.0061 -0.0087 5006 GLN 62 O -0.0111 -0.0059 -0.0086 5007 GLN 62 CB -0.0114 -0.0071 -0.0100 5008 GLN 62 CG -0.0122 -0.0073 -0.0101 5009 GLN 62 CD -0.0122 -0.0079 -0.0108 5010 GLN 62 OE1 -0.0115 -0.0081 -0.0112 5011 GLN 62 NE2 -0.0128 -0.0082 -0.0110 5012 VAL 63 N -0.0124 -0.0059 -0.0083 5013 VAL 63 CA -0.0126 -0.0055 -0.0077 5014 VAL 63 C -0.0135 -0.0058 -0.0077 5015 VAL 63 O -0.0141 -0.0058 -0.0075 5016 VAL 63 CB -0.0126 -0.0050 -0.0070 5017 VAL 63 CG1 -0.0129 -0.0046 -0.0064 5018 VAL 63 CG2 -0.0117 -0.0047 -0.0069 5019 THR 64 N -0.0135 -0.0060 -0.0080 5020 THR 64 CA -0.0144 -0.0062 -0.0081 5021 THR 64 C -0.0144 -0.0060 -0.0077 5022 THR 64 O -0.0140 -0.0061 -0.0080 5023 THR 64 CB -0.0144 -0.0069 -0.0089 5024 THR 64 OG1 -0.0139 -0.0070 -0.0091 5025 THR 64 CG2 -0.0142 -0.0071 -0.0093 5026 ASN 65 N -0.0148 -0.0068 -0.0069 5027 ASN 65 CA -0.0145 -0.0065 -0.0064 5028 ASN 65 C -0.0151 -0.0068 -0.0062 5029 ASN 65 O -0.0158 -0.0071 -0.0063 5030 ASN 65 CB -0.0143 -0.0062 -0.0056 5031 ASN 65 CG -0.0149 -0.0063 -0.0049 5032 ASN 65 OD1 -0.0156 -0.0066 -0.0049 5033 ASN 65 ND2 -0.0147 -0.0061 -0.0045 5034 VAL 66 N -0.0149 -0.0066 -0.0059 5035 VAL 66 CA -0.0154 -0.0068 -0.0055 5036 VAL 66 C -0.0153 -0.0064 -0.0047 5037 VAL 66 O -0.0146 -0.0061 -0.0045 5038 VAL 66 CB -0.0155 -0.0069 -0.0060 5039 VAL 66 CG1 -0.0155 -0.0071 -0.0070 5040 VAL 66 CG2 -0.0149 -0.0066 -0.0059 5041 GLY 67 N -0.0158 -0.0066 -0.0041 5042 GLY 67 CA -0.0158 -0.0063 -0.0033 5043 GLY 67 C -0.0154 -0.0060 -0.0028 5044 GLY 67 O -0.0153 -0.0058 -0.0020 5045 GLY 68 N -0.0151 -0.0060 -0.0031 5046 GLY 68 CA -0.0146 -0.0056 -0.0027 5047 GLY 68 C -0.0149 -0.0058 -0.0028 5048 GLY 68 O -0.0155 -0.0061 -0.0031 5049 ALA 69 N -0.0145 -0.0058 -0.0024 5050 ALA 69 CA -0.0144 -0.0057 -0.0024 5051 ALA 69 C -0.0136 -0.0054 -0.0028 5052 ALA 69 O -0.0132 -0.0048 -0.0025 5053 ALA 69 CB -0.0147 -0.0053 -0.0017 5054 VAL 70 N -0.0134 -0.0058 -0.0034 5055 VAL 70 CA -0.0126 -0.0055 -0.0038 5056 VAL 70 C -0.0125 -0.0054 -0.0038 5057 VAL 70 O -0.0129 -0.0059 -0.0039 5058 VAL 70 CB -0.0124 -0.0060 -0.0045 5059 VAL 70 CG1 -0.0116 -0.0058 -0.0050 5060 VAL 70 CG2 -0.0124 -0.0060 -0.0045 5061 VAL 71 N -0.0120 -0.0049 -0.0037 5062 VAL 71 CA -0.0117 -0.0047 -0.0038 5063 VAL 71 C -0.0110 -0.0047 -0.0044 5064 VAL 71 O -0.0105 -0.0043 -0.0044 5065 VAL 71 CB -0.0117 -0.0041 -0.0031 5066 VAL 71 CG1 -0.0114 -0.0039 -0.0032 5067 VAL 71 CG2 -0.0124 -0.0041 -0.0025 5068 THR 72 N -0.0110 -0.0051 -0.0049 5069 THR 72 CA -0.0103 -0.0051 -0.0055 5070 THR 72 C -0.0100 -0.0050 -0.0056 5071 THR 72 O -0.0104 -0.0054 -0.0056 5072 THR 72 CB -0.0104 -0.0058 -0.0061 5073 THR 72 OG1 -0.0109 -0.0063 -0.0062 5074 THR 72 CG2 -0.0106 -0.0060 -0.0061 5075 GLY 73 N -0.0085 -0.0040 -0.0055 5076 GLY 73 CA -0.0080 -0.0039 -0.0056 5077 GLY 73 C -0.0081 -0.0036 -0.0054 5078 GLY 73 O -0.0082 -0.0039 -0.0055 5079 VAL 74 N -0.0082 -0.0030 -0.0049 5080 VAL 74 CA -0.0083 -0.0027 -0.0046 5081 VAL 74 C -0.0075 -0.0024 -0.0047 5082 VAL 74 O -0.0071 -0.0022 -0.0049 5083 VAL 74 CB -0.0087 -0.0023 -0.0041 5084 VAL 74 CG1 -0.0094 -0.0026 -0.0040 5085 VAL 74 CG2 -0.0084 -0.0017 -0.0038 5086 THR 75 N -0.0075 -0.0023 -0.0047 5087 THR 75 CA -0.0068 -0.0020 -0.0048 5088 THR 75 C -0.0069 -0.0016 -0.0045 5089 THR 75 O -0.0073 -0.0018 -0.0044 5090 THR 75 CB -0.0065 -0.0025 -0.0054 5091 THR 75 OG1 -0.0064 -0.0029 -0.0057 5092 THR 75 CG2 -0.0057 -0.0022 -0.0055 5093 ALA 76 N -0.0064 -0.0011 -0.0043 5094 ALA 76 CA -0.0063 -0.0007 -0.0041 5095 ALA 76 C -0.0070 -0.0005 -0.0036 5096 ALA 76 O -0.0072 -0.0005 -0.0035 5097 ALA 76 CB -0.0061 -0.0010 -0.0044 5098 VAL 77 N -0.0075 -0.0010 -0.0034 5099 VAL 77 CA -0.0078 -0.0010 -0.0030 5100 VAL 77 C -0.0077 -0.0006 -0.0026 5101 VAL 77 O -0.0074 -0.0004 -0.0026 5102 VAL 77 CB -0.0080 -0.0011 -0.0029 5103 VAL 77 CG1 -0.0083 -0.0011 -0.0025 5104 VAL 77 CG2 -0.0081 -0.0014 -0.0033 5105 ALA 78 N -0.0079 -0.0006 -0.0023 5106 ALA 78 CA -0.0078 -0.0003 -0.0019 5107 ALA 78 C -0.0081 -0.0004 -0.0015 5108 ALA 78 O -0.0084 -0.0005 -0.0015 5109 ALA 78 CB -0.0075 -0.0002 -0.0021 5110 GLN 79 N -0.0082 -0.0002 -0.0012 5111 GLN 79 CA -0.0085 -0.0002 -0.0008 5112 GLN 79 C -0.0084 0.0001 -0.0004 5113 GLN 79 O -0.0080 0.0004 -0.0005 5114 GLN 79 CB -0.0088 -0.0003 -0.0007 5115 GLN 79 CG -0.0086 -0.0001 -0.0006 5116 GLN 79 CD -0.0089 -0.0003 -0.0005 5117 GLN 79 OE1 -0.0092 -0.0005 -0.0005 5118 GLN 79 NE2 -0.0087 -0.0001 -0.0004 5119 LYS 80 N -0.0086 0.0001 -0.0001 5120 LYS 80 CA -0.0085 0.0005 0.0003 5121 LYS 80 C -0.0089 0.0004 0.0007 5122 LYS 80 O -0.0092 0.0001 0.0006 5123 LYS 80 CB -0.0085 0.0006 0.0005 5124 LYS 80 CG -0.0083 0.0009 0.0008 5125 LYS 80 CD -0.0083 0.0011 0.0010 5126 LYS 80 CE -0.0081 0.0014 0.0014 5127 LYS 80 NZ -0.0081 0.0015 0.0016 5128 THR 81 N -0.0092 0.0007 0.0011 5129 THR 81 CA -0.0097 0.0007 0.0014 5130 THR 81 C -0.0096 0.0012 0.0019 5131 THR 81 O -0.0093 0.0014 0.0020 5132 THR 81 CB -0.0098 0.0005 0.0013 5133 THR 81 OG1 -0.0099 0.0001 0.0008 5134 THR 81 CG2 -0.0103 0.0005 0.0017 5135 VAL 82 N -0.0100 0.0013 0.0023 5136 VAL 82 CA -0.0100 0.0017 0.0028 5137 VAL 82 C -0.0105 0.0016 0.0030 5138 VAL 82 O -0.0109 0.0013 0.0030 5139 VAL 82 CB -0.0101 0.0018 0.0030 5140 VAL 82 CG1 -0.0102 0.0022 0.0035 5141 VAL 82 CG2 -0.0096 0.0019 0.0028 5142 GLU 83 N -0.0104 0.0018 0.0032 5143 GLU 83 CA -0.0107 0.0018 0.0035 5144 GLU 83 C -0.0111 0.0014 0.0032 5145 GLU 83 O -0.0115 0.0012 0.0033 5146 GLU 83 CB -0.0111 0.0020 0.0039 5147 GLU 83 CG -0.0108 0.0025 0.0043 5148 GLU 83 CD -0.0112 0.0026 0.0048 5149 GLU 83 OE1 -0.0117 0.0024 0.0048 5150 GLU 83 OE2 -0.0110 0.0030 0.0051 5151 GLY 84 N -0.0108 0.0013 0.0028 5152 GLY 84 CA -0.0110 0.0009 0.0025 5153 GLY 84 C -0.0106 0.0008 0.0021 5154 GLY 84 O -0.0101 0.0010 0.0021 5155 ALA 85 N -0.0108 0.0007 0.0018 5156 ALA 85 CA -0.0106 0.0007 0.0015 5157 ALA 85 C -0.0105 0.0002 0.0011 5158 ALA 85 O -0.0108 -0.0001 0.0011 5159 ALA 85 CB -0.0108 0.0006 0.0017 5160 GLY 86 N -0.0100 0.0002 0.0008 5161 GLY 86 CA -0.0099 -0.0001 0.0004 5162 GLY 86 C -0.0097 -0.0003 0.0001 5163 GLY 86 O -0.0093 -0.0000 -0.0000 5164 SER 87 N -0.0099 -0.0007 -0.0000 5165 SER 87 CA -0.0097 -0.0009 -0.0003 5166 SER 87 C -0.0096 -0.0013 -0.0007 5167 SER 87 O -0.0100 -0.0016 -0.0007 5168 SER 87 CB -0.0100 -0.0010 -0.0002 5169 SER 87 OG -0.0101 -0.0006 0.0002 5170 ILE 88 N -0.0092 -0.0012 -0.0010 5171 ILE 88 CA -0.0091 -0.0015 -0.0014 5172 ILE 88 C -0.0092 -0.0020 -0.0016 5173 ILE 88 O -0.0094 -0.0023 -0.0017 5174 ILE 88 CB -0.0086 -0.0013 -0.0016 5175 ILE 88 CG1 -0.0086 -0.0010 -0.0013 5176 ILE 88 CG2 -0.0084 -0.0017 -0.0020 5177 ILE 88 CD1 -0.0081 -0.0007 -0.0015 5178 ALA 89 N -0.0094 -0.0029 -0.0018 5179 ALA 89 CA -0.0095 -0.0036 -0.0023 5180 ALA 89 C -0.0099 -0.0034 -0.0016 5181 ALA 89 O -0.0094 -0.0029 -0.0017 5182 ALA 89 CB -0.0087 -0.0036 -0.0032 5183 ALA 90 N -0.0107 -0.0037 -0.0010 5184 ALA 90 CA -0.0111 -0.0035 -0.0003 5185 ALA 90 C -0.0116 -0.0044 -0.0005 5186 ALA 90 O -0.0119 -0.0052 -0.0009 5187 ALA 90 CB -0.0117 -0.0031 0.0006 5188 ALA 91 N -0.0117 -0.0043 -0.0003 5189 ALA 91 CA -0.0122 -0.0051 -0.0005 5190 ALA 91 C -0.0126 -0.0047 0.0002 5191 ALA 91 O -0.0121 -0.0040 0.0003 5192 ALA 91 CB -0.0116 -0.0054 -0.0014 5193 THR 92 N -0.0134 -0.0053 0.0007 5194 THR 92 CA -0.0139 -0.0050 0.0014 5195 THR 92 C -0.0144 -0.0059 0.0012 5196 THR 92 O -0.0147 -0.0068 0.0009 5197 THR 92 CB -0.0145 -0.0048 0.0024 5198 THR 92 OG1 -0.0152 -0.0056 0.0024 5199 THR 92 CG2 -0.0141 -0.0039 0.0026 5200 GLY 93 N -0.0154 -0.0058 0.0010 5201 GLY 93 CA -0.0155 -0.0057 0.0003 5202 GLY 93 C -0.0157 -0.0061 0.0012 5203 GLY 93 O -0.0164 -0.0064 0.0008 5204 PHE 94 N -0.0151 -0.0061 0.0024 5205 PHE 94 CA -0.0151 -0.0063 0.0034 5206 PHE 94 C -0.0149 -0.0067 0.0048 5207 PHE 94 O -0.0142 -0.0063 0.0051 5208 PHE 94 CB -0.0140 -0.0057 0.0033 5209 PHE 94 CG -0.0142 -0.0055 0.0021 5210 PHE 94 CD1 -0.0148 -0.0058 0.0021 5211 PHE 94 CD2 -0.0137 -0.0049 0.0009 5212 PHE 94 CE1 -0.0149 -0.0056 0.0009 5213 PHE 94 CE2 -0.0139 -0.0046 -0.0002 5214 PHE 94 CZ -0.0145 -0.0050 -0.0002 5215 VAL 95 N -0.0157 -0.0073 0.0057 5216 VAL 95 CA -0.0155 -0.0076 0.0071 5217 VAL 95 C -0.0156 -0.0079 0.0079 5218 VAL 95 O -0.0165 -0.0083 0.0077 5219 VAL 95 CB -0.0165 -0.0083 0.0074 5220 VAL 95 CG1 -0.0164 -0.0087 0.0089 5221 VAL 95 CG2 -0.0164 -0.0080 0.0068 5222 LYS 96 N -0.0146 -0.0076 0.0088 5223 LYS 96 CA -0.0145 -0.0077 0.0096 5224 LYS 96 C -0.0144 -0.0080 0.0111 5225 LYS 96 O -0.0143 -0.0081 0.0115 5226 LYS 96 CB -0.0135 -0.0070 0.0092 5227 LYS 96 CG -0.0137 -0.0067 0.0078 5228 LYS 96 CD -0.0146 -0.0072 0.0076 5229 LYS 96 CE -0.0148 -0.0070 0.0062 5230 LYS 96 NZ -0.0138 -0.0062 0.0059 5231 LYS 97 N -0.0132 -0.0092 0.0122 5232 LYS 97 CA -0.0117 -0.0128 0.0140 5233 LYS 97 C -0.0077 -0.0123 0.0145 5234 LYS 97 O -0.0068 -0.0100 0.0137 5235 LYS 97 CB -0.0143 -0.0153 0.0146 5236 LYS 97 CG -0.0132 -0.0192 0.0165 5237 LYS 97 CD -0.0138 -0.0210 0.0172 5238 LYS 97 CE -0.0126 -0.0249 0.0190 5239 LYS 97 NZ -0.0151 -0.0271 0.0195 5240 ASP 98 N -0.0052 -0.0146 0.0159 5241 ASP 98 CA -0.0013 -0.0148 0.0167 5242 ASP 98 C -0.0006 -0.0187 0.0186 5243 ASP 98 O -0.0031 -0.0211 0.0191 5244 ASP 98 CB 0.0016 -0.0126 0.0163 5245 ASP 98 CG 0.0054 -0.0116 0.0166 5246 ASP 98 OD1 0.0059 -0.0127 0.0171 5247 ASP 98 OD2 0.0079 -0.0098 0.0162 5248 GLN 99 N 0.0029 -0.0195 0.0195 5249 GLN 99 CA 0.0041 -0.0231 0.0213 5250 GLN 99 C 0.0043 -0.0250 0.0221 5251 GLN 99 O 0.0027 -0.0280 0.0231 5252 GLN 99 CB 0.0079 -0.0231 0.0220 5253 GLN 99 CG 0.0093 -0.0268 0.0238 5254 GLN 99 CD 0.0131 -0.0267 0.0245 5255 GLN 99 OE1 0.0149 -0.0239 0.0236 5256 GLN 99 NE2 0.0144 -0.0299 0.0261