1 TYR 61 N -0.0089 -0.0041 -0.0017 2 TYR 61 H1 -0.0094 -0.0042 -0.0012 3 TYR 61 H2 -0.0084 -0.0046 -0.0026 4 TYR 61 H3 -0.0083 -0.0033 -0.0015 5 TYR 61 CA -0.0097 -0.0047 -0.0015 6 TYR 61 CB -0.0105 -0.0042 -0.0002 7 TYR 61 CG -0.0098 -0.0030 0.0002 8 TYR 61 CD1 -0.0091 -0.0019 0.0005 9 TYR 61 CE1 -0.0084 -0.0009 0.0009 10 TYR 61 CZ -0.0085 -0.0008 0.0010 11 TYR 61 OH -0.0078 0.0003 0.0014 12 TYR 61 HH -0.0074 0.0009 0.0015 13 TYR 61 CE2 -0.0092 -0.0018 0.0007 14 TYR 61 CD2 -0.0098 -0.0029 0.0003 15 TYR 61 C -0.0104 -0.0060 -0.0021 16 TYR 61 O -0.0110 -0.0065 -0.0019 17 LYS 62 N -0.0103 -0.0067 -0.0028 18 LYS 62 H -0.0098 -0.0063 -0.0029 19 LYS 62 CA -0.0109 -0.0080 -0.0034 20 LYS 62 CB -0.0122 -0.0085 -0.0027 21 LYS 62 CG -0.0123 -0.0081 -0.0022 22 LYS 62 CD -0.0135 -0.0086 -0.0015 23 LYS 62 CE -0.0135 -0.0081 -0.0010 24 LYS 62 NZ -0.0147 -0.0087 -0.0005 25 LYS 62 HZ1 -0.0153 -0.0087 0.0002 26 LYS 62 HZ2 -0.0149 -0.0096 -0.0011 27 LYS 62 HZ3 -0.0147 -0.0084 -0.0002 28 LYS 62 C -0.0108 -0.0086 -0.0041 29 LYS 62 O -0.0116 -0.0095 -0.0042 30 GLY 63 N -0.0090 -0.0091 -0.0065 31 GLY 63 H -0.0080 -0.0083 -0.0064 32 GLY 63 CA -0.0080 -0.0095 -0.0072 33 GLY 63 C -0.0084 -0.0084 -0.0063 34 GLY 63 O -0.0069 -0.0074 -0.0062 35 ASN 64 N -0.0103 -0.0086 -0.0057 36 ASN 64 H -0.0115 -0.0094 -0.0057 37 ASN 64 CA -0.0108 -0.0077 -0.0048 38 ASN 64 CB -0.0123 -0.0089 -0.0051 39 ASN 64 CG -0.0113 -0.0104 -0.0064 40 ASN 64 OD1 -0.0098 -0.0100 -0.0068 41 ASN 64 ND2 -0.0123 -0.0122 -0.0072 42 ASN 64 1HD2 -0.0117 -0.0132 -0.0081 43 ASN 64 2HD2 -0.0135 -0.0125 -0.0069 44 ASN 64 C -0.0117 -0.0059 -0.0034 45 ASN 64 O -0.0118 -0.0050 -0.0027 46 TYR 65 N -0.0105 -0.0052 -0.0020 47 TYR 65 H -0.0104 -0.0055 -0.0023 48 TYR 65 CA -0.0112 -0.0040 -0.0008 49 TYR 65 CB -0.0124 -0.0040 -0.0001 50 TYR 65 CG -0.0136 -0.0054 -0.0003 51 TYR 65 CD1 -0.0137 -0.0066 -0.0011 52 TYR 65 CE1 -0.0148 -0.0079 -0.0012 53 TYR 65 CZ -0.0158 -0.0079 -0.0007 54 TYR 65 OH -0.0170 -0.0092 -0.0008 55 TYR 65 HH -0.0168 -0.0099 -0.0014 56 TYR 65 CE2 -0.0158 -0.0067 0.0001 57 TYR 65 CD2 -0.0147 -0.0054 0.0003 58 TYR 65 C -0.0100 -0.0026 -0.0006 59 TYR 65 O -0.0093 -0.0022 -0.0008 60 GLN 66 N -0.0097 -0.0017 -0.0002 61 GLN 66 H -0.0103 -0.0020 -0.0000 62 GLN 66 CA -0.0087 -0.0003 0.0001 63 GLN 66 CB -0.0078 -0.0001 -0.0002 64 GLN 66 CG -0.0069 -0.0011 -0.0015 65 GLN 66 CD -0.0056 -0.0009 -0.0021 66 GLN 66 OE1 -0.0047 0.0003 -0.0019 67 GLN 66 NE2 -0.0055 -0.0021 -0.0029 68 GLN 66 1HE2 -0.0047 -0.0021 -0.0034 69 GLN 66 2HE2 -0.0062 -0.0031 -0.0032 70 GLN 66 C -0.0094 0.0009 0.0013 71 GLN 66 O -0.0105 0.0009 0.0019 72 LEU 67 N -0.0056 -0.0001 0.0027 73 LEU 67 H -0.0053 -0.0002 0.0026 74 LEU 67 CA -0.0066 0.0012 0.0029 75 LEU 67 CB -0.0071 0.0021 0.0030 76 LEU 67 CG -0.0080 0.0014 0.0038 77 LEU 67 CD1 -0.0083 0.0023 0.0037 78 LEU 67 CD2 -0.0093 0.0014 0.0046 79 LEU 67 C -0.0059 0.0022 0.0022 80 LEU 67 O -0.0049 0.0026 0.0015 81 GLN 68 N -0.0065 0.0028 0.0025 82 GLN 68 H -0.0074 0.0024 0.0031 83 GLN 68 CA -0.0060 0.0038 0.0019 84 GLN 68 CB -0.0051 0.0032 0.0015 85 GLN 68 CG -0.0045 0.0043 0.0008 86 GLN 68 CD -0.0035 0.0035 0.0004 87 GLN 68 OE1 -0.0037 0.0027 0.0008 88 GLN 68 NE2 -0.0022 0.0036 -0.0004 89 GLN 68 1HE2 -0.0015 0.0031 -0.0007 90 GLN 68 2HE2 -0.0020 0.0042 -0.0007 91 GLN 68 C -0.0072 0.0049 0.0023 92 GLN 68 O -0.0081 0.0044 0.0030 93 THR 69 N -0.0047 0.0055 0.0047 94 THR 69 H -0.0047 0.0054 0.0050 95 THR 69 CA -0.0050 0.0056 0.0039 96 THR 69 CB -0.0057 0.0052 0.0037 97 THR 69 CG2 -0.0055 0.0053 0.0038 98 THR 69 OG1 -0.0061 0.0052 0.0028 99 THR 69 HG1 -0.0066 0.0049 0.0028 100 THR 69 C -0.0045 0.0062 0.0034 101 THR 69 O -0.0040 0.0064 0.0037 102 LEU 70 N -0.0046 0.0064 0.0026 103 LEU 70 H -0.0051 0.0062 0.0024 104 LEU 70 CA -0.0042 0.0070 0.0020 105 LEU 70 CB -0.0038 0.0073 0.0019 106 LEU 70 CG -0.0032 0.0079 0.0014 107 LEU 70 CD1 -0.0026 0.0082 0.0018 108 LEU 70 CD2 -0.0031 0.0082 0.0010 109 LEU 70 C -0.0047 0.0069 0.0012 110 LEU 70 O -0.0052 0.0067 0.0009 111 GLU 71 N -0.0003 0.0102 0.0011 112 GLU 71 H -0.0002 0.0105 0.0018 113 GLU 71 CA -0.0005 0.0098 0.0004 114 GLU 71 CB -0.0008 0.0089 0.0009 115 GLU 71 CG -0.0010 0.0084 0.0002 116 GLU 71 CD -0.0012 0.0076 0.0008 117 GLU 71 OE1 -0.0014 0.0071 0.0002 118 GLU 71 OE2 -0.0012 0.0074 0.0017 119 GLU 71 C -0.0003 0.0106 0.0001 120 GLU 71 O -0.0001 0.0111 0.0007 121 LEU 72 N -0.0004 0.0108 -0.0009 122 LEU 72 H -0.0005 0.0104 -0.0014 123 LEU 72 CA -0.0002 0.0116 -0.0013 124 LEU 72 CB -0.0001 0.0120 -0.0023 125 LEU 72 CG 0.0000 0.0125 -0.0022 126 LEU 72 CD1 0.0001 0.0128 -0.0032 127 LEU 72 CD2 0.0004 0.0133 -0.0014 128 LEU 72 C -0.0003 0.0113 -0.0016 129 LEU 72 O -0.0005 0.0106 -0.0020 130 ASN 73 N 0.0053 0.0130 -0.0057 131 ASN 73 H 0.0053 0.0122 -0.0061 132 ASN 73 CA 0.0052 0.0131 -0.0060 133 ASN 73 CB 0.0051 0.0124 -0.0074 134 ASN 73 CG 0.0050 0.0128 -0.0079 135 ASN 73 OD1 0.0051 0.0132 -0.0071 136 ASN 73 ND2 0.0049 0.0125 -0.0092 137 ASN 73 1HD2 0.0049 0.0127 -0.0095 138 ASN 73 2HD2 0.0049 0.0122 -0.0099 139 ASN 73 C 0.0054 0.0124 -0.0049 140 ASN 73 O 0.0056 0.0112 -0.0046 141 MET 74 N 0.0054 0.0132 -0.0042 142 MET 74 H 0.0053 0.0142 -0.0044 143 MET 74 CA 0.0056 0.0128 -0.0030 144 MET 74 CB 0.0056 0.0140 -0.0020 145 MET 74 CG 0.0056 0.0147 -0.0015 146 MET 74 SD 0.0058 0.0135 -0.0004 147 MET 74 CE 0.0057 0.0147 -0.0005 148 MET 74 C 0.0056 0.0120 -0.0033 149 MET 74 O 0.0058 0.0112 -0.0024 150 GLU 75 N 0.0099 0.0112 -0.0072 151 GLU 75 H 0.0097 0.0114 -0.0073 152 GLU 75 CA 0.0087 0.0100 -0.0050 153 GLU 75 CB 0.0074 0.0092 -0.0032 154 GLU 75 CG 0.0092 0.0076 -0.0025 155 GLU 75 CD 0.0077 0.0072 -0.0011 156 GLU 75 OE1 0.0053 0.0083 -0.0007 157 GLU 75 OE2 0.0091 0.0058 -0.0003 158 GLU 75 C 0.0066 0.0112 -0.0050 159 GLU 75 O 0.0060 0.0103 -0.0036 160 THR 76 N 0.0054 0.0132 -0.0066 161 THR 76 H 0.0059 0.0138 -0.0077 162 THR 76 CA 0.0033 0.0146 -0.0068 163 THR 76 CB 0.0023 0.0167 -0.0087 164 THR 76 CG2 -0.0001 0.0182 -0.0089 165 THR 76 OG1 0.0015 0.0166 -0.0081 166 THR 76 HG1 0.0020 0.0175 -0.0095 167 THR 76 C 0.0041 0.0146 -0.0075 168 THR 76 O 0.0026 0.0148 -0.0067 169 LEU 77 N 0.0066 0.0106 -0.0045 170 LEU 77 H 0.0074 0.0110 -0.0049 171 LEU 77 CA 0.0070 0.0104 -0.0042 172 LEU 77 CB 0.0083 0.0112 -0.0050 173 LEU 77 CG 0.0079 0.0121 -0.0064 174 LEU 77 CD1 0.0093 0.0127 -0.0071 175 LEU 77 CD2 0.0066 0.0121 -0.0068 176 LEU 77 C 0.0078 0.0096 -0.0028 177 LEU 77 O 0.0084 0.0095 -0.0024 178 ASN 78 N 0.0077 0.0091 -0.0021 179 ASN 78 H 0.0072 0.0093 -0.0024 180 ASN 78 CA 0.0084 0.0084 -0.0008 181 ASN 78 CB 0.0083 0.0081 -0.0005 182 ASN 78 CG 0.0093 0.0075 0.0007 183 ASN 78 OD1 0.0105 0.0075 0.0010 184 ASN 78 ND2 0.0089 0.0070 0.0013 185 ASN 78 1HD2 0.0095 0.0066 0.0021 186 ASN 78 2HD2 0.0080 0.0071 0.0011 187 ASN 78 C 0.0079 0.0076 0.0002 188 ASN 78 O 0.0089 0.0073 0.0009 189 MET 79 N 0.0064 0.0064 -0.0045 190 MET 79 H 0.0058 0.0063 -0.0057 191 MET 79 CA 0.0063 0.0047 -0.0034 192 MET 79 CB 0.0051 0.0031 -0.0044 193 MET 79 CG 0.0045 0.0032 -0.0056 194 MET 79 SD 0.0032 0.0013 -0.0066 195 MET 79 CE 0.0026 0.0019 -0.0082 196 MET 79 C 0.0068 0.0042 -0.0020 197 MET 79 O 0.0071 0.0033 -0.0006 198 THR 80 N 0.0067 0.0047 -0.0024 199 THR 80 H 0.0065 0.0054 -0.0036 200 THR 80 CA 0.0072 0.0043 -0.0013 201 THR 80 CB 0.0067 0.0043 -0.0022 202 THR 80 CG2 0.0055 0.0028 -0.0032 203 THR 80 OG1 0.0069 0.0059 -0.0033 204 THR 80 HG1 0.0063 0.0059 -0.0044 205 THR 80 C 0.0084 0.0055 -0.0000 206 THR 80 O 0.0088 0.0049 0.0014 207 MET 81 N 0.0076 0.0083 0.0006 208 MET 81 H 0.0077 0.0084 0.0003 209 MET 81 CA 0.0080 0.0086 0.0008 210 MET 81 CB 0.0082 0.0087 0.0002 211 MET 81 CG 0.0077 0.0084 -0.0001 212 MET 81 SD 0.0077 0.0085 -0.0008 213 MET 81 CE 0.0070 0.0081 -0.0009 214 MET 81 C 0.0086 0.0089 0.0011 215 MET 81 O 0.0087 0.0090 0.0009 216 PRO 82 N 0.0089 0.0090 0.0016 217 PRO 82 CA 0.0094 0.0093 0.0018 218 PRO 82 CB 0.0095 0.0093 0.0025 219 PRO 82 CG 0.0091 0.0091 0.0025 220 PRO 82 CD 0.0086 0.0088 0.0020 221 PRO 82 C 0.0098 0.0096 0.0013 222 PRO 82 O 0.0098 0.0097 0.0011 223 LEU 83 N 0.0098 0.0083 0.0034 224 LEU 83 H 0.0099 0.0084 0.0035 225 LEU 83 CA 0.0099 0.0080 0.0034 226 LEU 83 CB 0.0101 0.0080 0.0036 227 LEU 83 CG 0.0102 0.0081 0.0036 228 LEU 83 CD1 0.0104 0.0081 0.0038 229 LEU 83 CD2 0.0101 0.0081 0.0035 230 LEU 83 C 0.0099 0.0080 0.0034 231 LEU 83 O 0.0100 0.0081 0.0034 232 SER 84 N 0.0099 0.0077 0.0033 233 SER 84 H 0.0099 0.0076 0.0032 234 SER 84 CA 0.0099 0.0076 0.0032 235 SER 84 CB 0.0097 0.0075 0.0031 236 SER 84 OG 0.0097 0.0074 0.0030 237 SER 84 HG 0.0096 0.0072 0.0029 238 SER 84 C 0.0101 0.0074 0.0034 239 SER 84 O 0.0101 0.0073 0.0033 240 CYS 85 N 0.0105 0.0022 0.0070 241 CYS 85 H 0.0105 0.0023 0.0066 242 CYS 85 CA 0.0104 0.0013 0.0080 243 CYS 85 CB 0.0107 0.0018 0.0091 244 CYS 85 SG 0.0111 0.0030 0.0097 245 CYS 85 C 0.0101 0.0002 0.0076 246 CYS 85 O 0.0100 0.0003 0.0069 247 THR 86 N 0.0100 -0.0008 0.0081 248 THR 86 H 0.0101 -0.0009 0.0087 249 THR 86 CA 0.0097 -0.0020 0.0079 250 THR 86 CB 0.0094 -0.0028 0.0076 251 THR 86 CG2 0.0091 -0.0041 0.0074 252 THR 86 OG1 0.0093 -0.0024 0.0065 253 THR 86 HG1 0.0092 -0.0029 0.0064 254 THR 86 C 0.0098 -0.0024 0.0090 255 THR 86 O 0.0099 -0.0026 0.0100 256 LYS 87 N 0.0114 -0.0065 0.0109 257 LYS 87 H 0.0109 -0.0060 0.0093 258 LYS 87 CA 0.0119 -0.0068 0.0122 259 LYS 87 CB 0.0123 -0.0055 0.0111 260 LYS 87 CG 0.0129 -0.0056 0.0124 261 LYS 87 CD 0.0132 -0.0041 0.0111 262 LYS 87 CE 0.0139 -0.0041 0.0124 263 LYS 87 NZ 0.0142 -0.0026 0.0110 264 LYS 87 HZ1 0.0151 -0.0012 0.0106 265 LYS 87 HZ2 0.0132 -0.0031 0.0096 266 LYS 87 HZ3 0.0147 -0.0026 0.0118 267 LYS 87 C 0.0105 -0.0090 0.0126 268 LYS 87 O 0.0108 -0.0101 0.0145 269 ASN 88 N 0.0091 -0.0097 0.0109 270 ASN 88 H 0.0089 -0.0088 0.0094 271 ASN 88 CA 0.0076 -0.0117 0.0109 272 ASN 88 CB 0.0072 -0.0119 0.0103 273 ASN 88 CG 0.0084 -0.0115 0.0121 274 ASN 88 OD1 0.0085 -0.0128 0.0140 275 ASN 88 ND2 0.0094 -0.0098 0.0116 276 ASN 88 1HD2 0.0102 -0.0095 0.0128 277 ASN 88 2HD2 0.0093 -0.0089 0.0101 278 ASN 88 C 0.0063 -0.0123 0.0092 279 ASN 88 O 0.0065 -0.0112 0.0081 280 ASN 89 N 0.0026 -0.0158 0.0135 281 ASN 89 H 0.0024 -0.0170 0.0146 282 ASN 89 CA 0.0001 -0.0168 0.0115 283 ASN 89 CB -0.0023 -0.0197 0.0116 284 ASN 89 CG -0.0023 -0.0222 0.0144 285 ASN 89 OD1 -0.0009 -0.0222 0.0161 286 ASN 89 ND2 -0.0039 -0.0246 0.0150 287 ASN 89 1HD2 -0.0040 -0.0264 0.0169 288 ASN 89 2HD2 -0.0051 -0.0247 0.0136 289 ASN 89 C -0.0004 -0.0146 0.0084 290 ASN 89 O -0.0013 -0.0141 0.0067 291 SER 90 N 0.0001 -0.0134 0.0076 292 SER 90 H 0.0008 -0.0139 0.0090 293 SER 90 CA -0.0003 -0.0112 0.0047 294 SER 90 CB -0.0008 -0.0112 0.0040 295 SER 90 OG 0.0013 -0.0107 0.0062 296 SER 90 HG 0.0006 -0.0118 0.0064 297 SER 90 C 0.0019 -0.0082 0.0041 298 SER 90 O 0.0013 -0.0068 0.0018 299 HIS 91 N 0.0043 -0.0064 0.0057 300 HIS 91 H 0.0043 -0.0069 0.0067 301 HIS 91 CA 0.0054 -0.0050 0.0056 302 HIS 91 CB 0.0062 -0.0044 0.0063 303 HIS 91 CG 0.0058 -0.0044 0.0054 304 HIS 91 ND1 0.0061 -0.0033 0.0042 305 HIS 91 CE1 0.0056 -0.0037 0.0037 306 HIS 91 NE2 0.0050 -0.0048 0.0045 307 HIS 91 CD2 0.0051 -0.0053 0.0056 308 HIS 91 C 0.0061 -0.0045 0.0064 309 HIS 91 O 0.0063 -0.0050 0.0077 310 HIS 92 N 0.0065 -0.0035 0.0054 311 HIS 92 H 0.0063 -0.0031 0.0043 312 HIS 92 CA 0.0072 -0.0029 0.0059 313 HIS 92 CB 0.0066 -0.0031 0.0050 314 HIS 92 CG 0.0055 -0.0046 0.0053 315 HIS 92 ND1 0.0054 -0.0054 0.0065 316 HIS 92 CE1 0.0043 -0.0066 0.0063 317 HIS 92 NE2 0.0037 -0.0067 0.0050 318 HIS 92 CD2 0.0044 -0.0054 0.0043 319 HIS 92 C 0.0082 -0.0014 0.0055 320 HIS 92 O 0.0082 -0.0009 0.0043 321 TYR 93 N 0.0082 -0.0005 0.0046 322 TYR 93 H 0.0083 -0.0010 0.0052 323 TYR 93 CA 0.0088 0.0009 0.0046 324 TYR 93 CB 0.0095 0.0013 0.0057 325 TYR 93 CG 0.0094 0.0009 0.0058 326 TYR 93 CD1 0.0092 -0.0003 0.0064 327 TYR 93 CE1 0.0091 -0.0006 0.0064 328 TYR 93 CZ 0.0092 0.0003 0.0058 329 TYR 93 OH 0.0090 0.0000 0.0058 330 TYR 93 HH 0.0089 0.0006 0.0051 331 TYR 93 CE2 0.0094 0.0016 0.0052 332 TYR 93 CD2 0.0095 0.0019 0.0052 333 TYR 93 C 0.0090 0.0016 0.0044 334 TYR 93 O 0.0092 0.0012 0.0051 335 ILE 94 N 0.0090 0.0027 0.0035 336 ILE 94 H 0.0089 0.0030 0.0030 337 ILE 94 CA 0.0093 0.0036 0.0032 338 ILE 94 CB 0.0087 0.0039 0.0018 339 ILE 94 CG2 0.0090 0.0049 0.0016 340 ILE 94 CG1 0.0079 0.0026 0.0013 341 ILE 94 CD1 0.0072 0.0027 -0.0002 342 ILE 94 C 0.0100 0.0048 0.0037 343 ILE 94 O 0.0101 0.0053 0.0034 344 ARG 95 N 0.0106 0.0055 0.0028 345 ARG 95 H 0.0106 0.0054 0.0026 346 ARG 95 CA 0.0105 0.0057 0.0030 347 ARG 95 CB 0.0107 0.0056 0.0030 348 ARG 95 CG 0.0107 0.0055 0.0027 349 ARG 95 CD 0.0109 0.0054 0.0027 350 ARG 95 NE 0.0109 0.0053 0.0024 351 ARG 95 HE 0.0108 0.0052 0.0023 352 ARG 95 CZ 0.0111 0.0052 0.0024 353 ARG 95 NH1 0.0112 0.0053 0.0026 354 ARG 95 1HH1 0.0111 0.0054 0.0028 355 ARG 95 2HH1 0.0113 0.0053 0.0026 356 ARG 95 NH2 0.0111 0.0051 0.0021 357 ARG 95 1HH2 0.0111 0.0050 0.0020 358 ARG 95 2HH2 0.0112 0.0050 0.0021 359 ARG 95 C 0.0102 0.0057 0.0029 360 ARG 95 O 0.0101 0.0055 0.0027 361 VAL 96 N 0.0100 0.0058 0.0031 362 VAL 96 H 0.0101 0.0059 0.0033 363 VAL 96 CA 0.0097 0.0058 0.0030 364 VAL 96 CB 0.0094 0.0059 0.0031 365 VAL 96 CG1 0.0091 0.0059 0.0031 366 VAL 96 CG2 0.0094 0.0059 0.0030 367 VAL 96 C 0.0097 0.0059 0.0032 368 VAL 96 O 0.0097 0.0060 0.0034 369 GLY 97 N 0.0104 0.0058 0.0022 370 GLY 97 H 0.0103 0.0054 0.0019 371 GLY 97 CA 0.0108 0.0059 0.0025 372 GLY 97 C 0.0114 0.0060 0.0027 373 GLY 97 O 0.0116 0.0057 0.0026 374 ASN 98 N 0.0117 0.0064 0.0031 375 ASN 98 H 0.0115 0.0066 0.0032 376 ASN 98 CA 0.0122 0.0066 0.0034 377 ASN 98 CB 0.0128 0.0065 0.0035 378 ASN 98 CG 0.0126 0.0069 0.0037 379 ASN 98 OD1 0.0121 0.0072 0.0038 380 ASN 98 ND2 0.0130 0.0068 0.0038 381 ASN 98 1HD2 0.0129 0.0071 0.0039 382 ASN 98 2HD2 0.0134 0.0066 0.0038 383 ASN 98 C 0.0121 0.0071 0.0037 384 ASN 98 O 0.0125 0.0073 0.0040 385 GLU 99 N 0.0131 0.0033 0.0008 386 GLU 99 H 0.0136 0.0030 0.0014 387 GLU 99 CA 0.0130 0.0040 -0.0003 388 GLU 99 CB 0.0141 0.0039 -0.0005 389 GLU 99 CG 0.0156 0.0038 -0.0006 390 GLU 99 CD 0.0166 0.0039 -0.0009 391 GLU 99 OE1 0.0162 0.0040 -0.0010 392 GLU 99 OE2 0.0179 0.0037 -0.0009 393 GLU 99 C 0.0117 0.0042 -0.0006 394 GLU 99 O 0.0113 0.0048 -0.0016 395 THR 100 N 0.0111 0.0038 0.0003 396 THR 100 H 0.0113 0.0034 0.0012 397 THR 100 CA 0.0098 0.0041 0.0000 398 THR 100 CB 0.0101 0.0040 0.0001 399 THR 100 CG2 0.0088 0.0044 -0.0003 400 THR 100 OG1 0.0112 0.0043 -0.0007 401 THR 100 HG1 0.0120 0.0041 -0.0003 402 THR 100 C 0.0087 0.0038 0.0009 403 THR 100 O 0.0089 0.0032 0.0019 404 GLY 101 N 0.0105 0.0045 0.0001 405 GLY 101 H 0.0104 0.0051 -0.0004 406 GLY 101 CA 0.0099 0.0038 0.0004 407 GLY 101 C 0.0089 0.0041 -0.0001 408 GLY 101 O 0.0087 0.0048 -0.0006 409 LEU 102 N 0.0082 0.0034 0.0002 410 LEU 102 H 0.0083 0.0028 0.0007 411 LEU 102 CA 0.0071 0.0035 -0.0001 412 LEU 102 CB 0.0065 0.0032 -0.0000 413 LEU 102 CG 0.0054 0.0033 -0.0004 414 LEU 102 CD1 0.0053 0.0042 -0.0011 415 LEU 102 CD2 0.0049 0.0028 -0.0002 416 LEU 102 C 0.0068 0.0029 0.0002 417 LEU 102 O 0.0070 0.0022 0.0008 418 GLU 103 N 0.0077 0.0016 -0.0000 419 GLU 103 H 0.0077 0.0022 -0.0009 420 GLU 103 CA 0.0067 0.0010 0.0003 421 GLU 103 CB 0.0065 0.0014 -0.0004 422 GLU 103 CG 0.0055 0.0008 -0.0001 423 GLU 103 CD 0.0055 0.0013 -0.0008 424 GLU 103 OE1 0.0044 0.0014 -0.0015 425 GLU 103 OE2 0.0066 0.0016 -0.0006 426 GLU 103 C 0.0054 0.0007 0.0001 427 GLU 103 O 0.0050 0.0012 -0.0009 428 LEU 104 N 0.0046 -0.0001 0.0010 429 LEU 104 H 0.0049 -0.0005 0.0018 430 LEU 104 CA 0.0033 -0.0005 0.0008 431 LEU 104 CB 0.0033 -0.0010 0.0016 432 LEU 104 CG 0.0020 -0.0012 0.0012 433 LEU 104 CD1 0.0024 -0.0012 0.0014 434 LEU 104 CD2 0.0008 -0.0021 0.0019 435 LEU 104 C 0.0024 -0.0010 0.0011 436 LEU 104 O 0.0025 -0.0016 0.0021 437 THR 105 N 0.0017 -0.0020 -0.0001 438 THR 105 H 0.0017 -0.0013 -0.0018 439 THR 105 CA -0.0001 -0.0032 0.0003 440 THR 105 CB 0.0000 -0.0027 -0.0009 441 THR 105 CG2 -0.0018 -0.0039 -0.0004 442 THR 105 OG1 0.0020 -0.0019 0.0001 443 THR 105 HG1 0.0024 -0.0012 -0.0011 444 THR 105 C -0.0022 -0.0041 -0.0006 445 THR 105 O -0.0026 -0.0036 -0.0025 446 LEU 106 N -0.0036 -0.0055 0.0009 447 LEU 106 H -0.0033 -0.0059 0.0025 448 LEU 106 CA -0.0058 -0.0066 0.0003 449 LEU 106 CB -0.0067 -0.0079 0.0024 450 LEU 106 CG -0.0055 -0.0077 0.0037 451 LEU 106 CD1 -0.0064 -0.0091 0.0059 452 LEU 106 CD2 -0.0056 -0.0071 0.0020 453 LEU 106 C -0.0071 -0.0070 -0.0006 454 LEU 106 O -0.0071 -0.0075 0.0007 455 THR 107 N -0.0124 -0.0065 -0.0013 456 THR 107 H -0.0124 -0.0061 -0.0024 457 THR 107 CA -0.0141 -0.0067 -0.0029 458 THR 107 CB -0.0122 -0.0052 -0.0046 459 THR 107 CG2 -0.0109 -0.0039 -0.0069 460 THR 107 OG1 -0.0137 -0.0054 -0.0059 461 THR 107 HG1 -0.0122 -0.0046 -0.0064 462 THR 107 C -0.0166 -0.0070 -0.0048 463 THR 107 O -0.0169 -0.0069 -0.0055 464 ASN 108 N -0.0187 -0.0076 -0.0056 465 ASN 108 H -0.0185 -0.0078 -0.0050 466 ASN 108 CA -0.0212 -0.0080 -0.0076 467 ASN 108 CB -0.0239 -0.0095 -0.0068 468 ASN 108 CG -0.0246 -0.0108 -0.0040 469 ASN 108 OD1 -0.0254 -0.0112 -0.0038 470 ASN 108 ND2 -0.0243 -0.0115 -0.0016 471 ASN 108 1HD2 -0.0248 -0.0124 0.0003 472 ASN 108 2HD2 -0.0237 -0.0112 -0.0018 473 ASN 108 C -0.0208 -0.0067 -0.0107 474 ASN 108 O -0.0224 -0.0067 -0.0128 475 THR 109 N -0.0195 -0.0056 -0.0090 476 THR 109 H -0.0182 -0.0059 -0.0080 477 THR 109 CA -0.0189 -0.0043 -0.0113 478 THR 109 CB -0.0172 -0.0038 -0.0118 479 THR 109 CG2 -0.0166 -0.0024 -0.0143 480 THR 109 OG1 -0.0183 -0.0042 -0.0112 481 THR 109 HG1 -0.0170 -0.0041 -0.0111 482 THR 109 C -0.0177 -0.0038 -0.0119 483 THR 109 O -0.0158 -0.0041 -0.0108 484 SER 110 N -0.0189 -0.0031 -0.0135 485 SER 110 H -0.0205 -0.0028 -0.0143 486 SER 110 CA -0.0180 -0.0025 -0.0143 487 SER 110 CB -0.0201 -0.0022 -0.0154 488 SER 110 OG -0.0192 -0.0016 -0.0163 489 SER 110 HG -0.0206 -0.0014 -0.0171 490 SER 110 C -0.0161 -0.0014 -0.0160 491 SER 110 O -0.0166 -0.0006 -0.0176 492 ILE 111 N -0.0130 0.0024 -0.0129 493 ILE 111 H -0.0124 0.0014 -0.0109 494 ILE 111 CA -0.0103 0.0033 -0.0153 495 ILE 111 CB -0.0068 0.0023 -0.0140 496 ILE 111 CG2 -0.0039 0.0032 -0.0165 497 ILE 111 CG1 -0.0067 0.0016 -0.0125 498 ILE 111 CD1 -0.0035 0.0004 -0.0106 499 ILE 111 C -0.0105 0.0041 -0.0172 500 ILE 111 O -0.0104 0.0055 -0.0200 501 ILE 112 N -0.0108 0.0034 -0.0155 502 ILE 112 H -0.0110 0.0024 -0.0132 503 ILE 112 CA -0.0108 0.0041 -0.0170 504 ILE 112 CB -0.0088 0.0031 -0.0152 505 ILE 112 CG2 -0.0087 0.0038 -0.0169 506 ILE 112 CG1 -0.0051 0.0025 -0.0148 507 ILE 112 CD1 -0.0031 0.0013 -0.0125 508 ILE 112 C -0.0144 0.0046 -0.0174 509 ILE 112 O -0.0165 0.0038 -0.0152 510 SER 113 N -0.0214 0.0112 -0.0282 511 SER 113 H -0.0169 0.0117 -0.0335 512 SER 113 CA -0.0296 0.0141 -0.0291 513 SER 113 CB -0.0316 0.0183 -0.0389 514 SER 113 OG -0.0247 0.0181 -0.0442 515 SER 113 HG -0.0263 0.0208 -0.0501 516 SER 113 C -0.0296 0.0128 -0.0255 517 SER 113 O -0.0363 0.0134 -0.0213 518 HIS 114 N -0.0217 0.0109 -0.0271 519 HIS 114 H -0.0165 0.0105 -0.0304 520 HIS 114 CA -0.0198 0.0094 -0.0246 521 HIS 114 CB -0.0111 0.0084 -0.0295 522 HIS 114 CG -0.0115 0.0121 -0.0393 523 HIS 114 ND1 -0.0163 0.0150 -0.0431 524 HIS 114 CE1 -0.0150 0.0178 -0.0519 525 HIS 114 NE2 -0.0096 0.0169 -0.0541 526 HIS 114 CD2 -0.0074 0.0133 -0.0461 527 HIS 114 C -0.0192 0.0056 -0.0149 528 HIS 114 O -0.0186 0.0036 -0.0099 529 LYS 115 N -0.0115 0.0050 -0.0076 530 LYS 115 H -0.0103 0.0031 -0.0076 531 LYS 115 CA -0.0094 0.0066 -0.0042 532 LYS 115 CB -0.0077 0.0085 -0.0010 533 LYS 115 CG -0.0102 0.0123 -0.0013 534 LYS 115 CD -0.0086 0.0143 0.0019 535 LYS 115 CE -0.0111 0.0180 0.0016 536 LYS 115 NZ -0.0094 0.0197 0.0046 537 LYS 115 HZ1 -0.0078 0.0174 0.0049 538 LYS 115 HZ2 -0.0080 0.0209 0.0070 539 LYS 115 HZ3 -0.0112 0.0220 0.0043 540 LYS 115 C -0.0067 0.0033 -0.0034 541 LYS 115 O -0.0048 0.0043 -0.0006 542 PHE 116 N -0.0066 -0.0006 -0.0059 543 PHE 116 H -0.0082 -0.0012 -0.0082 544 PHE 116 CA -0.0042 -0.0041 -0.0056 545 PHE 116 CB -0.0044 -0.0082 -0.0087 546 PHE 116 CG -0.0031 -0.0096 -0.0081 547 PHE 116 CD1 -0.0054 -0.0088 -0.0101 548 PHE 116 CE1 -0.0042 -0.0101 -0.0096 549 PHE 116 CZ -0.0007 -0.0121 -0.0072 550 PHE 116 CE2 0.0015 -0.0129 -0.0052 551 PHE 116 CD2 0.0003 -0.0117 -0.0057 552 PHE 116 C -0.0044 -0.0039 -0.0057 553 PHE 116 O -0.0072 -0.0022 -0.0077 554 CYS 117 N 0.0013 -0.0036 0.0017 555 CYS 117 H 0.0012 -0.0040 0.0034 556 CYS 117 CA -0.0009 -0.0041 -0.0011 557 CYS 117 CB -0.0002 -0.0034 -0.0032 558 CYS 117 SG 0.0035 -0.0014 -0.0048 559 CYS 117 C -0.0041 -0.0058 -0.0001 560 CYS 117 O -0.0061 -0.0063 -0.0020 561 ASN 118 N -0.0048 -0.0067 0.0029 562 ASN 118 H -0.0033 -0.0062 0.0044 563 ASN 118 CA -0.0078 -0.0083 0.0041 564 ASN 118 CB -0.0079 -0.0090 0.0078 565 ASN 118 CG -0.0111 -0.0107 0.0090 566 ASN 118 OD1 -0.0123 -0.0112 0.0089 567 ASN 118 ND2 -0.0125 -0.0116 0.0103 568 ASN 118 1HD2 -0.0145 -0.0127 0.0112 569 ASN 118 2HD2 -0.0114 -0.0111 0.0104 570 ASN 118 C -0.0103 -0.0090 0.0021 571 ASN 118 O -0.0099 -0.0087 0.0015 572 LEU 119 N -0.0084 -0.0097 0.0051 573 LEU 119 H -0.0090 -0.0101 0.0061 574 LEU 119 CA -0.0114 -0.0112 0.0023 575 LEU 119 CB -0.0122 -0.0114 -0.0020 576 LEU 119 CG -0.0089 -0.0092 -0.0052 577 LEU 119 CD1 -0.0099 -0.0095 -0.0091 578 LEU 119 CD2 -0.0078 -0.0084 -0.0068 579 LEU 119 C -0.0151 -0.0136 0.0044 580 LEU 119 O -0.0174 -0.0149 0.0026 581 SER 120 N -0.0156 -0.0142 0.0084 582 SER 120 H -0.0136 -0.0131 0.0099 583 SER 120 CA -0.0191 -0.0165 0.0107 584 SER 120 CB -0.0189 -0.0167 0.0149 585 SER 120 OG -0.0187 -0.0165 0.0138 586 SER 120 HG -0.0186 -0.0166 0.0166 587 SER 120 C -0.0202 -0.0172 0.0119 588 SER 120 O -0.0234 -0.0191 0.0111 589 ASP 121 N -0.0194 -0.0140 0.0176 590 ASP 121 H -0.0164 -0.0128 0.0180 591 ASP 121 CA -0.0195 -0.0137 0.0200 592 ASP 121 CB -0.0154 -0.0117 0.0235 593 ASP 121 CG -0.0159 -0.0114 0.0280 594 ASP 121 OD1 -0.0198 -0.0126 0.0305 595 ASP 121 OD2 -0.0125 -0.0099 0.0288 596 ASP 121 C -0.0195 -0.0142 0.0161 597 ASP 121 O -0.0216 -0.0149 0.0169 598 ALA 122 N -0.0170 -0.0137 0.0117 599 ALA 122 H -0.0153 -0.0132 0.0112 600 ALA 122 CA -0.0165 -0.0141 0.0076 601 ALA 122 CB -0.0134 -0.0134 0.0032 602 ALA 122 C -0.0212 -0.0162 0.0053 603 ALA 122 O -0.0225 -0.0168 0.0042 604 HIS 123 N -0.0231 -0.0165 0.0068 605 HIS 123 H -0.0199 -0.0162 0.0070 606 HIS 123 CA -0.0287 -0.0163 0.0042 607 HIS 123 CB -0.0286 -0.0156 0.0021 608 HIS 123 CG -0.0340 -0.0151 -0.0016 609 HIS 123 ND1 -0.0391 -0.0164 0.0005 610 HIS 123 CE1 -0.0429 -0.0154 -0.0041 611 HIS 123 NE2 -0.0406 -0.0135 -0.0090 612 HIS 123 CD2 -0.0349 -0.0133 -0.0074 613 HIS 123 C -0.0338 -0.0183 0.0082 614 HIS 123 O -0.0388 -0.0183 0.0063 615 LYS 124 N -0.0326 -0.0200 0.0139 616 LYS 124 H -0.0284 -0.0199 0.0152 617 LYS 124 CA -0.0368 -0.0220 0.0184 618 LYS 124 CB -0.0341 -0.0236 0.0244 619 LYS 124 CG -0.0328 -0.0238 0.0253 620 LYS 124 CD -0.0300 -0.0254 0.0313 621 LYS 124 CE -0.0287 -0.0256 0.0325 622 LYS 124 NZ -0.0259 -0.0272 0.0384 623 LYS 124 HZ1 -0.0214 -0.0267 0.0384 624 LYS 124 HZ2 -0.0282 -0.0284 0.0412 625 LYS 124 HZ3 -0.0262 -0.0277 0.0397 626 LYS 124 C -0.0389 -0.0224 0.0189 627 LYS 124 O -0.0440 -0.0236 0.0205 628 LYS 125 N -0.0298 -0.0230 0.0185 629 LYS 125 H -0.0265 -0.0202 0.0181 630 LYS 125 CA -0.0300 -0.0227 0.0149 631 LYS 125 CB -0.0247 -0.0179 0.0124 632 LYS 125 CG -0.0203 -0.0149 0.0178 633 LYS 125 CD -0.0210 -0.0160 0.0216 634 LYS 125 CE -0.0165 -0.0128 0.0267 635 LYS 125 NZ -0.0177 -0.0142 0.0303 636 LYS 125 HZ1 -0.0144 -0.0118 0.0332 637 LYS 125 HZ2 -0.0188 -0.0147 0.0268 638 LYS 125 HZ3 -0.0207 -0.0171 0.0334 639 LYS 125 C -0.0337 -0.0251 0.0087 640 LYS 125 O -0.0336 -0.0245 0.0047 641 ASN 126 N -0.0370 -0.0277 0.0078 642 ASN 126 H -0.0369 -0.0280 0.0112 643 ASN 126 CA -0.0409 -0.0303 0.0022 644 ASN 126 CB -0.0443 -0.0333 0.0030 645 ASN 126 CG -0.0481 -0.0372 0.0085 646 ASN 126 OD1 -0.0495 -0.0385 0.0104 647 ASN 126 ND2 -0.0500 -0.0390 0.0112 648 ASN 126 1HD2 -0.0525 -0.0415 0.0148 649 ASN 126 2HD2 -0.0488 -0.0378 0.0096 650 ASN 126 C -0.0384 -0.0274 -0.0044 651 ASN 126 O -0.0406 -0.0286 -0.0096 652 LEU 127 N -0.0226 -0.0213 -0.0061 653 LEU 127 H -0.0218 -0.0218 -0.0047 654 LEU 127 CA -0.0225 -0.0194 -0.0079 655 LEU 127 CB -0.0217 -0.0190 -0.0075 656 LEU 127 CG -0.0233 -0.0208 -0.0073 657 LEU 127 CD1 -0.0222 -0.0203 -0.0067 658 LEU 127 CD2 -0.0254 -0.0210 -0.0094 659 LEU 127 C -0.0211 -0.0173 -0.0086 660 LEU 127 O -0.0212 -0.0157 -0.0103 661 TYR 128 N -0.0197 -0.0173 -0.0072 662 TYR 128 H -0.0197 -0.0186 -0.0058 663 TYR 128 CA -0.0183 -0.0154 -0.0075 664 TYR 128 CB -0.0169 -0.0161 -0.0055 665 TYR 128 CG -0.0152 -0.0144 -0.0054 666 TYR 128 CD1 -0.0133 -0.0128 -0.0050 667 TYR 128 CE1 -0.0116 -0.0113 -0.0048 668 TYR 128 CZ -0.0119 -0.0115 -0.0049 669 TYR 128 OH -0.0102 -0.0100 -0.0047 670 TYR 128 HH -0.0091 -0.0090 -0.0046 671 TYR 128 CE2 -0.0138 -0.0131 -0.0053 672 TYR 128 CD2 -0.0154 -0.0146 -0.0055 673 TYR 128 C -0.0195 -0.0147 -0.0096 674 TYR 128 O -0.0210 -0.0160 -0.0098 675 ASP 129 N -0.0106 -0.0027 -0.0040 676 ASP 129 H -0.0106 -0.0012 -0.0039 677 ASP 129 CA -0.0106 -0.0032 -0.0047 678 ASP 129 CB -0.0109 -0.0019 -0.0065 679 ASP 129 CG -0.0110 -0.0028 -0.0075 680 ASP 129 OD1 -0.0109 -0.0045 -0.0070 681 ASP 129 OD2 -0.0112 -0.0016 -0.0088 682 ASP 129 C -0.0104 -0.0031 -0.0030 683 ASP 129 O -0.0104 -0.0015 -0.0021 684 HIS 130 N -0.0103 -0.0049 -0.0025 685 HIS 130 H -0.0104 -0.0062 -0.0033 686 HIS 130 CA -0.0101 -0.0052 -0.0010 687 HIS 130 CB -0.0099 -0.0075 -0.0004 688 HIS 130 CG -0.0098 -0.0083 0.0008 689 HIS 130 ND1 -0.0096 -0.0077 0.0027 690 HIS 130 CE1 -0.0095 -0.0088 0.0032 691 HIS 130 NE2 -0.0096 -0.0101 0.0017 692 HIS 130 CD2 -0.0098 -0.0098 0.0002 693 HIS 130 C -0.0102 -0.0044 -0.0017 694 HIS 130 O -0.0101 -0.0037 -0.0003 695 THR 131 N -0.0050 0.0020 -0.0011 696 THR 131 H -0.0046 0.0023 -0.0011 697 THR 131 CA -0.0044 0.0013 -0.0018 698 THR 131 CB -0.0035 0.0014 -0.0024 699 THR 131 CG2 -0.0029 0.0007 -0.0032 700 THR 131 OG1 -0.0037 0.0010 -0.0025 701 THR 131 HG1 -0.0032 0.0013 -0.0027 702 THR 131 C -0.0042 0.0017 -0.0018 703 THR 131 O -0.0044 0.0011 -0.0020 704 LEU 132 N -0.0037 0.0027 -0.0016 705 LEU 132 H -0.0036 0.0032 -0.0014 706 LEU 132 CA -0.0034 0.0032 -0.0015 707 LEU 132 CB -0.0027 0.0043 -0.0014 708 LEU 132 CG -0.0017 0.0043 -0.0020 709 LEU 132 CD1 -0.0011 0.0054 -0.0019 710 LEU 132 CD2 -0.0012 0.0036 -0.0027 711 LEU 132 C -0.0042 0.0033 -0.0009 712 LEU 132 O -0.0042 0.0030 -0.0010 713 MET 133 N -0.0065 0.0010 -0.0031 714 MET 133 H -0.0063 -0.0004 -0.0042 715 MET 133 CA -0.0045 0.0011 -0.0023 716 MET 133 CB -0.0024 -0.0010 -0.0034 717 MET 133 CG -0.0037 -0.0026 -0.0052 718 MET 133 SD -0.0051 -0.0017 -0.0048 719 MET 133 CE -0.0020 -0.0013 -0.0036 720 MET 133 C -0.0031 0.0030 -0.0003 721 MET 133 O -0.0025 0.0039 0.0006 722 SER 134 N -0.0027 0.0037 0.0004 723 SER 134 H -0.0033 0.0030 -0.0004 724 SER 134 CA -0.0014 0.0056 0.0023 725 SER 134 CB -0.0008 0.0059 0.0028 726 SER 134 OG 0.0011 0.0042 0.0019 727 SER 134 HG 0.0020 0.0048 0.0027 728 SER 134 C -0.0031 0.0077 0.0035 729 SER 134 O -0.0021 0.0090 0.0049 730 ILE 135 N 0.0008 0.0070 -0.0001 731 ILE 135 H 0.0006 0.0067 -0.0004 732 ILE 135 CA 0.0002 0.0074 0.0003 733 ILE 135 CB -0.0006 0.0074 0.0001 734 ILE 135 CG2 -0.0013 0.0078 0.0005 735 ILE 135 CG1 -0.0004 0.0075 0.0002 736 ILE 135 CD1 -0.0011 0.0074 -0.0001 737 ILE 135 C -0.0000 0.0074 0.0002 738 ILE 135 O -0.0001 0.0078 0.0007 739 ILE 136 N -0.0001 0.0069 -0.0003 740 ILE 136 H -0.0000 0.0066 -0.0007 741 ILE 136 CA -0.0003 0.0069 -0.0005 742 ILE 136 CB -0.0005 0.0063 -0.0012 743 ILE 136 CG2 -0.0006 0.0062 -0.0014 744 ILE 136 CG1 -0.0012 0.0063 -0.0014 745 ILE 136 CD1 -0.0014 0.0058 -0.0022 746 ILE 136 C 0.0004 0.0070 -0.0002 747 ILE 136 O 0.0002 0.0072 0.0000 748 SER 137 N 0.0003 0.0077 0.0016 749 SER 137 H 0.0002 0.0076 0.0015 750 SER 137 CA 0.0015 0.0079 0.0016 751 SER 137 CB 0.0025 0.0078 0.0014 752 SER 137 OG 0.0025 0.0068 0.0007 753 SER 137 HG 0.0028 0.0068 0.0006 754 SER 137 C 0.0016 0.0090 0.0023 755 SER 137 O 0.0022 0.0092 0.0024 756 THR 138 N 0.0011 0.0097 0.0029 757 THR 138 H 0.0007 0.0096 0.0028 758 THR 138 CA 0.0012 0.0108 0.0036 759 THR 138 CB 0.0007 0.0114 0.0041 760 THR 138 CG2 0.0008 0.0126 0.0049 761 THR 138 OG1 0.0014 0.0114 0.0040 762 THR 138 HG1 0.0011 0.0107 0.0035 763 THR 138 C 0.0004 0.0109 0.0038 764 THR 138 O 0.0008 0.0115 0.0041 765 PHE 139 N 0.0002 0.0082 0.0028 766 PHE 139 H 0.0002 0.0084 0.0033 767 PHE 139 CA 0.0004 0.0073 0.0028 768 PHE 139 CB 0.0005 0.0070 0.0036 769 PHE 139 CG 0.0006 0.0062 0.0036 770 PHE 139 CD1 0.0007 0.0058 0.0039 771 PHE 139 CE1 0.0008 0.0050 0.0039 772 PHE 139 CZ 0.0009 0.0046 0.0037 773 PHE 139 CE2 0.0009 0.0049 0.0035 774 PHE 139 CD2 0.0007 0.0057 0.0035 775 PHE 139 C 0.0004 0.0070 0.0021 776 PHE 139 O 0.0005 0.0065 0.0018 777 HIS 140 N 0.0004 0.0072 0.0019 778 HIS 140 H 0.0003 0.0076 0.0022 779 HIS 140 CA 0.0004 0.0069 0.0013 780 HIS 140 CB 0.0004 0.0071 0.0013 781 HIS 140 CG 0.0005 0.0067 0.0007 782 HIS 140 ND1 0.0006 0.0059 0.0008 783 HIS 140 CE1 0.0006 0.0057 0.0002 784 HIS 140 NE2 0.0005 0.0063 -0.0003 785 HIS 140 CD2 0.0004 0.0069 0.0001 786 HIS 140 C 0.0004 0.0071 0.0005 787 HIS 140 O 0.0005 0.0066 0.0001 788 LEU 141 N -0.0009 0.0091 0.0013 789 LEU 141 H -0.0009 0.0095 0.0017 790 LEU 141 CA -0.0011 0.0092 0.0004 791 LEU 141 CB -0.0014 0.0101 0.0004 792 LEU 141 CG -0.0017 0.0108 0.0005 793 LEU 141 CD1 -0.0019 0.0117 0.0006 794 LEU 141 CD2 -0.0018 0.0108 -0.0003 795 LEU 141 C -0.0010 0.0086 0.0002 796 LEU 141 O -0.0011 0.0083 -0.0006 797 SER 142 N -0.0008 0.0084 0.0008 798 SER 142 H -0.0007 0.0086 0.0014 799 SER 142 CA -0.0006 0.0078 0.0006 800 SER 142 CB -0.0005 0.0078 0.0013 801 SER 142 OG -0.0002 0.0077 0.0021 802 SER 142 HG -0.0004 0.0082 0.0023 803 SER 142 C -0.0004 0.0069 0.0004 804 SER 142 O -0.0003 0.0064 0.0001 805 ILE 143 N -0.0015 0.0059 0.0014 806 ILE 143 H -0.0016 0.0061 0.0016 807 ILE 143 CA -0.0013 0.0056 0.0014 808 ILE 143 CB -0.0012 0.0057 0.0017 809 ILE 143 CG2 -0.0010 0.0054 0.0016 810 ILE 143 CG1 -0.0010 0.0057 0.0020 811 ILE 143 CD1 -0.0009 0.0059 0.0023 812 ILE 143 C -0.0015 0.0056 0.0010 813 ILE 143 O -0.0017 0.0058 0.0010 814 PRO 144 N -0.0014 0.0053 0.0008 815 PRO 144 CA -0.0016 0.0052 0.0004 816 PRO 144 CB -0.0014 0.0050 0.0002 817 PRO 144 CG -0.0011 0.0048 0.0004 818 PRO 144 CD -0.0012 0.0051 0.0008 819 PRO 144 C -0.0015 0.0052 0.0004 820 PRO 144 O -0.0013 0.0051 0.0006 821 ASN 145 N -0.0019 0.0066 0.0038 822 ASN 145 H -0.0021 0.0066 0.0037 823 ASN 145 CA -0.0014 0.0065 0.0043 824 ASN 145 CB -0.0008 0.0068 0.0042 825 ASN 145 CG -0.0006 0.0074 0.0038 826 ASN 145 OD1 -0.0004 0.0075 0.0039 827 ASN 145 ND2 -0.0006 0.0077 0.0035 828 ASN 145 1HD2 -0.0005 0.0081 0.0032 829 ASN 145 2HD2 -0.0008 0.0076 0.0034 830 ASN 145 C -0.0016 0.0059 0.0047 831 ASN 145 O -0.0021 0.0057 0.0046 832 PHE 146 N -0.0011 0.0057 0.0052 833 PHE 146 H -0.0007 0.0059 0.0052 834 PHE 146 CA -0.0012 0.0052 0.0056 835 PHE 146 CB -0.0008 0.0050 0.0061 836 PHE 146 CG -0.0009 0.0044 0.0066 837 PHE 146 CD1 -0.0014 0.0041 0.0066 838 PHE 146 CE1 -0.0016 0.0036 0.0071 839 PHE 146 CZ -0.0012 0.0034 0.0075 840 PHE 146 CE2 -0.0007 0.0037 0.0074 841 PHE 146 CD2 -0.0005 0.0043 0.0070 842 PHE 146 C -0.0012 0.0052 0.0057 843 PHE 146 O -0.0007 0.0054 0.0057 844 ASN 147 N -0.0023 0.0050 0.0042 845 ASN 147 H -0.0017 0.0049 0.0042 846 ASN 147 CA -0.0031 0.0049 0.0036 847 ASN 147 CB -0.0029 0.0047 0.0032 848 ASN 147 CG -0.0029 0.0050 0.0039 849 ASN 147 OD1 -0.0036 0.0053 0.0043 850 ASN 147 ND2 -0.0022 0.0049 0.0041 851 ASN 147 1HD2 -0.0021 0.0051 0.0045 852 ASN 147 2HD2 -0.0016 0.0046 0.0037 853 ASN 147 C -0.0032 0.0046 0.0029 854 ASN 147 O -0.0025 0.0043 0.0026 855 GLN 148 N -0.0041 0.0047 0.0026 856 GLN 148 H -0.0046 0.0049 0.0029 857 GLN 148 CA -0.0044 0.0044 0.0019 858 GLN 148 CB -0.0054 0.0047 0.0020 859 GLN 148 CG -0.0058 0.0045 0.0013 860 GLN 148 CD -0.0068 0.0047 0.0015 861 GLN 148 OE1 -0.0072 0.0051 0.0021 862 GLN 148 NE2 -0.0072 0.0046 0.0009 863 GLN 148 1HE2 -0.0079 0.0047 0.0010 864 GLN 148 2HE2 -0.0069 0.0043 0.0004 865 GLN 148 C -0.0042 0.0040 0.0011 866 GLN 148 O -0.0045 0.0040 0.0009 867 TYR 149 N -0.0066 0.0015 0.0027 868 TYR 149 H -0.0064 0.0016 0.0038 869 TYR 149 CA -0.0060 0.0005 0.0007 870 TYR 149 CB -0.0050 -0.0004 0.0007 871 TYR 149 CG -0.0034 -0.0018 0.0017 872 TYR 149 CD1 -0.0027 -0.0019 0.0038 873 TYR 149 CE1 -0.0012 -0.0032 0.0047 874 TYR 149 CZ -0.0002 -0.0044 0.0035 875 TYR 149 OH 0.0013 -0.0057 0.0043 876 TYR 149 HH 0.0015 -0.0055 0.0058 877 TYR 149 CE2 -0.0009 -0.0043 0.0014 878 TYR 149 CD2 -0.0024 -0.0030 0.0005 879 TYR 149 C -0.0074 0.0013 -0.0011 880 TYR 149 O -0.0072 0.0007 -0.0030 881 GLU 150 N -0.0088 0.0028 -0.0007 882 GLU 150 H -0.0089 0.0033 0.0008 883 GLU 150 CA -0.0102 0.0038 -0.0023 884 GLU 150 CB -0.0115 0.0052 -0.0014 885 GLU 150 CG -0.0111 0.0050 -0.0009 886 GLU 150 CD -0.0125 0.0066 -0.0002 887 GLU 150 OE1 -0.0130 0.0074 0.0014 888 GLU 150 OE2 -0.0132 0.0069 -0.0014 889 GLU 150 C -0.0109 0.0042 -0.0030 890 GLU 150 O -0.0116 0.0045 -0.0048 891 ALA 151 N -0.0087 0.0010 -0.0045 892 ALA 151 H -0.0085 0.0009 -0.0040 893 ALA 151 CA -0.0088 0.0009 -0.0041 894 ALA 151 CB -0.0089 0.0009 -0.0029 895 ALA 151 C -0.0080 0.0008 -0.0045 896 ALA 151 O -0.0082 0.0009 -0.0047 897 MET 152 N -0.0070 0.0006 -0.0045 898 MET 152 H -0.0069 0.0005 -0.0042 899 MET 152 CA -0.0061 0.0004 -0.0048 900 MET 152 CB -0.0051 0.0001 -0.0043 901 MET 152 CG -0.0041 -0.0001 -0.0046 902 MET 152 SD -0.0030 -0.0004 -0.0039 903 MET 152 CE -0.0021 -0.0005 -0.0047 904 MET 152 C -0.0059 0.0004 -0.0060 905 MET 152 O -0.0060 0.0005 -0.0064 906 SER 153 N -0.0063 0.0002 -0.0060 907 SER 153 H -0.0063 0.0001 -0.0055 908 SER 153 CA -0.0059 0.0004 -0.0077 909 SER 153 CB -0.0074 0.0011 -0.0087 910 SER 153 OG -0.0078 0.0011 -0.0084 911 SER 153 HG -0.0088 0.0015 -0.0089 912 SER 153 C -0.0045 0.0001 -0.0082 913 SER 153 O -0.0044 -0.0001 -0.0074 914 CYS 154 N -0.0034 0.0000 -0.0093 915 CYS 154 H -0.0035 0.0001 -0.0100 916 CYS 154 CA -0.0021 -0.0003 -0.0098 917 CYS 154 CB -0.0006 -0.0009 -0.0088 918 CYS 154 SG 0.0003 -0.0012 -0.0090 919 CYS 154 C -0.0015 -0.0002 -0.0116 920 CYS 154 O -0.0015 -0.0000 -0.0124 921 ASP 155 N 0.0008 0.0032 -0.0052 922 ASP 155 H 0.0015 0.0029 -0.0075 923 ASP 155 CA 0.0009 0.0033 -0.0053 924 ASP 155 CB 0.0031 0.0055 -0.0073 925 ASP 155 CG 0.0045 0.0089 -0.0057 926 ASP 155 OD1 0.0038 0.0096 -0.0027 927 ASP 155 OD2 0.0065 0.0107 -0.0075 928 ASP 155 C -0.0004 0.0002 -0.0068 929 ASP 155 O -0.0004 -0.0013 -0.0093 930 PHE 156 N -0.0018 -0.0009 -0.0053 931 PHE 156 H -0.0018 0.0004 -0.0033 932 PHE 156 CA -0.0033 -0.0039 -0.0062 933 PHE 156 CB -0.0055 -0.0057 -0.0037 934 PHE 156 CG -0.0060 -0.0042 -0.0002 935 PHE 156 CD1 -0.0071 -0.0048 0.0015 936 PHE 156 CE1 -0.0076 -0.0034 0.0047 937 PHE 156 CZ -0.0070 -0.0013 0.0064 938 PHE 156 CE2 -0.0060 -0.0007 0.0049 939 PHE 156 CD2 -0.0055 -0.0021 0.0016 940 PHE 156 C -0.0033 -0.0041 -0.0064 941 PHE 156 O -0.0047 -0.0067 -0.0070 942 ASN 157 N -0.0018 -0.0006 0.0031 943 ASN 157 H 0.0014 0.0008 0.0033 944 ASN 157 CA -0.0019 0.0012 0.0063 945 ASN 157 CB 0.0030 0.0051 0.0094 946 ASN 157 CG 0.0024 0.0070 0.0131 947 ASN 157 OD1 -0.0018 0.0075 0.0168 948 ASN 157 ND2 0.0066 0.0081 0.0121 949 ASN 157 1HD2 0.0065 0.0094 0.0144 950 ASN 157 2HD2 0.0099 0.0077 0.0091 951 ASN 157 C -0.0021 -0.0007 0.0032 952 ASN 157 O 0.0016 -0.0014 -0.0006 953 GLY 158 N -0.0067 -0.0014 0.0051 954 GLY 158 H -0.0095 -0.0008 0.0082 955 GLY 158 CA -0.0078 -0.0031 0.0030 956 GLY 158 C -0.0088 -0.0069 -0.0026 957 GLY 158 O -0.0080 -0.0082 -0.0054 958 GLY 159 N -0.0055 -0.0045 -0.0026 959 GLY 159 H -0.0043 -0.0043 -0.0013 960 GLY 159 CA -0.0062 -0.0039 -0.0050 961 GLY 159 C -0.0048 -0.0024 -0.0070 962 GLY 159 O -0.0054 -0.0018 -0.0092 963 LYS 160 N -0.0030 -0.0016 -0.0063 964 LYS 160 H -0.0025 -0.0020 -0.0046 965 LYS 160 CA -0.0016 -0.0001 -0.0083 966 LYS 160 CB -0.0003 0.0006 -0.0080 967 LYS 160 CG 0.0009 0.0021 -0.0103 968 LYS 160 CD 0.0022 0.0030 -0.0105 969 LYS 160 CE 0.0033 0.0045 -0.0130 970 LYS 160 NZ 0.0046 0.0053 -0.0132 971 LYS 160 HZ1 0.0033 0.0047 -0.0133 972 LYS 160 HZ2 0.0059 0.0055 -0.0117 973 LYS 160 HZ3 0.0053 0.0064 -0.0149 974 LYS 160 C 0.0003 0.0009 -0.0082 975 LYS 160 O 0.0019 0.0012 -0.0064 976 ILE 161 N -0.0012 0.0022 -0.0080 977 ILE 161 H -0.0012 0.0019 -0.0085 978 ILE 161 CA -0.0014 0.0020 -0.0082 979 ILE 161 CB -0.0020 0.0012 -0.0089 980 ILE 161 CG2 -0.0022 0.0010 -0.0090 981 ILE 161 CG1 -0.0030 0.0010 -0.0086 982 ILE 161 CD1 -0.0035 0.0002 -0.0093 983 ILE 161 C -0.0004 0.0022 -0.0085 984 ILE 161 O 0.0003 0.0020 -0.0092 985 SER 162 N -0.0003 0.0026 -0.0081 986 SER 162 H -0.0008 0.0028 -0.0075 987 SER 162 CA 0.0006 0.0028 -0.0083 988 SER 162 CB 0.0014 0.0036 -0.0077 989 SER 162 OG 0.0018 0.0036 -0.0079 990 SER 162 HG 0.0023 0.0041 -0.0075 991 SER 162 C 0.0002 0.0027 -0.0082 992 SER 162 O -0.0002 0.0031 -0.0074 993 VAL 163 N -0.0007 0.0013 -0.0080 994 VAL 163 H -0.0006 0.0012 -0.0068 995 VAL 163 CA -0.0014 0.0011 -0.0076 996 VAL 163 CB -0.0001 0.0013 -0.0061 997 VAL 163 CG1 -0.0010 0.0011 -0.0058 998 VAL 163 CG2 0.0021 0.0018 -0.0069 999 VAL 163 C -0.0035 0.0007 -0.0067 1000 VAL 163 O -0.0038 0.0005 -0.0051 1001 GLN 164 N -0.0050 0.0005 -0.0078 1002 GLN 164 H -0.0047 0.0006 -0.0091 1003 GLN 164 CA -0.0071 0.0000 -0.0072 1004 GLN 164 CB -0.0084 -0.0001 -0.0090 1005 GLN 164 CG -0.0107 -0.0006 -0.0086 1006 GLN 164 CD -0.0118 -0.0006 -0.0107 1007 GLN 164 OE1 -0.0119 -0.0006 -0.0118 1008 GLN 164 NE2 -0.0126 -0.0008 -0.0111 1009 GLN 164 1HE2 -0.0134 -0.0008 -0.0124 1010 GLN 164 2HE2 -0.0126 -0.0008 -0.0101 1011 GLN 164 C -0.0077 -0.0001 -0.0065 1012 GLN 164 O -0.0072 0.0000 -0.0074 1013 TYR 165 N -0.0070 -0.0007 -0.0035 1014 TYR 165 H -0.0072 -0.0008 -0.0026 1015 TYR 165 CA -0.0074 -0.0009 -0.0033 1016 TYR 165 CB -0.0070 -0.0007 -0.0017 1017 TYR 165 CG -0.0054 0.0002 -0.0016 1018 TYR 165 CD1 -0.0045 0.0006 -0.0008 1019 TYR 165 CE1 -0.0031 0.0014 -0.0007 1020 TYR 165 CZ -0.0025 0.0017 -0.0013 1021 TYR 165 OH -0.0010 0.0025 -0.0012 1022 TYR 165 HH -0.0007 0.0026 -0.0016 1023 TYR 165 CE2 -0.0033 0.0013 -0.0020 1024 TYR 165 CD2 -0.0048 0.0005 -0.0022 1025 TYR 165 C -0.0090 -0.0018 -0.0032 1026 TYR 165 O -0.0097 -0.0021 -0.0022 1027 ASN 166 N -0.0097 -0.0022 -0.0044 1028 ASN 166 H -0.0091 -0.0019 -0.0052 1029 ASN 166 CA -0.0112 -0.0030 -0.0046 1030 ASN 166 CB -0.0117 -0.0033 -0.0063 1031 ASN 166 CG -0.0133 -0.0041 -0.0065 1032 ASN 166 OD1 -0.0141 -0.0045 -0.0057 1033 ASN 166 ND2 -0.0138 -0.0044 -0.0076 1034 ASN 166 1HD2 -0.0148 -0.0050 -0.0078 1035 ASN 166 2HD2 -0.0131 -0.0041 -0.0083 1036 ASN 166 C -0.0116 -0.0032 -0.0034 1037 ASN 166 O -0.0110 -0.0029 -0.0034 1038 LEU 167 N -0.0117 -0.0093 -0.0025 1039 LEU 167 H -0.0135 -0.0099 -0.0032 1040 LEU 167 CA -0.0121 -0.0077 -0.0000 1041 LEU 167 CB -0.0137 -0.0065 0.0019 1042 LEU 167 CG -0.0120 -0.0061 0.0023 1043 LEU 167 CD1 -0.0139 -0.0050 0.0041 1044 LEU 167 CD2 -0.0087 -0.0053 0.0031 1045 LEU 167 C -0.0139 -0.0077 0.0000 1046 LEU 167 O -0.0139 -0.0064 0.0019 1047 SER 168 N -0.0155 -0.0092 -0.0020 1048 SER 168 H -0.0154 -0.0103 -0.0036 1049 SER 168 CA -0.0172 -0.0093 -0.0021 1050 SER 168 CB -0.0197 -0.0108 -0.0040 1051 SER 168 OG -0.0218 -0.0106 -0.0035 1052 SER 168 HG -0.0232 -0.0116 -0.0049 1053 SER 168 C -0.0152 -0.0096 -0.0026 1054 SER 168 O -0.0140 -0.0109 -0.0046 1055 HIS 169 N -0.0063 -0.0074 0.0058 1056 HIS 169 H -0.0071 -0.0048 0.0041 1057 HIS 169 CA -0.0020 -0.0075 0.0054 1058 HIS 169 CB -0.0032 -0.0059 0.0044 1059 HIS 169 CG 0.0011 -0.0063 0.0042 1060 HIS 169 ND1 0.0047 -0.0034 0.0018 1061 HIS 169 CE1 0.0079 -0.0048 0.0024 1062 HIS 169 NE2 0.0066 -0.0084 0.0051 1063 HIS 169 CD2 0.0024 -0.0093 0.0062 1064 HIS 169 C 0.0017 -0.0048 0.0031 1065 HIS 169 O 0.0012 -0.0011 0.0005 1066 ALA 170 N 0.0052 -0.0068 0.0041 1067 ALA 170 H 0.0053 -0.0099 0.0063 1068 ALA 170 CA 0.0089 -0.0046 0.0022 1069 ALA 170 CB 0.0082 -0.0047 0.0023 1070 ALA 170 C 0.0142 -0.0064 0.0028 1071 ALA 170 O 0.0178 -0.0046 0.0012 1072 TYR 171 N 0.0223 -0.0154 0.0092 1073 TYR 171 H 0.0180 -0.0150 0.0123 1074 TYR 171 CA 0.0278 -0.0182 0.0092 1075 TYR 171 CB 0.0258 -0.0205 0.0146 1076 TYR 171 CG 0.0250 -0.0240 0.0212 1077 TYR 171 CD1 0.0186 -0.0230 0.0250 1078 TYR 171 CE1 0.0177 -0.0262 0.0311 1079 TYR 171 CZ 0.0233 -0.0305 0.0335 1080 TYR 171 OH 0.0224 -0.0337 0.0397 1081 TYR 171 HH 0.0176 -0.0324 0.0415 1082 TYR 171 CE2 0.0297 -0.0316 0.0297 1083 TYR 171 CD2 0.0306 -0.0283 0.0236 1084 TYR 171 C 0.0302 -0.0158 0.0030 1085 TYR 171 O 0.0363 -0.0175 0.0006 1086 ALA 172 N 0.0256 -0.0118 0.0003 1087 ALA 172 H 0.0207 -0.0104 0.0023 1088 ALA 172 CA 0.0274 -0.0092 -0.0055 1089 ALA 172 CB 0.0218 -0.0058 -0.0063 1090 ALA 172 C 0.0294 -0.0066 -0.0116 1091 ALA 172 O 0.0347 -0.0070 -0.0156 1092 VAL 173 N 0.0194 -0.0016 0.0055 1093 VAL 173 H 0.0179 -0.0027 0.0049 1094 VAL 173 CA 0.0190 0.0020 0.0062 1095 VAL 173 CB 0.0205 0.0036 0.0069 1096 VAL 173 CG1 0.0184 0.0029 0.0063 1097 VAL 173 CG2 0.0211 0.0073 0.0078 1098 VAL 173 C 0.0153 0.0028 0.0057 1099 VAL 173 O 0.0132 0.0008 0.0048 1100 ASP 174 N 0.0144 0.0059 0.0062 1101 ASP 174 H 0.0162 0.0075 0.0069 1102 ASP 174 CA 0.0110 0.0070 0.0058 1103 ASP 174 CB 0.0107 0.0103 0.0065 1104 ASP 174 CG 0.0071 0.0114 0.0061 1105 ASP 174 OD1 0.0067 0.0140 0.0066 1106 ASP 174 OD2 0.0046 0.0098 0.0052 1107 ASP 174 C 0.0096 0.0075 0.0056 1108 ASP 174 O 0.0108 0.0094 0.0063 1109 ALA 175 N 0.0056 0.0071 0.0052 1110 ALA 175 H 0.0054 0.0068 0.0050 1111 ALA 175 CA 0.0047 0.0066 0.0046 1112 ALA 175 CB 0.0038 0.0056 0.0039 1113 ALA 175 C 0.0041 0.0078 0.0042 1114 ALA 175 O 0.0039 0.0077 0.0040 1115 ALA 176 N 0.0039 0.0090 0.0041 1116 ALA 176 H 0.0041 0.0091 0.0042 1117 ALA 176 CA 0.0033 0.0103 0.0037 1118 ALA 176 CB 0.0029 0.0113 0.0034 1119 ALA 176 C 0.0041 0.0111 0.0043 1120 ALA 176 O 0.0037 0.0115 0.0040 1121 GLU 177 N 0.0045 0.0103 0.0055 1122 GLU 177 H 0.0047 0.0097 0.0054 1123 GLU 177 CA 0.0055 0.0113 0.0060 1124 GLU 177 CB 0.0064 0.0116 0.0063 1125 GLU 177 CG 0.0056 0.0121 0.0063 1126 GLU 177 CD 0.0049 0.0135 0.0065 1127 GLU 177 OE1 0.0056 0.0145 0.0069 1128 GLU 177 OE2 0.0036 0.0137 0.0063 1129 GLU 177 C 0.0064 0.0111 0.0061 1130 GLU 177 O 0.0066 0.0121 0.0065 1131 HIS 178 N 0.0070 0.0098 0.0059 1132 HIS 178 H 0.0068 0.0091 0.0056 1133 HIS 178 CA 0.0079 0.0095 0.0060 1134 HIS 178 CB 0.0088 0.0082 0.0058 1135 HIS 178 CG 0.0101 0.0079 0.0059 1136 HIS 178 ND1 0.0101 0.0072 0.0058 1137 HIS 178 CE1 0.0115 0.0071 0.0060 1138 HIS 178 NE2 0.0123 0.0076 0.0063 1139 HIS 178 CD2 0.0114 0.0081 0.0063 1140 HIS 178 C 0.0072 0.0095 0.0058 1141 HIS 178 O 0.0061 0.0090 0.0054 1142 CYS 179 N 0.0026 0.0061 0.0047 1143 CYS 179 H 0.0027 0.0062 0.0047 1144 CYS 179 CA 0.0022 0.0061 0.0045 1145 CYS 179 CB 0.0021 0.0063 0.0042 1146 CYS 179 SG 0.0023 0.0066 0.0040 1147 CYS 179 C 0.0020 0.0058 0.0047 1148 CYS 179 O 0.0016 0.0057 0.0046 1149 GLY 180 N 0.0022 0.0057 0.0050 1150 GLY 180 H 0.0025 0.0058 0.0050 1151 GLY 180 CA 0.0020 0.0054 0.0052 1152 GLY 180 C 0.0020 0.0052 0.0054 1153 GLY 180 O 0.0019 0.0050 0.0056 1154 THR 181 N 0.0011 0.0048 0.0047 1155 THR 181 H 0.0009 0.0053 0.0044 1156 THR 181 CA 0.0009 0.0040 0.0049 1157 THR 181 CB 0.0007 0.0041 0.0048 1158 THR 181 CG2 0.0014 0.0046 0.0049 1159 THR 181 OG1 -0.0001 0.0045 0.0043 1160 THR 181 HG1 -0.0002 0.0044 0.0043 1161 THR 181 C 0.0002 0.0034 0.0048 1162 THR 181 O -0.0004 0.0038 0.0045 1163 VAL 182 N 0.0001 0.0026 0.0051 1164 VAL 182 H 0.0006 0.0023 0.0053 1165 VAL 182 CA -0.0005 0.0019 0.0050 1166 VAL 182 CB -0.0004 0.0010 0.0054 1167 VAL 182 CG1 -0.0011 0.0003 0.0054 1168 VAL 182 CG2 0.0005 0.0008 0.0058 1169 VAL 182 C -0.0014 0.0021 0.0047 1170 VAL 182 O -0.0020 0.0021 0.0044 1171 ALA 183 N -0.0009 0.0018 0.0050 1172 ALA 183 H -0.0005 0.0018 0.0052 1173 ALA 183 CA -0.0017 0.0020 0.0047 1174 ALA 183 CB -0.0016 0.0023 0.0046 1175 ALA 183 C -0.0020 0.0027 0.0044 1176 ALA 183 O -0.0026 0.0026 0.0041 1177 ASN 184 N -0.0014 0.0033 0.0044 1178 ASN 184 H -0.0009 0.0033 0.0046 1179 ASN 184 CA -0.0016 0.0040 0.0041 1180 ASN 184 CB -0.0010 0.0047 0.0042 1181 ASN 184 CG -0.0010 0.0051 0.0041 1182 ASN 184 OD1 -0.0015 0.0051 0.0039 1183 ASN 184 ND2 -0.0003 0.0055 0.0043 1184 ASN 184 1HD2 -0.0002 0.0058 0.0043 1185 ASN 184 2HD2 0.0002 0.0055 0.0045 1186 ASN 184 C -0.0018 0.0038 0.0041 1187 ASN 184 O -0.0024 0.0041 0.0038 1188 GLY 185 N -0.0009 0.0036 0.0035 1189 GLY 185 H -0.0008 0.0035 0.0035 1190 GLY 185 CA -0.0008 0.0036 0.0035 1191 GLY 185 C -0.0010 0.0035 0.0034 1192 GLY 185 O -0.0011 0.0035 0.0035 1193 VAL 186 N -0.0012 0.0032 0.0034 1194 VAL 186 H -0.0011 0.0032 0.0034 1195 VAL 186 CA -0.0014 0.0031 0.0033 1196 VAL 186 CB -0.0014 0.0029 0.0033 1197 VAL 186 CG1 -0.0016 0.0027 0.0032 1198 VAL 186 CG2 -0.0012 0.0027 0.0033 1199 VAL 186 C -0.0016 0.0033 0.0033 1200 VAL 186 O -0.0017 0.0033 0.0033 1201 LEU 187 N -0.0003 0.0017 0.0028 1202 LEU 187 H -0.0004 0.0016 0.0026 1203 LEU 187 CA -0.0005 0.0018 0.0032 1204 LEU 187 CB -0.0009 0.0015 0.0033 1205 LEU 187 CG -0.0011 0.0012 0.0031 1206 LEU 187 CD1 -0.0014 0.0009 0.0031 1207 LEU 187 CD2 -0.0012 0.0012 0.0032 1208 LEU 187 C -0.0003 0.0020 0.0035 1209 LEU 187 O -0.0004 0.0022 0.0038 1210 GLN 188 N -0.0002 0.0022 0.0034 1211 GLN 188 H -0.0002 0.0020 0.0031 1212 GLN 188 CA 0.0000 0.0024 0.0036 1213 GLN 188 CB 0.0002 0.0025 0.0034 1214 GLN 188 CG -0.0000 0.0023 0.0034 1215 GLN 188 CD 0.0002 0.0024 0.0032 1216 GLN 188 OE1 0.0005 0.0026 0.0030 1217 GLN 188 NE2 0.0000 0.0023 0.0032 1218 GLN 188 1HE2 0.0001 0.0023 0.0030 1219 GLN 188 2HE2 -0.0002 0.0021 0.0034 1220 GLN 188 C 0.0003 0.0027 0.0037 1221 GLN 188 O 0.0003 0.0029 0.0040 1222 THR 189 N 0.0013 0.0017 0.0029 1223 THR 189 H 0.0010 0.0019 0.0027 1224 THR 189 CA 0.0016 0.0023 0.0030 1225 THR 189 CB 0.0012 0.0031 0.0028 1226 THR 189 CG2 0.0014 0.0038 0.0029 1227 THR 189 OG1 0.0004 0.0030 0.0024 1228 THR 189 HG1 0.0003 0.0028 0.0023 1229 THR 189 C 0.0024 0.0024 0.0035 1230 THR 189 O 0.0028 0.0024 0.0037 1231 PHE 190 N 0.0027 0.0024 0.0037 1232 PHE 190 H 0.0024 0.0024 0.0035 1233 PHE 190 CA 0.0035 0.0025 0.0041 1234 PHE 190 CB 0.0038 0.0029 0.0042 1235 PHE 190 CG 0.0046 0.0032 0.0047 1236 PHE 190 CD1 0.0047 0.0038 0.0047 1237 PHE 190 CE1 0.0055 0.0041 0.0051 1238 PHE 190 CZ 0.0061 0.0037 0.0054 1239 PHE 190 CE2 0.0059 0.0030 0.0054 1240 PHE 190 CD2 0.0052 0.0028 0.0050 1241 PHE 190 C 0.0039 0.0017 0.0043 1242 PHE 190 O 0.0045 0.0018 0.0047 1243 MET 191 N 0.0050 0.0018 0.0042 1244 MET 191 H 0.0045 0.0016 0.0037 1245 MET 191 CA 0.0055 0.0006 0.0042 1246 MET 191 CB 0.0050 -0.0007 0.0034 1247 MET 191 CG 0.0054 -0.0021 0.0033 1248 MET 191 SD 0.0045 -0.0023 0.0024 1249 MET 191 CE 0.0032 -0.0024 0.0013 1250 MET 191 C 0.0051 0.0009 0.0041 1251 MET 191 O 0.0058 0.0005 0.0045 1252 ARG 192 N 0.0041 0.0017 0.0035 1253 ARG 192 H 0.0035 0.0020 0.0031 1254 ARG 192 CA 0.0037 0.0021 0.0033 1255 ARG 192 CB 0.0025 0.0030 0.0025 1256 ARG 192 CG 0.0016 0.0022 0.0015 1257 ARG 192 CD 0.0004 0.0031 0.0007 1258 ARG 192 NE -0.0003 0.0021 -0.0002 1259 ARG 192 HE 0.0000 0.0011 -0.0003 1260 ARG 192 CZ -0.0013 0.0026 -0.0009 1261 ARG 192 NH1 -0.0017 0.0040 -0.0008 1262 ARG 192 1HH1 -0.0012 0.0047 -0.0001 1263 ARG 192 2HH1 -0.0024 0.0044 -0.0013 1264 ARG 192 NH2 -0.0019 0.0017 -0.0017 1265 ARG 192 1HH2 -0.0016 0.0006 -0.0018 1266 ARG 192 2HH2 -0.0026 0.0020 -0.0022 1267 ARG 192 C 0.0045 0.0030 0.0042 1268 ARG 192 O 0.0046 0.0029 0.0043 1269 MET 193 N 0.0054 0.0026 0.0034 1270 MET 193 H 0.0053 0.0025 0.0033 1271 MET 193 CA 0.0061 0.0034 0.0044 1272 MET 193 CB 0.0062 0.0046 0.0048 1273 MET 193 CG 0.0053 0.0057 0.0042 1274 MET 193 SD 0.0055 0.0071 0.0048 1275 MET 193 CE 0.0061 0.0077 0.0055 1276 MET 193 C 0.0072 0.0027 0.0052 1277 MET 193 O 0.0078 0.0029 0.0058 1278 ALA 194 N 0.0076 0.0019 0.0053 1279 ALA 194 H 0.0071 0.0017 0.0048 1280 ALA 194 CA 0.0086 0.0013 0.0061 1281 ALA 194 CB 0.0089 0.0013 0.0064 1282 ALA 194 C 0.0088 -0.0001 0.0059 1283 ALA 194 O 0.0097 -0.0008 0.0066 1284 TRP 195 N 0.0087 -0.0018 0.0052 1285 TRP 195 H 0.0078 -0.0012 0.0046 1286 TRP 195 CA 0.0091 -0.0032 0.0041 1287 TRP 195 CB 0.0090 -0.0032 0.0040 1288 TRP 195 CG 0.0099 -0.0031 0.0055 1289 TRP 195 CD1 0.0097 -0.0018 0.0067 1290 TRP 195 NE1 0.0108 -0.0022 0.0079 1291 TRP 195 HE1 0.0109 -0.0015 0.0089 1292 TRP 195 CE2 0.0116 -0.0038 0.0073 1293 TRP 195 CZ2 0.0128 -0.0048 0.0080 1294 TRP 195 CH2 0.0135 -0.0064 0.0072 1295 TRP 195 CZ3 0.0130 -0.0070 0.0057 1296 TRP 195 CE3 0.0118 -0.0060 0.0050 1297 TRP 195 CD2 0.0111 -0.0044 0.0059 1298 TRP 195 C 0.0101 -0.0047 0.0040 1299 TRP 195 O 0.0107 -0.0047 0.0048 1300 GLY 196 N 0.0105 -0.0060 0.0030 1301 GLY 196 H 0.0101 -0.0060 0.0024 1302 GLY 196 CA 0.0115 -0.0076 0.0027 1303 GLY 196 C 0.0129 -0.0083 0.0040 1304 GLY 196 O 0.0137 -0.0097 0.0035 1305 GLY 197 N 0.0103 -0.0062 0.0059 1306 GLY 197 H 0.0103 -0.0058 0.0059 1307 GLY 197 CA 0.0106 -0.0065 0.0064 1308 GLY 197 C 0.0105 -0.0067 0.0063 1309 GLY 197 O 0.0106 -0.0073 0.0065 1310 SER 198 N 0.0104 -0.0064 0.0061 1311 SER 198 H 0.0103 -0.0060 0.0060 1312 SER 198 CA 0.0103 -0.0066 0.0060 1313 SER 198 CB 0.0104 -0.0061 0.0062 1314 SER 198 OG 0.0103 -0.0055 0.0059 1315 SER 198 HG 0.0104 -0.0053 0.0061 1316 SER 198 C 0.0099 -0.0067 0.0054 1317 SER 198 O 0.0098 -0.0069 0.0053 1318 TYR 199 N 0.0105 -0.0059 0.0036 1319 TYR 199 H 0.0100 -0.0061 0.0032 1320 TYR 199 CA 0.0095 -0.0059 0.0033 1321 TYR 199 CB 0.0078 -0.0053 0.0037 1322 TYR 199 CG 0.0079 -0.0042 0.0051 1323 TYR 199 CD1 0.0076 -0.0038 0.0055 1324 TYR 199 CE1 0.0077 -0.0027 0.0068 1325 TYR 199 CZ 0.0079 -0.0021 0.0077 1326 TYR 199 OH 0.0080 -0.0010 0.0089 1327 TYR 199 HH 0.0080 -0.0009 0.0091 1328 TYR 199 CE2 0.0082 -0.0024 0.0073 1329 TYR 199 CD2 0.0081 -0.0035 0.0060 1330 TYR 199 C 0.0094 -0.0070 0.0020 1331 TYR 199 O 0.0082 -0.0072 0.0015 1332 ILE 200 N 0.0107 -0.0077 0.0013 1333 ILE 200 H 0.0117 -0.0076 0.0018 1334 ILE 200 CA 0.0107 -0.0088 0.0000 1335 ILE 200 CB 0.0123 -0.0095 -0.0005 1336 ILE 200 CG2 0.0122 -0.0106 -0.0019 1337 ILE 200 CG1 0.0127 -0.0096 -0.0004 1338 ILE 200 CD1 0.0144 -0.0101 -0.0007 1339 ILE 200 C 0.0105 -0.0089 -0.0001 1340 ILE 200 O 0.0114 -0.0085 0.0006 1341 ALA 201 N 0.0142 -0.0064 0.0033 1342 ALA 201 H 0.0150 -0.0071 0.0038 1343 ALA 201 CA 0.0130 -0.0061 0.0038 1344 ALA 201 CB 0.0133 -0.0062 0.0037 1345 ALA 201 C 0.0123 -0.0066 0.0053 1346 ALA 201 O 0.0111 -0.0063 0.0057 1347 LEU 202 N 0.0131 -0.0074 0.0060 1348 LEU 202 H 0.0141 -0.0076 0.0056 1349 LEU 202 CA 0.0126 -0.0079 0.0075 1350 LEU 202 CB 0.0136 -0.0089 0.0084 1351 LEU 202 CG 0.0137 -0.0089 0.0084 1352 LEU 202 CD1 0.0147 -0.0099 0.0094 1353 LEU 202 CD2 0.0122 -0.0084 0.0088 1354 LEU 202 C 0.0120 -0.0078 0.0079 1355 LEU 202 O 0.0120 -0.0085 0.0090 1356 ASP 203 N 0.0191 -0.0058 0.0092 1357 ASP 203 H 0.0191 -0.0098 -0.0001 1358 ASP 203 CA 0.0060 -0.0021 0.0144 1359 ASP 203 CB -0.0058 -0.0051 0.0045 1360 ASP 203 CG -0.0055 -0.0075 -0.0010 1361 ASP 203 OD1 0.0017 -0.0061 0.0042 1362 ASP 203 OD2 -0.0129 -0.0110 -0.0108 1363 ASP 203 C 0.0023 0.0014 0.0214 1364 ASP 203 O 0.0050 -0.0007 0.0172 1365 SER 204 N -0.0038 0.0069 0.0324 1366 SER 204 H -0.0058 0.0085 0.0356 1367 SER 204 CA -0.0077 0.0108 0.0404 1368 SER 204 CB -0.0129 0.0169 0.0530 1369 SER 204 OG -0.0168 0.0208 0.0609 1370 SER 204 HG -0.0201 0.0244 0.0683 1371 SER 204 C -0.0181 0.0091 0.0340 1372 SER 204 O -0.0285 0.0079 0.0287 1373 GLY 205 N -0.0072 0.0073 0.0401 1374 GLY 205 H 0.0003 0.0141 0.0374 1375 GLY 205 CA -0.0094 -0.0048 0.0330 1376 GLY 205 C 0.0013 -0.0041 0.0223 1377 GLY 205 O 0.0100 0.0030 0.0184 1378 LYS 206 N 0.0006 -0.0121 0.0168 1379 LYS 206 H -0.0066 -0.0180 0.0199 1380 LYS 206 CA 0.0101 -0.0124 0.0064 1381 LYS 206 CB 0.0078 -0.0187 0.0040 1382 LYS 206 CG 0.0059 -0.0108 0.0121 1383 LYS 206 CD 0.0040 -0.0168 0.0095 1384 LYS 206 CE 0.0024 -0.0087 0.0175 1385 LYS 206 NZ 0.0010 -0.0148 0.0142 1386 LYS 206 HZ1 0.0073 -0.0175 0.0055 1387 LYS 206 HZ2 0.0013 -0.0086 0.0187 1388 LYS 206 HZ3 -0.0065 -0.0228 0.0160 1389 LYS 206 C 0.0150 -0.0189 -0.0038 1390 LYS 206 O 0.0250 -0.0154 -0.0117 1391 GLY 207 N 0.0127 -0.0149 0.0033 1392 GLY 207 H 0.0118 -0.0157 0.0048 1393 GLY 207 CA 0.0131 -0.0158 0.0025 1394 GLY 207 C 0.0127 -0.0139 0.0034 1395 GLY 207 O 0.0130 -0.0145 0.0029 1396 SER 208 N 0.0121 -0.0117 0.0047 1397 SER 208 H 0.0120 -0.0112 0.0051 1398 SER 208 CA 0.0117 -0.0098 0.0057 1399 SER 208 CB 0.0107 -0.0080 0.0078 1400 SER 208 OG 0.0095 -0.0096 0.0097 1401 SER 208 HG 0.0088 -0.0084 0.0110 1402 SER 208 C 0.0129 -0.0079 0.0038 1403 SER 208 O 0.0138 -0.0070 0.0023 1404 TRP 209 N 0.0080 -0.0025 0.0034 1405 TRP 209 H 0.0089 -0.0017 0.0040 1406 TRP 209 CA 0.0062 -0.0022 0.0036 1407 TRP 209 CB 0.0055 -0.0008 0.0046 1408 TRP 209 CG 0.0057 -0.0005 0.0049 1409 TRP 209 CD1 0.0071 0.0001 0.0054 1410 TRP 209 NE1 0.0068 0.0002 0.0054 1411 TRP 209 HE1 0.0076 0.0006 0.0057 1412 TRP 209 CE2 0.0052 -0.0004 0.0049 1413 TRP 209 CZ2 0.0043 -0.0007 0.0047 1414 TRP 209 CH2 0.0026 -0.0013 0.0041 1415 TRP 209 CZ3 0.0019 -0.0018 0.0038 1416 TRP 209 CE3 0.0028 -0.0015 0.0040 1417 TRP 209 CD2 0.0044 -0.0009 0.0045 1418 TRP 209 C 0.0059 -0.0021 0.0036 1419 TRP 209 O 0.0072 -0.0019 0.0038 1420 ASP 210 N 0.0042 -0.0023 0.0035 1421 ASP 210 H 0.0032 -0.0024 0.0033 1422 ASP 210 CA 0.0037 -0.0022 0.0035 1423 ASP 210 CB 0.0017 -0.0026 0.0031 1424 ASP 210 CG 0.0013 -0.0030 0.0028 1425 ASP 210 OD1 0.0021 -0.0040 0.0021 1426 ASP 210 OD2 0.0002 -0.0022 0.0034 1427 ASP 210 C 0.0040 -0.0007 0.0046 1428 ASP 210 O 0.0043 -0.0006 0.0047 1429 CYS 211 N 0.0021 0.0012 0.0053 1430 CYS 211 H 0.0021 0.0013 0.0054 1431 CYS 211 CA 0.0022 0.0013 0.0054 1432 CYS 211 CB 0.0021 0.0015 0.0056 1433 CYS 211 SG 0.0018 0.0013 0.0058 1434 CYS 211 C 0.0023 0.0014 0.0053 1435 CYS 211 O 0.0025 0.0015 0.0052 1436 ILE 212 N 0.0023 0.0014 0.0053 1437 ILE 212 H 0.0022 0.0014 0.0054 1438 ILE 212 CA 0.0025 0.0015 0.0052 1439 ILE 212 CB 0.0024 0.0014 0.0052 1440 ILE 212 CG2 0.0026 0.0016 0.0051 1441 ILE 212 CG1 0.0024 0.0012 0.0050 1442 ILE 212 CD1 0.0022 0.0011 0.0050 1443 ILE 212 C 0.0026 0.0018 0.0054 1444 ILE 212 O 0.0025 0.0018 0.0056 1445 MET 213 N -0.0039 0.0069 0.0037 1446 MET 213 H -0.0057 0.0085 0.0035 1447 MET 213 CA -0.0038 0.0047 0.0036 1448 MET 213 CB -0.0029 0.0063 0.0038 1449 MET 213 CG 0.0005 0.0076 0.0042 1450 MET 213 SD 0.0037 0.0047 0.0045 1451 MET 213 CE 0.0031 0.0028 0.0043 1452 MET 213 C -0.0070 0.0033 0.0031 1453 MET 213 O -0.0094 0.0049 0.0029 1454 THR 214 N -0.0071 0.0000 0.0030 1455 THR 214 H -0.0051 -0.0013 0.0032 1456 THR 214 CA -0.0099 -0.0018 0.0025 1457 THR 214 CB -0.0111 -0.0036 0.0023 1458 THR 214 CG2 -0.0120 -0.0013 0.0023 1459 THR 214 OG1 -0.0088 -0.0059 0.0025 1460 THR 214 HG1 -0.0088 -0.0076 0.0024 1461 THR 214 C -0.0094 -0.0041 0.0025 1462 THR 214 O -0.0068 -0.0053 0.0028 1463 SER 215 N -0.0229 -0.0146 0.0063 1464 SER 215 H -0.0223 -0.0147 0.0076 1465 SER 215 CA -0.0246 -0.0148 0.0045 1466 SER 215 CB -0.0256 -0.0154 0.0054 1467 SER 215 OG -0.0239 -0.0148 0.0059 1468 SER 215 HG -0.0247 -0.0153 0.0064 1469 SER 215 C -0.0236 -0.0137 0.0021 1470 SER 215 O -0.0248 -0.0137 0.0002 1471 TYR 216 N -0.0213 -0.0129 0.0023 1472 TYR 216 H -0.0204 -0.0129 0.0039 1473 TYR 216 CA -0.0200 -0.0118 0.0003 1474 TYR 216 CB -0.0174 -0.0110 0.0011 1475 TYR 216 CG -0.0175 -0.0114 0.0025 1476 TYR 216 CD1 -0.0171 -0.0119 0.0050 1477 TYR 216 CE1 -0.0171 -0.0123 0.0063 1478 TYR 216 CZ -0.0175 -0.0121 0.0051 1479 TYR 216 OH -0.0175 -0.0125 0.0065 1480 TYR 216 HH -0.0172 -0.0128 0.0082 1481 TYR 216 CE2 -0.0179 -0.0116 0.0026 1482 TYR 216 CD2 -0.0179 -0.0113 0.0013 1483 TYR 216 C -0.0199 -0.0113 -0.0016 1484 TYR 216 O -0.0195 -0.0113 -0.0011 1485 GLN 217 N -0.0218 -0.0086 -0.0005 1486 GLN 217 H -0.0223 -0.0087 -0.0010 1487 GLN 217 CA -0.0217 -0.0082 -0.0026 1488 GLN 217 CB -0.0231 -0.0082 -0.0051 1489 GLN 217 CG -0.0260 -0.0091 -0.0050 1490 GLN 217 CD -0.0269 -0.0090 -0.0077 1491 GLN 217 OE1 -0.0271 -0.0087 -0.0096 1492 GLN 217 NE2 -0.0273 -0.0091 -0.0078 1493 GLN 217 1HE2 -0.0279 -0.0090 -0.0096 1494 GLN 217 2HE2 -0.0271 -0.0093 -0.0063 1495 GLN 217 C -0.0192 -0.0073 -0.0034 1496 GLN 217 O -0.0188 -0.0071 -0.0043 1497 TYR 218 N -0.0173 -0.0068 -0.0033 1498 TYR 218 H -0.0176 -0.0069 -0.0027 1499 TYR 218 CA -0.0148 -0.0059 -0.0042 1500 TYR 218 CB -0.0142 -0.0053 -0.0067 1501 TYR 218 CG -0.0159 -0.0054 -0.0090 1502 TYR 218 CD1 -0.0181 -0.0060 -0.0095 1503 TYR 218 CE1 -0.0198 -0.0062 -0.0115 1504 TYR 218 CZ -0.0193 -0.0058 -0.0131 1505 TYR 218 OH -0.0210 -0.0059 -0.0152 1506 TYR 218 HH -0.0203 -0.0056 -0.0160 1507 TYR 218 CE2 -0.0171 -0.0052 -0.0126 1508 TYR 218 CD2 -0.0154 -0.0050 -0.0106 1509 TYR 218 C -0.0128 -0.0056 -0.0022 1510 TYR 218 O -0.0130 -0.0059 -0.0008 1511 LEU 219 N -0.0092 -0.0031 -0.0029 1512 LEU 219 H -0.0092 -0.0029 -0.0040 1513 LEU 219 CA -0.0074 -0.0026 -0.0015 1514 LEU 219 CB -0.0067 -0.0025 -0.0003 1515 LEU 219 CG -0.0050 -0.0020 0.0017 1516 LEU 219 CD1 -0.0055 -0.0025 0.0036 1517 LEU 219 CD2 -0.0028 -0.0010 0.0008 1518 LEU 219 C -0.0058 -0.0017 -0.0031 1519 LEU 219 O -0.0053 -0.0013 -0.0046 1520 ILE 220 N -0.0050 -0.0014 -0.0030 1521 ILE 220 H -0.0054 -0.0017 -0.0018 1522 ILE 220 CA -0.0035 -0.0006 -0.0045 1523 ILE 220 CB -0.0044 -0.0007 -0.0061 1524 ILE 220 CG2 -0.0028 0.0001 -0.0077 1525 ILE 220 CG1 -0.0064 -0.0014 -0.0074 1526 ILE 220 CD1 -0.0077 -0.0017 -0.0087 1527 ILE 220 C -0.0015 0.0001 -0.0033 1528 ILE 220 O -0.0015 -0.0001 -0.0018 1529 ILE 221 N -0.0009 0.0015 -0.0037 1530 ILE 221 H -0.0014 0.0018 -0.0041 1531 ILE 221 CA 0.0005 0.0013 -0.0034 1532 ILE 221 CB 0.0006 0.0011 -0.0030 1533 ILE 221 CG2 0.0021 0.0010 -0.0029 1534 ILE 221 CG1 -0.0003 0.0004 -0.0020 1535 ILE 221 CD1 -0.0003 0.0002 -0.0018 1536 ILE 221 C 0.0012 0.0021 -0.0045 1537 ILE 221 O 0.0009 0.0027 -0.0053 1538 GLN 222 N 0.0022 0.0021 -0.0045 1539 GLN 222 H 0.0025 0.0017 -0.0038 1540 GLN 222 CA 0.0030 0.0028 -0.0055 1541 GLN 222 CB 0.0027 0.0031 -0.0059 1542 GLN 222 CG 0.0013 0.0034 -0.0064 1543 GLN 222 CD 0.0012 0.0037 -0.0069 1544 GLN 222 OE1 0.0017 0.0044 -0.0078 1545 GLN 222 NE2 0.0006 0.0033 -0.0062 1546 GLN 222 1HE2 0.0005 0.0034 -0.0065 1547 GLN 222 2HE2 0.0002 0.0027 -0.0055 1548 GLN 222 C 0.0045 0.0027 -0.0052 1549 GLN 222 O 0.0049 0.0020 -0.0042 1550 ASN 223 N 0.0037 0.0025 -0.0060 1551 ASN 223 H 0.0033 0.0033 -0.0061 1552 ASN 223 CA 0.0043 0.0031 -0.0055 1553 ASN 223 CB 0.0039 0.0048 -0.0054 1554 ASN 223 CG 0.0043 0.0056 -0.0050 1555 ASN 223 OD1 0.0052 0.0052 -0.0046 1556 ASN 223 ND2 0.0036 0.0069 -0.0053 1557 ASN 223 1HD2 0.0038 0.0075 -0.0050 1558 ASN 223 2HD2 0.0028 0.0072 -0.0057 1559 ASN 223 C 0.0057 0.0029 -0.0046 1560 ASN 223 O 0.0062 0.0035 -0.0043 1561 THR 224 N 0.0065 0.0022 -0.0043 1562 THR 224 H 0.0061 0.0018 -0.0046 1563 THR 224 CA 0.0078 0.0020 -0.0035 1564 THR 224 CB 0.0083 0.0006 -0.0035 1565 THR 224 CG2 0.0098 0.0004 -0.0026 1566 THR 224 OG1 0.0078 0.0006 -0.0038 1567 THR 224 HG1 0.0080 -0.0004 -0.0039 1568 THR 224 C 0.0084 0.0019 -0.0032 1569 THR 224 O 0.0081 0.0010 -0.0035 1570 THR 225 N 0.0126 0.0057 0.0012 1571 THR 225 H 0.0126 0.0059 0.0009 1572 THR 225 CA 0.0133 0.0062 0.0019 1573 THR 225 CB 0.0139 0.0068 0.0020 1574 THR 225 CG2 0.0146 0.0074 0.0028 1575 THR 225 OG1 0.0138 0.0075 0.0011 1576 THR 225 HG1 0.0139 0.0078 0.0009 1577 THR 225 C 0.0134 0.0055 0.0028 1578 THR 225 O 0.0131 0.0048 0.0031 1579 TRP 226 N 0.0137 0.0056 0.0033 1580 TRP 226 H 0.0139 0.0061 0.0031 1581 TRP 226 CA 0.0138 0.0050 0.0042 1582 TRP 226 CB 0.0140 0.0051 0.0044 1583 TRP 226 CG 0.0140 0.0045 0.0054 1584 TRP 226 CD1 0.0146 0.0046 0.0062 1585 TRP 226 NE1 0.0144 0.0039 0.0069 1586 TRP 226 HE1 0.0148 0.0038 0.0076 1587 TRP 226 CE2 0.0137 0.0032 0.0064 1588 TRP 226 CZ2 0.0133 0.0023 0.0068 1589 TRP 226 CH2 0.0126 0.0017 0.0061 1590 TRP 226 CZ3 0.0123 0.0021 0.0052 1591 TRP 226 CE3 0.0127 0.0030 0.0048 1592 TRP 226 CD2 0.0134 0.0035 0.0055 1593 TRP 226 C 0.0143 0.0050 0.0051 1594 TRP 226 O 0.0149 0.0058 0.0053 1595 ASP 227 N 0.0155 0.0036 0.0077 1596 ASP 227 H 0.0154 0.0025 0.0071 1597 ASP 227 CA 0.0158 0.0035 0.0095 1598 ASP 227 CB 0.0160 0.0031 0.0103 1599 ASP 227 CG 0.0161 0.0014 0.0098 1600 ASP 227 OD1 0.0159 0.0005 0.0088 1601 ASP 227 OD2 0.0162 0.0010 0.0105 1602 ASP 227 C 0.0160 0.0024 0.0100 1603 ASP 227 O 0.0163 0.0014 0.0111 1604 ASP 228 N 0.0158 0.0025 0.0091 1605 ASP 228 H 0.0156 0.0033 0.0082 1606 ASP 228 CA 0.0160 0.0015 0.0094 1607 ASP 228 CB 0.0163 0.0021 0.0110 1608 ASP 228 CG 0.0163 0.0015 0.0111 1609 ASP 228 OD1 0.0161 0.0011 0.0098 1610 ASP 228 OD2 0.0166 0.0015 0.0124 1611 ASP 228 C 0.0160 -0.0003 0.0092 1612 ASP 228 O 0.0163 -0.0013 0.0103 1613 HIS 229 N 0.0141 0.0007 0.0097 1614 HIS 229 H 0.0143 0.0013 0.0090 1615 HIS 229 CA 0.0136 -0.0005 0.0094 1616 HIS 229 CB 0.0134 -0.0007 0.0081 1617 HIS 229 CG 0.0134 -0.0005 0.0076 1618 HIS 229 ND1 0.0131 -0.0013 0.0078 1619 HIS 229 CE1 0.0131 -0.0009 0.0072 1620 HIS 229 NE2 0.0134 0.0001 0.0066 1621 HIS 229 CD2 0.0136 0.0003 0.0069 1622 HIS 229 C 0.0134 -0.0012 0.0098 1623 HIS 229 O 0.0131 -0.0022 0.0101 1624 CYS 230 N 0.0136 -0.0006 0.0097 1625 CYS 230 H 0.0139 0.0002 0.0095 1626 CYS 230 CA 0.0134 -0.0013 0.0100 1627 CYS 230 CB 0.0130 -0.0019 0.0089 1628 CYS 230 SG 0.0128 -0.0027 0.0093 1629 CYS 230 C 0.0138 -0.0006 0.0106 1630 CYS 230 O 0.0140 0.0002 0.0100 1631 GLN 231 N 0.0127 0.0007 0.0084 1632 GLN 231 H 0.0133 0.0011 0.0082 1633 GLN 231 CA 0.0124 -0.0002 0.0076 1634 GLN 231 CB 0.0131 -0.0005 0.0068 1635 GLN 231 CG 0.0128 -0.0014 0.0061 1636 GLN 231 CD 0.0134 -0.0017 0.0053 1637 GLN 231 OE1 0.0140 -0.0012 0.0052 1638 GLN 231 NE2 0.0132 -0.0025 0.0046 1639 GLN 231 1HE2 0.0135 -0.0028 0.0041 1640 GLN 231 2HE2 0.0126 -0.0030 0.0047 1641 GLN 231 C 0.0127 -0.0002 0.0075 1642 GLN 231 O 0.0134 0.0003 0.0073 1643 PHE 232 N 0.0120 -0.0007 0.0076 1644 PHE 232 H 0.0113 -0.0011 0.0077 1645 PHE 232 CA 0.0121 -0.0007 0.0075 1646 PHE 232 CB 0.0115 -0.0002 0.0084 1647 PHE 232 CG 0.0117 0.0000 0.0085 1648 PHE 232 CD1 0.0111 -0.0004 0.0088 1649 PHE 232 CE1 0.0112 -0.0001 0.0089 1650 PHE 232 CZ 0.0121 0.0005 0.0087 1651 PHE 232 CE2 0.0128 0.0009 0.0085 1652 PHE 232 CD2 0.0126 0.0006 0.0084 1653 PHE 232 C 0.0118 -0.0016 0.0068 1654 PHE 232 O 0.0116 -0.0022 0.0064 1655 SER 233 N 0.0109 -0.0019 0.0110 1656 SER 233 H 0.0109 -0.0026 0.0106 1657 SER 233 CA 0.0108 -0.0021 0.0106 1658 SER 233 CB 0.0107 -0.0037 0.0101 1659 SER 233 OG 0.0103 -0.0039 0.0089 1660 SER 233 HG 0.0103 -0.0049 0.0087 1661 SER 233 C 0.0103 -0.0011 0.0096 1662 SER 233 O 0.0103 -0.0006 0.0097 1663 ARG 234 N 0.0100 -0.0006 0.0087 1664 ARG 234 H 0.0100 -0.0010 0.0087 1665 ARG 234 CA 0.0095 0.0004 0.0078 1666 ARG 234 CB 0.0090 -0.0002 0.0063 1667 ARG 234 CG 0.0086 0.0008 0.0054 1668 ARG 234 CD 0.0081 0.0004 0.0040 1669 ARG 234 NE 0.0081 -0.0009 0.0039 1670 ARG 234 HE 0.0085 -0.0012 0.0048 1671 ARG 234 CZ 0.0078 -0.0017 0.0028 1672 ARG 234 NH1 0.0073 -0.0014 0.0016 1673 ARG 234 1HH1 0.0072 -0.0006 0.0016 1674 ARG 234 2HH1 0.0070 -0.0021 0.0008 1675 ARG 234 NH2 0.0079 -0.0029 0.0029 1676 ARG 234 1HH2 0.0083 -0.0032 0.0038 1677 ARG 234 2HH2 0.0076 -0.0035 0.0021 1678 ARG 234 C 0.0094 0.0018 0.0077 1679 ARG 234 O 0.0090 0.0020 0.0067 1680 PRO 235 N 0.0097 0.0063 0.0037 1681 PRO 235 CA 0.0096 0.0077 0.0037 1682 PRO 235 CB 0.0101 0.0082 0.0051 1683 PRO 235 CG 0.0104 0.0068 0.0059 1684 PRO 235 CD 0.0102 0.0060 0.0051 1685 PRO 235 C 0.0093 0.0086 0.0032 1686 PRO 235 O 0.0094 0.0080 0.0033 1687 SER 236 N 0.0091 0.0099 0.0027 1688 SER 236 H 0.0091 0.0103 0.0028 1689 SER 236 CA 0.0087 0.0108 0.0020 1690 SER 236 CB 0.0086 0.0102 0.0016 1691 SER 236 OG 0.0084 0.0090 0.0008 1692 SER 236 HG 0.0087 0.0082 0.0013 1693 SER 236 C 0.0082 0.0110 0.0007 1694 SER 236 O 0.0082 0.0103 0.0004 1695 PRO 237 N 0.0086 0.0100 0.0020 1696 PRO 237 CA 0.0078 0.0104 0.0020 1697 PRO 237 CB 0.0074 0.0106 0.0019 1698 PRO 237 CG 0.0078 0.0099 0.0019 1699 PRO 237 CD 0.0087 0.0098 0.0020 1700 PRO 237 C 0.0073 0.0100 0.0018 1701 PRO 237 O 0.0067 0.0104 0.0018 1702 ILE 238 N 0.0075 0.0092 0.0017 1703 ILE 238 H 0.0081 0.0089 0.0018 1704 ILE 238 CA 0.0069 0.0086 0.0015 1705 ILE 238 CB 0.0073 0.0077 0.0014 1706 ILE 238 CG2 0.0069 0.0072 0.0013 1707 ILE 238 CG1 0.0072 0.0073 0.0013 1708 ILE 238 CD1 0.0078 0.0075 0.0015 1709 ILE 238 C 0.0065 0.0090 0.0015 1710 ILE 238 O 0.0057 0.0088 0.0013 1711 GLY 239 N 0.0077 0.0082 0.0036 1712 GLY 239 H 0.0081 0.0083 0.0037 1713 GLY 239 CA 0.0079 0.0084 0.0039 1714 GLY 239 C 0.0071 0.0089 0.0043 1715 GLY 239 O 0.0068 0.0089 0.0042 1716 TYR 240 N 0.0067 0.0093 0.0047 1717 TYR 240 H 0.0069 0.0093 0.0046 1718 TYR 240 CA 0.0059 0.0098 0.0051 1719 TYR 240 CB 0.0058 0.0102 0.0055 1720 TYR 240 CG 0.0050 0.0107 0.0059 1721 TYR 240 CD1 0.0049 0.0112 0.0065 1722 TYR 240 CE1 0.0041 0.0116 0.0068 1723 TYR 240 CZ 0.0034 0.0115 0.0066 1724 TYR 240 OH 0.0026 0.0119 0.0070 1725 TYR 240 HH 0.0026 0.0122 0.0073 1726 TYR 240 CE2 0.0034 0.0110 0.0061 1727 TYR 240 CD2 0.0042 0.0106 0.0057 1728 TYR 240 C 0.0051 0.0094 0.0046 1729 TYR 240 O 0.0045 0.0096 0.0047 1730 LEU 241 N 0.0064 0.0111 0.0031 1731 LEU 241 H 0.0071 0.0109 0.0034 1732 LEU 241 CA 0.0057 0.0107 0.0028 1733 LEU 241 CB 0.0063 0.0099 0.0030 1734 LEU 241 CG 0.0071 0.0105 0.0033 1735 LEU 241 CD1 0.0076 0.0097 0.0035 1736 LEU 241 CD2 0.0068 0.0116 0.0032 1737 LEU 241 C 0.0049 0.0100 0.0025 1738 LEU 241 O 0.0041 0.0100 0.0022 1739 GLY 242 N 0.0051 0.0095 0.0026 1740 GLY 242 H 0.0058 0.0095 0.0028 1741 GLY 242 CA 0.0044 0.0089 0.0023 1742 GLY 242 C 0.0035 0.0096 0.0019 1743 GLY 242 O 0.0027 0.0092 0.0016 1744 LEU 243 N 0.0024 0.0098 0.0045 1745 LEU 243 H 0.0027 0.0103 0.0053 1746 LEU 243 CA 0.0022 0.0100 0.0032 1747 LEU 243 CB 0.0023 0.0103 0.0032 1748 LEU 243 CG 0.0021 0.0093 0.0039 1749 LEU 243 CD1 0.0023 0.0099 0.0040 1750 LEU 243 CD2 0.0016 0.0079 0.0032 1751 LEU 243 C 0.0023 0.0112 0.0023 1752 LEU 243 O 0.0021 0.0112 0.0011 1753 LEU 244 N 0.0028 0.0124 0.0031 1754 LEU 244 H 0.0030 0.0124 0.0041 1755 LEU 244 CA 0.0030 0.0137 0.0025 1756 LEU 244 CB 0.0036 0.0148 0.0035 1757 LEU 244 CG 0.0038 0.0154 0.0041 1758 LEU 244 CD1 0.0043 0.0164 0.0053 1759 LEU 244 CD2 0.0038 0.0161 0.0030 1760 LEU 244 C 0.0029 0.0134 0.0019 1761 LEU 244 O 0.0028 0.0140 0.0008 1762 SER 245 N 0.0017 0.0130 -0.0011 1763 SER 245 H 0.0026 0.0125 -0.0001 1764 SER 245 CA 0.0009 0.0115 -0.0018 1765 SER 245 CB 0.0021 0.0100 -0.0007 1766 SER 245 OG 0.0028 0.0088 0.0001 1767 SER 245 HG 0.0035 0.0079 0.0007 1768 SER 245 C -0.0002 0.0103 -0.0029 1769 SER 245 O -0.0008 0.0088 -0.0035 1770 GLN 246 N -0.0007 0.0110 -0.0034 1771 GLN 246 H -0.0002 0.0122 -0.0029 1772 GLN 246 CA -0.0018 0.0099 -0.0045 1773 GLN 246 CB -0.0021 0.0111 -0.0048 1774 GLN 246 CG -0.0029 0.0100 -0.0056 1775 GLN 246 CD -0.0046 0.0101 -0.0073 1776 GLN 246 OE1 -0.0053 0.0085 -0.0080 1777 GLN 246 NE2 -0.0052 0.0119 -0.0079 1778 GLN 246 1HE2 -0.0063 0.0120 -0.0090 1779 GLN 246 2HE2 -0.0046 0.0132 -0.0073 1780 GLN 246 C -0.0032 0.0095 -0.0059 1781 GLN 246 O -0.0038 0.0078 -0.0064 1782 ARG 247 N -0.0032 0.0135 -0.0089 1783 ARG 247 H -0.0020 0.0151 -0.0088 1784 ARG 247 CA -0.0046 0.0131 -0.0097 1785 ARG 247 CB -0.0046 0.0155 -0.0108 1786 ARG 247 CG -0.0057 0.0172 -0.0124 1787 ARG 247 CD -0.0057 0.0197 -0.0135 1788 ARG 247 NE -0.0069 0.0210 -0.0150 1789 ARG 247 HE -0.0085 0.0209 -0.0161 1790 ARG 247 CZ -0.0058 0.0225 -0.0149 1791 ARG 247 NH1 -0.0036 0.0228 -0.0134 1792 ARG 247 1HH1 -0.0027 0.0220 -0.0124 1793 ARG 247 2HH1 -0.0028 0.0239 -0.0134 1794 ARG 247 NH2 -0.0070 0.0237 -0.0163 1795 ARG 247 1HH2 -0.0086 0.0235 -0.0174 1796 ARG 247 2HH2 -0.0062 0.0248 -0.0163 1797 ARG 247 C -0.0041 0.0112 -0.0084 1798 ARG 247 O -0.0055 0.0099 -0.0089 1799 THR 248 N -0.0019 0.0109 -0.0068 1800 THR 248 H -0.0008 0.0117 -0.0064 1801 THR 248 CA -0.0012 0.0091 -0.0054 1802 THR 248 CB 0.0012 0.0101 -0.0042 1803 THR 248 CG2 0.0014 0.0126 -0.0052 1804 THR 248 OG1 0.0027 0.0106 -0.0033 1805 THR 248 HG1 0.0041 0.0108 -0.0024 1806 THR 248 C -0.0016 0.0066 -0.0045 1807 THR 248 O -0.0007 0.0050 -0.0032 1808 ARG 249 N -0.0035 0.0070 -0.0042 1809 ARG 249 H -0.0039 0.0081 -0.0048 1810 ARG 249 CA -0.0036 0.0048 -0.0037 1811 ARG 249 CB -0.0036 0.0048 -0.0037 1812 ARG 249 CG -0.0020 0.0059 -0.0025 1813 ARG 249 CD -0.0021 0.0055 -0.0025 1814 ARG 249 NE -0.0035 0.0066 -0.0040 1815 ARG 249 HE -0.0033 0.0083 -0.0043 1816 ARG 249 CZ -0.0050 0.0053 -0.0051 1817 ARG 249 NH1 -0.0052 0.0031 -0.0047 1818 ARG 249 1HH1 -0.0043 0.0023 -0.0036 1819 ARG 249 2HH1 -0.0064 0.0022 -0.0055 1820 ARG 249 NH2 -0.0064 0.0064 -0.0066 1821 ARG 249 1HH2 -0.0063 0.0080 -0.0070 1822 ARG 249 2HH2 -0.0076 0.0055 -0.0074 1823 ARG 249 C -0.0054 0.0036 -0.0050 1824 ARG 249 O -0.0056 0.0017 -0.0047 1825 ASP 250 N -0.0067 0.0048 -0.0065 1826 ASP 250 H -0.0064 0.0064 -0.0066 1827 ASP 250 CA -0.0085 0.0040 -0.0079 1828 ASP 250 CB -0.0096 0.0060 -0.0093 1829 ASP 250 CG -0.0095 0.0070 -0.0095 1830 ASP 250 OD1 -0.0090 0.0060 -0.0088 1831 ASP 250 OD2 -0.0100 0.0089 -0.0105 1832 ASP 250 C -0.0092 0.0027 -0.0081 1833 ASP 250 O -0.0103 0.0010 -0.0086 1834 ILE 251 N -0.0095 0.0041 -0.0028 1835 ILE 251 H -0.0084 0.0050 -0.0029 1836 ILE 251 CA -0.0100 0.0025 -0.0022 1837 ILE 251 CB -0.0093 0.0031 -0.0022 1838 ILE 251 CG2 -0.0097 0.0015 -0.0016 1839 ILE 251 CG1 -0.0104 0.0048 -0.0033 1840 ILE 251 CD1 -0.0127 0.0045 -0.0039 1841 ILE 251 C -0.0093 0.0007 -0.0011 1842 ILE 251 O -0.0102 -0.0008 -0.0006 1843 TYR 252 N -0.0077 0.0009 -0.0007 1844 TYR 252 H -0.0071 0.0021 -0.0011 1845 TYR 252 CA -0.0068 -0.0007 0.0003 1846 TYR 252 CB -0.0081 -0.0018 0.0004 1847 TYR 252 CG -0.0082 -0.0006 -0.0001 1848 TYR 252 CD1 -0.0099 0.0002 -0.0010 1849 TYR 252 CE1 -0.0099 0.0012 -0.0015 1850 TYR 252 CZ -0.0082 0.0015 -0.0011 1851 TYR 252 OH -0.0082 0.0025 -0.0016 1852 TYR 252 HH -0.0094 0.0030 -0.0022 1853 TYR 252 CE2 -0.0065 0.0006 -0.0003 1854 TYR 252 CD2 -0.0065 -0.0004 0.0003 1855 TYR 252 C -0.0059 -0.0020 0.0012 1856 TYR 252 O -0.0056 -0.0035 0.0020 1857 ILE 253 N -0.0046 0.0025 0.0047 1858 ILE 253 H -0.0045 0.0034 0.0036 1859 ILE 253 CA -0.0026 -0.0001 0.0063 1860 ILE 253 CB -0.0040 -0.0019 0.0092 1861 ILE 253 CG2 -0.0063 -0.0021 0.0110 1862 ILE 253 CG1 -0.0053 -0.0014 0.0095 1863 ILE 253 CD1 -0.0062 -0.0034 0.0124 1864 ILE 253 C 0.0004 -0.0006 0.0047 1865 ILE 253 O 0.0006 0.0011 0.0027 1866 SER 254 N 0.0027 -0.0029 0.0057 1867 SER 254 H 0.0024 -0.0042 0.0074 1868 SER 254 CA 0.0058 -0.0038 0.0046 1869 SER 254 CB 0.0079 -0.0064 0.0061 1870 SER 254 OG 0.0068 -0.0082 0.0089 1871 SER 254 HG 0.0082 -0.0098 0.0097 1872 SER 254 C 0.0060 -0.0038 0.0045 1873 SER 254 O 0.0085 -0.0042 0.0032 1874 ARG 255 N 0.0023 -0.0074 0.0092 1875 ARG 255 H -0.0007 -0.0072 0.0107 1876 ARG 255 CA 0.0015 -0.0069 0.0092 1877 ARG 255 CB -0.0036 -0.0069 0.0120 1878 ARG 255 CG -0.0043 -0.0112 0.0162 1879 ARG 255 CD -0.0093 -0.0113 0.0190 1880 ARG 255 NE -0.0095 -0.0157 0.0230 1881 ARG 255 HE -0.0064 -0.0179 0.0233 1882 ARG 255 CZ -0.0136 -0.0168 0.0263 1883 ARG 255 NH1 -0.0179 -0.0140 0.0261 1884 ARG 255 1HH1 -0.0181 -0.0110 0.0235 1885 ARG 255 2HH1 -0.0209 -0.0149 0.0285 1886 ARG 255 NH2 -0.0133 -0.0210 0.0298 1887 ARG 255 1HH2 -0.0102 -0.0231 0.0300 1888 ARG 255 2HH2 -0.0163 -0.0219 0.0322 1889 ARG 255 C 0.0026 -0.0031 0.0052 1890 ARG 255 O 0.0027 -0.0026 0.0047 1891 ARG 256 N 0.0032 -0.0002 0.0023 1892 ARG 256 H 0.0029 -0.0006 0.0028 1893 ARG 256 CA 0.0044 0.0035 -0.0016 1894 ARG 256 CB 0.0019 0.0073 -0.0036 1895 ARG 256 CG -0.0037 0.0091 -0.0022 1896 ARG 256 CD -0.0053 0.0109 -0.0029 1897 ARG 256 NE -0.0031 0.0143 -0.0071 1898 ARG 256 HE -0.0018 0.0156 -0.0090 1899 ARG 256 CZ -0.0031 0.0158 -0.0085 1900 ARG 256 NH1 -0.0049 0.0142 -0.0061 1901 ARG 256 1HH1 -0.0065 0.0120 -0.0032 1902 ARG 256 2HH1 -0.0048 0.0153 -0.0071 1903 ARG 256 NH2 -0.0010 0.0189 -0.0124 1904 ARG 256 1HH2 0.0006 0.0201 -0.0142 1905 ARG 256 2HH2 -0.0008 0.0200 -0.0134 1906 ARG 256 C 0.0098 0.0029 -0.0041 1907 ARG 256 O 0.0112 0.0060 -0.0075 1908 LEU 257 N 0.0112 0.0049 0.0005 1909 LEU 257 H 0.0108 0.0044 0.0028 1910 LEU 257 CA 0.0142 0.0048 -0.0003 1911 LEU 257 CB 0.0160 0.0040 0.0026 1912 LEU 257 CG 0.0142 0.0037 0.0044 1913 LEU 257 CD1 0.0160 0.0028 0.0075 1914 LEU 257 CD2 0.0137 0.0043 0.0022 1915 LEU 257 C 0.0165 0.0051 -0.0024 1916 LEU 257 O 0.0180 0.0055 -0.0046 1917 LEU 258 N 0.0166 0.0050 -0.0018 1918 LEU 258 H 0.0154 0.0046 0.0001 1919 LEU 258 CA 0.0185 0.0052 -0.0036 1920 LEU 258 CB 0.0171 0.0062 -0.0070 1921 LEU 258 CG 0.0136 0.0065 -0.0071 1922 LEU 258 CD1 0.0125 0.0075 -0.0106 1923 LEU 258 CD2 0.0131 0.0061 -0.0053 1924 LEU 258 C 0.0221 0.0050 -0.0039 1925 LEU 258 O 0.0239 0.0044 -0.0023 1926 GLY 259 N 0.0259 0.0053 -0.0026 1927 GLY 259 H 0.0231 0.0052 -0.0041 1928 GLY 259 CA 0.0277 0.0034 -0.0038 1929 GLY 259 C 0.0279 0.0054 -0.0014 1930 GLY 259 O 0.0310 0.0045 -0.0008 1931 THR 260 N 0.0246 0.0080 -0.0001 1932 THR 260 H 0.0222 0.0085 -0.0008 1933 THR 260 CA 0.0240 0.0103 0.0022 1934 THR 260 CB 0.0265 0.0125 0.0060 1935 THR 260 CG2 0.0250 0.0143 0.0074 1936 THR 260 OG1 0.0309 0.0108 0.0064 1937 THR 260 HG1 0.0317 0.0102 0.0060 1938 THR 260 C 0.0244 0.0091 0.0010 1939 THR 260 O 0.0248 0.0107 0.0031 1940 PHE 261 N 0.0161 0.0045 -0.0006 1941 PHE 261 H 0.0168 0.0036 0.0001 1942 PHE 261 CA 0.0141 0.0038 -0.0010 1943 PHE 261 CB 0.0135 0.0015 -0.0003 1944 PHE 261 CG 0.0115 0.0006 -0.0007 1945 PHE 261 CD1 0.0112 0.0003 -0.0006 1946 PHE 261 CE1 0.0093 -0.0004 -0.0010 1947 PHE 261 CZ 0.0076 -0.0010 -0.0014 1948 PHE 261 CE2 0.0079 -0.0007 -0.0014 1949 PHE 261 CD2 0.0098 0.0000 -0.0010 1950 PHE 261 C 0.0126 0.0049 -0.0019 1951 PHE 261 O 0.0129 0.0052 -0.0019 1952 THR 262 N 0.0111 0.0057 -0.0028 1953 THR 262 H 0.0108 0.0056 -0.0028 1954 THR 262 CA 0.0098 0.0069 -0.0037 1955 THR 262 CB 0.0098 0.0090 -0.0046 1956 THR 262 CG2 0.0084 0.0103 -0.0055 1957 THR 262 OG1 0.0119 0.0100 -0.0042 1958 THR 262 HG1 0.0126 0.0094 -0.0037 1959 THR 262 C 0.0076 0.0058 -0.0041 1960 THR 262 O 0.0067 0.0053 -0.0042 1961 TRP 263 N 0.0066 0.0045 -0.0022 1962 TRP 263 H 0.0071 0.0056 -0.0020 1963 TRP 263 CA 0.0056 0.0036 -0.0035 1964 TRP 263 CB 0.0053 0.0036 -0.0039 1965 TRP 263 CG 0.0056 0.0024 -0.0027 1966 TRP 263 CD1 0.0064 0.0028 -0.0015 1967 TRP 263 NE1 0.0063 0.0013 -0.0008 1968 TRP 263 HE1 0.0068 0.0012 0.0001 1969 TRP 263 CE2 0.0054 -0.0001 -0.0015 1970 TRP 263 CZ2 0.0049 -0.0019 -0.0012 1971 TRP 263 CH2 0.0040 -0.0030 -0.0021 1972 TRP 263 CZ3 0.0035 -0.0024 -0.0033 1973 TRP 263 CE3 0.0039 -0.0006 -0.0036 1974 TRP 263 CD2 0.0049 0.0005 -0.0027 1975 TRP 263 C 0.0050 0.0044 -0.0050 1976 TRP 263 O 0.0051 0.0059 -0.0057 1977 THR 264 N 0.0043 0.0034 -0.0055 1978 THR 264 H 0.0042 0.0022 -0.0048 1979 THR 264 CA 0.0036 0.0038 -0.0068 1980 THR 264 CB 0.0034 0.0028 -0.0066 1981 THR 264 CG2 0.0028 0.0034 -0.0080 1982 THR 264 OG1 0.0044 0.0032 -0.0052 1983 THR 264 HG1 0.0047 0.0026 -0.0043 1984 THR 264 C 0.0026 0.0035 -0.0083 1985 THR 264 O 0.0022 0.0022 -0.0082 1986 LEU 265 N -0.0002 0.0036 -0.0079 1987 LEU 265 H -0.0007 0.0036 -0.0069 1988 LEU 265 CA 0.0006 0.0038 -0.0099 1989 LEU 265 CB 0.0002 0.0049 -0.0103 1990 LEU 265 CG -0.0011 0.0070 -0.0099 1991 LEU 265 CD1 -0.0014 0.0079 -0.0103 1992 LEU 265 CD2 -0.0012 0.0081 -0.0111 1993 LEU 265 C 0.0019 0.0019 -0.0104 1994 LEU 265 O 0.0028 0.0017 -0.0121 1995 SER 266 N 0.0020 0.0004 -0.0088 1996 SER 266 H 0.0012 0.0007 -0.0075 1997 SER 266 CA 0.0031 -0.0015 -0.0090 1998 SER 266 CB 0.0029 -0.0029 -0.0071 1999 SER 266 OG 0.0022 -0.0025 -0.0060 2000 SER 266 HG 0.0022 -0.0034 -0.0048 2001 SER 266 C 0.0040 -0.0023 -0.0100 2002 SER 266 O 0.0051 -0.0034 -0.0111 2003 ASP 267 N 0.0038 -0.0022 -0.0108 2004 ASP 267 H 0.0033 -0.0014 -0.0100 2005 ASP 267 CA 0.0042 -0.0030 -0.0112 2006 ASP 267 CB 0.0037 -0.0026 -0.0102 2007 ASP 267 CG 0.0035 -0.0033 -0.0085 2008 ASP 267 OD1 0.0037 -0.0043 -0.0081 2009 ASP 267 OD2 0.0030 -0.0027 -0.0076 2010 ASP 267 C 0.0045 -0.0026 -0.0129 2011 ASP 267 O 0.0051 -0.0036 -0.0137 2012 SER 268 N 0.0042 -0.0011 -0.0135 2013 SER 268 H 0.0038 -0.0003 -0.0128 2014 SER 268 CA 0.0045 -0.0005 -0.0151 2015 SER 268 CB 0.0040 0.0013 -0.0153 2016 SER 268 OG 0.0035 0.0020 -0.0145 2017 SER 268 HG 0.0032 0.0031 -0.0145 2018 SER 268 C 0.0050 -0.0012 -0.0161 2019 SER 268 O 0.0055 -0.0017 -0.0174 2020 GLU 269 N 0.0051 -0.0017 -0.0187 2021 GLU 269 H 0.0037 -0.0011 -0.0167 2022 GLU 269 CA 0.0064 -0.0029 -0.0190 2023 GLU 269 CB 0.0048 -0.0021 -0.0170 2024 GLU 269 CG 0.0027 0.0005 -0.0185 2025 GLU 269 CD 0.0039 0.0005 -0.0217 2026 GLU 269 OE1 0.0036 0.0017 -0.0243 2027 GLU 269 OE2 0.0052 -0.0007 -0.0216 2028 GLU 269 C 0.0089 -0.0055 -0.0182 2029 GLU 269 O 0.0104 -0.0066 -0.0190 2030 GLY 270 N 0.0095 -0.0066 -0.0165 2031 GLY 270 H 0.0082 -0.0057 -0.0158 2032 GLY 270 CA 0.0118 -0.0092 -0.0156 2033 GLY 270 C 0.0120 -0.0105 -0.0124 2034 GLY 270 O 0.0137 -0.0126 -0.0113 2035 LYS 271 N 0.0124 -0.0132 -0.0158 2036 LYS 271 H 0.0113 -0.0103 -0.0169 2037 LYS 271 CA 0.0121 -0.0153 -0.0126 2038 LYS 271 CB 0.0137 -0.0168 -0.0144 2039 LYS 271 CG 0.0164 -0.0209 -0.0160 2040 LYS 271 CD 0.0182 -0.0206 -0.0208 2041 LYS 271 CE 0.0210 -0.0247 -0.0225 2042 LYS 271 NZ 0.0216 -0.0262 -0.0222 2043 LYS 271 HZ1 0.0214 -0.0241 -0.0243 2044 LYS 271 HZ2 0.0204 -0.0262 -0.0190 2045 LYS 271 HZ3 0.0234 -0.0291 -0.0230 2046 LYS 271 C 0.0095 -0.0124 -0.0097 2047 LYS 271 O 0.0081 -0.0086 -0.0110 2048 GLU 272 N 0.0087 -0.0141 -0.0057 2049 GLU 272 H 0.0099 -0.0171 -0.0048 2050 GLU 272 CA 0.0062 -0.0117 -0.0026 2051 GLU 272 CB 0.0058 -0.0144 0.0019 2052 GLU 272 CG 0.0056 -0.0160 0.0043 2053 GLU 272 CD 0.0051 -0.0184 0.0087 2054 GLU 272 OE1 0.0031 -0.0166 0.0112 2055 GLU 272 OE2 0.0066 -0.0221 0.0095 2056 GLU 272 C 0.0059 -0.0098 -0.0040 2057 GLU 272 O 0.0039 -0.0063 -0.0037 2058 THR 273 N 0.0052 -0.0092 -0.0045 2059 THR 273 H 0.0070 -0.0109 -0.0047 2060 THR 273 CA 0.0045 -0.0084 -0.0049 2061 THR 273 CB 0.0044 -0.0094 -0.0020 2062 THR 273 CG2 0.0024 -0.0085 0.0009 2063 THR 273 OG1 0.0067 -0.0120 -0.0012 2064 THR 273 HG1 0.0067 -0.0125 0.0002 2065 THR 273 C 0.0061 -0.0088 -0.0079 2066 THR 273 O 0.0077 -0.0104 -0.0079 2067 PRO 274 N 0.0057 -0.0073 -0.0107 2068 PRO 274 CA 0.0071 -0.0075 -0.0139 2069 PRO 274 CB 0.0069 -0.0064 -0.0161 2070 PRO 274 CG 0.0044 -0.0045 -0.0146 2071 PRO 274 CD 0.0038 -0.0053 -0.0111 2072 PRO 274 C 0.0058 -0.0059 -0.0147 2073 PRO 274 O 0.0044 -0.0053 -0.0125 2074 GLY 275 N 0.0011 -0.0055 -0.0120 2075 GLY 275 H 0.0018 -0.0058 -0.0130 2076 GLY 275 CA 0.0008 -0.0041 -0.0131 2077 GLY 275 C -0.0006 -0.0018 -0.0128 2078 GLY 275 O -0.0013 -0.0015 -0.0118 2079 GLY 276 N -0.0012 -0.0003 -0.0136 2080 GLY 276 H -0.0006 -0.0005 -0.0145 2081 GLY 276 CA -0.0026 0.0019 -0.0134 2082 GLY 276 C -0.0024 0.0030 -0.0152 2083 GLY 276 O -0.0014 0.0030 -0.0172 2084 TYR 277 N -0.0007 0.0048 -0.0131 2085 TYR 277 H -0.0015 0.0045 -0.0132 2086 TYR 277 CA -0.0006 0.0059 -0.0138 2087 TYR 277 CB -0.0018 0.0064 -0.0146 2088 TYR 277 CG -0.0018 0.0076 -0.0154 2089 TYR 277 CD1 -0.0009 0.0085 -0.0157 2090 TYR 277 CE1 -0.0008 0.0096 -0.0164 2091 TYR 277 CZ -0.0016 0.0099 -0.0168 2092 TYR 277 OH -0.0015 0.0110 -0.0176 2093 TYR 277 HH -0.0009 0.0114 -0.0176 2094 TYR 277 CE2 -0.0025 0.0090 -0.0166 2095 TYR 277 CD2 -0.0026 0.0079 -0.0159 2096 TYR 277 C -0.0005 0.0059 -0.0137 2097 TYR 277 O -0.0012 0.0052 -0.0135 2098 CYS 278 N 0.0005 0.0066 -0.0138 2099 CYS 278 H 0.0011 0.0071 -0.0140 2100 CYS 278 CA 0.0008 0.0066 -0.0137 2101 CYS 278 CB 0.0022 0.0070 -0.0134 2102 CYS 278 SG 0.0031 0.0059 -0.0124 2103 CYS 278 C 0.0002 0.0075 -0.0145 2104 CYS 278 O 0.0002 0.0084 -0.0152 2105 LEU 279 N 0.0037 0.0071 -0.0102 2106 LEU 279 H 0.0041 0.0060 -0.0103 2107 LEU 279 CA 0.0032 0.0091 -0.0102 2108 LEU 279 CB 0.0021 0.0091 -0.0100 2109 LEU 279 CG -0.0003 0.0088 -0.0095 2110 LEU 279 CD1 -0.0010 0.0070 -0.0093 2111 LEU 279 CD2 -0.0012 0.0088 -0.0094 2112 LEU 279 C 0.0052 0.0102 -0.0106 2113 LEU 279 O 0.0067 0.0095 -0.0109 2114 THR 280 N 0.0053 0.0120 -0.0107 2115 THR 280 H 0.0040 0.0125 -0.0105 2116 THR 280 CA 0.0070 0.0134 -0.0110 2117 THR 280 CB 0.0067 0.0151 -0.0110 2118 THR 280 CG2 0.0064 0.0139 -0.0109 2119 THR 280 OG1 0.0049 0.0164 -0.0107 2120 THR 280 HG1 0.0055 0.0177 -0.0109 2121 THR 280 C 0.0076 0.0145 -0.0112 2122 THR 280 O 0.0063 0.0147 -0.0109 2123 ARG 281 N 0.0156 0.0130 -0.0086 2124 ARG 281 H 0.0185 0.0129 -0.0087 2125 ARG 281 CA 0.0164 0.0149 -0.0092 2126 ARG 281 CB 0.0217 0.0160 -0.0098 2127 ARG 281 CG 0.0239 0.0197 -0.0110 2128 ARG 281 CD 0.0291 0.0207 -0.0116 2129 ARG 281 NE 0.0309 0.0238 -0.0127 2130 ARG 281 HE 0.0327 0.0224 -0.0123 2131 ARG 281 CZ 0.0302 0.0285 -0.0141 2132 ARG 281 NH1 0.0278 0.0306 -0.0146 2133 ARG 281 1HH1 0.0264 0.0288 -0.0140 2134 ARG 281 2HH1 0.0274 0.0340 -0.0157 2135 ARG 281 NH2 0.0321 0.0310 -0.0150 2136 ARG 281 1HH2 0.0339 0.0295 -0.0146 2137 ARG 281 2HH2 0.0316 0.0344 -0.0160 2138 ARG 281 C 0.0132 0.0190 -0.0103 2139 ARG 281 O 0.0120 0.0198 -0.0105 2140 TRP 282 N 0.0120 0.0217 -0.0111 2141 TRP 282 H 0.0131 0.0210 -0.0109 2142 TRP 282 CA 0.0089 0.0257 -0.0122 2143 TRP 282 CB 0.0086 0.0285 -0.0131 2144 TRP 282 CG 0.0132 0.0309 -0.0140 2145 TRP 282 CD1 0.0164 0.0297 -0.0138 2146 TRP 282 NE1 0.0201 0.0328 -0.0149 2147 TRP 282 HE1 0.0227 0.0327 -0.0150 2148 TRP 282 CE2 0.0193 0.0361 -0.0159 2149 TRP 282 CZ2 0.0219 0.0399 -0.0172 2150 TRP 282 CH2 0.0202 0.0426 -0.0180 2151 TRP 282 CZ3 0.0160 0.0416 -0.0175 2152 TRP 282 CE3 0.0133 0.0377 -0.0162 2153 TRP 282 CD2 0.0150 0.0350 -0.0154 2154 TRP 282 C 0.0039 0.0242 -0.0115 2155 TRP 282 O 0.0016 0.0262 -0.0120 2156 MET 283 N 0.0049 0.0165 -0.0096 2157 MET 283 H 0.0055 0.0161 -0.0095 2158 MET 283 CA 0.0037 0.0161 -0.0094 2159 MET 283 CB 0.0034 0.0152 -0.0090 2160 MET 283 CG 0.0021 0.0148 -0.0088 2161 MET 283 SD 0.0009 0.0159 -0.0093 2162 MET 283 CE -0.0004 0.0151 -0.0089 2163 MET 283 C 0.0034 0.0155 -0.0092 2164 MET 283 O 0.0023 0.0155 -0.0091 2165 LEU 284 N 0.0043 0.0149 -0.0089 2166 LEU 284 H 0.0052 0.0149 -0.0089 2167 LEU 284 CA 0.0043 0.0142 -0.0086 2168 LEU 284 CB 0.0052 0.0132 -0.0082 2169 LEU 284 CG 0.0050 0.0124 -0.0078 2170 LEU 284 CD1 0.0060 0.0114 -0.0074 2171 LEU 284 CD2 0.0037 0.0120 -0.0076 2172 LEU 284 C 0.0046 0.0149 -0.0089 2173 LEU 284 O 0.0051 0.0158 -0.0093 2174 ILE 285 N 0.0050 0.0157 -0.0085 2175 ILE 285 H 0.0043 0.0150 -0.0075 2176 ILE 285 CA 0.0047 0.0167 -0.0094 2177 ILE 285 CB 0.0029 0.0168 -0.0087 2178 ILE 285 CG2 0.0031 0.0155 -0.0074 2179 ILE 285 CG1 0.0023 0.0182 -0.0099 2180 ILE 285 CD1 0.0016 0.0195 -0.0109 2181 ILE 285 C 0.0064 0.0163 -0.0098 2182 ILE 285 O 0.0068 0.0173 -0.0110 2183 GLU 286 N 0.0074 0.0150 -0.0088 2184 GLU 286 H 0.0070 0.0142 -0.0079 2185 GLU 286 CA 0.0090 0.0144 -0.0090 2186 GLU 286 CB 0.0092 0.0130 -0.0075 2187 GLU 286 CG 0.0077 0.0130 -0.0069 2188 GLU 286 CD 0.0078 0.0116 -0.0055 2189 GLU 286 OE1 0.0093 0.0109 -0.0054 2190 GLU 286 OE2 0.0064 0.0112 -0.0044 2191 GLU 286 C 0.0108 0.0144 -0.0098 2192 GLU 286 O 0.0110 0.0144 -0.0099 2193 ALA 287 N 0.0204 0.0185 -0.0105 2194 ALA 287 H 0.0215 0.0183 -0.0108 2195 ALA 287 CA 0.0219 0.0188 -0.0109 2196 ALA 287 CB 0.0248 0.0193 -0.0117 2197 ALA 287 C 0.0216 0.0162 -0.0109 2198 ALA 287 O 0.0215 0.0164 -0.0109 2199 GLU 288 N 0.0215 0.0138 -0.0110 2200 GLU 288 H 0.0216 0.0137 -0.0110 2201 GLU 288 CA 0.0212 0.0112 -0.0110 2202 GLU 288 CB 0.0221 0.0087 -0.0114 2203 GLU 288 CG 0.0251 0.0087 -0.0122 2204 GLU 288 CD 0.0259 0.0061 -0.0125 2205 GLU 288 OE1 0.0242 0.0043 -0.0121 2206 GLU 288 OE2 0.0283 0.0058 -0.0132 2207 GLU 288 C 0.0184 0.0107 -0.0102 2208 GLU 288 O 0.0166 0.0112 -0.0097 2209 LEU 289 N 0.0153 0.0113 -0.0110 2210 LEU 289 H 0.0180 0.0110 -0.0114 2211 LEU 289 CA 0.0130 0.0106 -0.0102 2212 LEU 289 CB 0.0150 0.0101 -0.0103 2213 LEU 289 CG 0.0152 0.0131 -0.0119 2214 LEU 289 CD1 0.0172 0.0158 -0.0137 2215 LEU 289 CD2 0.0166 0.0121 -0.0117 2216 LEU 289 C 0.0116 0.0073 -0.0083 2217 LEU 289 O 0.0136 0.0050 -0.0075 2218 LYS 290 N 0.0080 0.0071 -0.0074 2219 LYS 290 H 0.0065 0.0089 -0.0080 2220 LYS 290 CA 0.0065 0.0041 -0.0056 2221 LYS 290 CB 0.0033 0.0042 -0.0049 2222 LYS 290 CG 0.0046 0.0049 -0.0056 2223 LYS 290 CD 0.0017 0.0053 -0.0052 2224 LYS 290 CE 0.0034 0.0056 -0.0057 2225 LYS 290 NZ 0.0006 0.0059 -0.0052 2226 LYS 290 HZ1 -0.0005 0.0084 -0.0062 2227 LYS 290 HZ2 -0.0015 0.0045 -0.0040 2228 LYS 290 HZ3 0.0017 0.0052 -0.0051 2229 LYS 290 C 0.0056 0.0023 -0.0045 2230 LYS 290 O 0.0036 0.0036 -0.0047 2231 CYS 291 N 0.0020 0.0057 -0.0079 2232 CYS 291 H 0.0035 0.0052 -0.0085 2233 CYS 291 CA 0.0007 0.0040 -0.0078 2234 CYS 291 CB 0.0022 0.0022 -0.0085 2235 CYS 291 SG 0.0041 0.0037 -0.0089 2236 CYS 291 C -0.0009 0.0025 -0.0075 2237 CYS 291 O -0.0004 0.0022 -0.0077 2238 PHE 292 N -0.0029 0.0017 -0.0070 2239 PHE 292 H -0.0032 0.0019 -0.0068 2240 PHE 292 CA -0.0046 0.0003 -0.0066 2241 PHE 292 CB -0.0068 0.0016 -0.0057 2242 PHE 292 CG -0.0064 0.0036 -0.0056 2243 PHE 292 CD1 -0.0059 0.0059 -0.0054 2244 PHE 292 CE1 -0.0055 0.0077 -0.0053 2245 PHE 292 CZ -0.0057 0.0073 -0.0053 2246 PHE 292 CE2 -0.0063 0.0050 -0.0054 2247 PHE 292 CD2 -0.0066 0.0031 -0.0056 2248 PHE 292 C -0.0050 -0.0021 -0.0068 2249 PHE 292 O -0.0038 -0.0027 -0.0073 2250 GLY 293 N -0.0088 0.0006 -0.0061 2251 GLY 293 H -0.0090 0.0007 -0.0060 2252 GLY 293 CA -0.0084 0.0004 -0.0057 2253 GLY 293 C -0.0081 0.0003 -0.0056 2254 GLY 293 O -0.0081 0.0003 -0.0059 2255 ASN 294 N -0.0077 0.0001 -0.0053 2256 ASN 294 H -0.0077 0.0002 -0.0051 2257 ASN 294 CA -0.0073 -0.0000 -0.0051 2258 ASN 294 CB -0.0070 -0.0001 -0.0047 2259 ASN 294 CG -0.0067 -0.0003 -0.0048 2260 ASN 294 OD1 -0.0066 -0.0003 -0.0053 2261 ASN 294 ND2 -0.0066 -0.0003 -0.0044 2262 ASN 294 1HD2 -0.0064 -0.0004 -0.0045 2263 ASN 294 2HD2 -0.0066 -0.0002 -0.0040 2264 ASN 294 C -0.0076 0.0001 -0.0049 2265 ASN 294 O -0.0074 0.0000 -0.0051 2266 THR 295 N -0.0079 0.0015 -0.0028 2267 THR 295 H -0.0078 0.0014 -0.0027 2268 THR 295 CA -0.0089 0.0017 -0.0023 2269 THR 295 CB -0.0095 0.0018 -0.0017 2270 THR 295 CG2 -0.0106 0.0021 -0.0011 2271 THR 295 OG1 -0.0090 0.0012 -0.0010 2272 THR 295 HG1 -0.0083 0.0010 -0.0014 2273 THR 295 C -0.0095 0.0024 -0.0031 2274 THR 295 O -0.0100 0.0025 -0.0028 2275 ALA 296 N -0.0094 0.0028 -0.0041 2276 ALA 296 H -0.0089 0.0027 -0.0044 2277 ALA 296 CA -0.0099 0.0034 -0.0049 2278 ALA 296 CB -0.0098 0.0039 -0.0059 2279 ALA 296 C -0.0095 0.0034 -0.0052 2280 ALA 296 O -0.0101 0.0038 -0.0055 2281 VAL 297 N -0.0060 0.0035 -0.0080 2282 VAL 297 H -0.0055 0.0034 -0.0071 2283 VAL 297 CA -0.0044 0.0027 -0.0088 2284 VAL 297 CB -0.0026 0.0019 -0.0097 2285 VAL 297 CG1 -0.0009 0.0011 -0.0105 2286 VAL 297 CG2 -0.0034 0.0019 -0.0115 2287 VAL 297 C -0.0036 0.0027 -0.0070 2288 VAL 297 O -0.0036 0.0026 -0.0074 2289 ALA 298 N -0.0031 0.0028 -0.0050 2290 ALA 298 H -0.0032 0.0029 -0.0047 2291 ALA 298 CA -0.0022 0.0027 -0.0031 2292 ALA 298 CB -0.0017 0.0028 -0.0011 2293 ALA 298 C -0.0036 0.0033 -0.0024 2294 ALA 298 O -0.0029 0.0031 -0.0021 2295 LYS 299 N -0.0042 0.0047 -0.0030 2296 LYS 299 H -0.0037 0.0045 -0.0026 2297 LYS 299 CA -0.0054 0.0043 -0.0033 2298 LYS 299 CB -0.0057 0.0033 -0.0028 2299 LYS 299 CG -0.0056 0.0024 -0.0021 2300 LYS 299 CD -0.0060 0.0014 -0.0016 2301 LYS 299 CE -0.0059 0.0005 -0.0009 2302 LYS 299 NZ -0.0064 -0.0004 -0.0005 2303 LYS 299 HZ1 -0.0071 -0.0004 -0.0009 2304 LYS 299 HZ2 -0.0065 -0.0010 -0.0001 2305 LYS 299 HZ3 -0.0059 -0.0005 -0.0001 2306 LYS 299 C -0.0059 0.0051 -0.0040 2307 LYS 299 O -0.0068 0.0051 -0.0045 2308 CYS 300 N -0.0053 0.0058 -0.0043 2309 CYS 300 H -0.0046 0.0058 -0.0039 2310 CYS 300 CA -0.0058 0.0066 -0.0050 2311 CYS 300 CB -0.0051 0.0072 -0.0051 2312 CYS 300 SG -0.0051 0.0065 -0.0047 2313 CYS 300 C -0.0060 0.0073 -0.0056 2314 CYS 300 O -0.0067 0.0077 -0.0063 2315 ASN 301 N -0.0005 0.0045 -0.0049 2316 ASN 301 H -0.0008 0.0045 -0.0052 2317 ASN 301 CA 0.0004 0.0035 -0.0045 2318 ASN 301 CB 0.0009 0.0029 -0.0044 2319 ASN 301 CG 0.0005 0.0021 -0.0055 2320 ASN 301 OD1 0.0002 0.0016 -0.0063 2321 ASN 301 ND2 0.0005 0.0022 -0.0055 2322 ASN 301 1HD2 0.0003 0.0017 -0.0062 2323 ASN 301 2HD2 0.0007 0.0026 -0.0048 2324 ASN 301 C 0.0010 0.0039 -0.0033 2325 ASN 301 O 0.0015 0.0034 -0.0031 2326 GLU 302 N 0.0010 0.0049 -0.0026 2327 GLU 302 H 0.0006 0.0053 -0.0028 2328 GLU 302 CA 0.0015 0.0054 -0.0014 2329 GLU 302 CB 0.0017 0.0060 -0.0006 2330 GLU 302 CG 0.0023 0.0051 -0.0005 2331 GLU 302 CD 0.0025 0.0058 0.0002 2332 GLU 302 OE1 0.0021 0.0069 0.0007 2333 GLU 302 OE2 0.0030 0.0052 0.0004 2334 GLU 302 C 0.0011 0.0063 -0.0013 2335 GLU 302 O 0.0016 0.0062 -0.0006 2336 LYS 303 N 0.0007 0.0081 -0.0021 2337 LYS 303 H 0.0004 0.0082 -0.0021 2338 LYS 303 CA 0.0002 0.0082 -0.0021 2339 LYS 303 CB -0.0005 0.0085 -0.0020 2340 LYS 303 CG -0.0005 0.0091 -0.0014 2341 LYS 303 CD -0.0013 0.0095 -0.0012 2342 LYS 303 CE -0.0013 0.0101 -0.0006 2343 LYS 303 NZ -0.0020 0.0104 -0.0005 2344 LYS 303 HZ1 -0.0023 0.0104 -0.0006 2345 LYS 303 HZ2 -0.0023 0.0102 -0.0007 2346 LYS 303 HZ3 -0.0020 0.0108 -0.0001 2347 LYS 303 C 0.0001 0.0077 -0.0026 2348 LYS 303 O -0.0001 0.0073 -0.0031 2349 HIS 304 N 0.0002 0.0078 -0.0025 2350 HIS 304 H 0.0003 0.0081 -0.0021 2351 HIS 304 CA 0.0000 0.0074 -0.0029 2352 HIS 304 CB 0.0007 0.0072 -0.0029 2353 HIS 304 CG 0.0014 0.0069 -0.0031 2354 HIS 304 ND1 0.0019 0.0071 -0.0028 2355 HIS 304 CE1 0.0023 0.0066 -0.0031 2356 HIS 304 NE2 0.0021 0.0061 -0.0036 2357 HIS 304 CD2 0.0015 0.0063 -0.0036 2358 HIS 304 C -0.0006 0.0077 -0.0028 2359 HIS 304 O -0.0008 0.0074 -0.0031 2360 ASP 305 N 0.0001 0.0082 -0.0044 2361 ASP 305 H 0.0002 0.0089 -0.0041 2362 ASP 305 CA -0.0005 0.0080 -0.0042 2363 ASP 305 CB -0.0004 0.0088 -0.0038 2364 ASP 305 CG -0.0005 0.0097 -0.0031 2365 ASP 305 OD1 0.0000 0.0101 -0.0032 2366 ASP 305 OD2 -0.0012 0.0100 -0.0025 2367 ASP 305 C -0.0015 0.0075 -0.0038 2368 ASP 305 O -0.0020 0.0070 -0.0038 2369 GLU 306 N -0.0019 0.0077 -0.0034 2370 GLU 306 H -0.0015 0.0081 -0.0034 2371 GLU 306 CA -0.0029 0.0072 -0.0030 2372 GLU 306 CB -0.0034 0.0079 -0.0022 2373 GLU 306 CG -0.0034 0.0087 -0.0017 2374 GLU 306 CD -0.0041 0.0084 -0.0014 2375 GLU 306 OE1 -0.0047 0.0076 -0.0015 2376 GLU 306 OE2 -0.0041 0.0090 -0.0010 2377 GLU 306 C -0.0030 0.0064 -0.0034 2378 GLU 306 O -0.0026 0.0065 -0.0037 2379 GLU 307 N -0.0024 0.0074 -0.0043 2380 GLU 307 H -0.0021 0.0071 -0.0044 2381 GLU 307 CA -0.0024 0.0069 -0.0037 2382 GLU 307 CB -0.0020 0.0061 -0.0034 2383 GLU 307 CG -0.0014 0.0057 -0.0039 2384 GLU 307 CD -0.0010 0.0059 -0.0046 2385 GLU 307 OE1 -0.0013 0.0063 -0.0046 2386 GLU 307 OE2 -0.0005 0.0055 -0.0050 2387 GLU 307 C -0.0031 0.0071 -0.0031 2388 GLU 307 O -0.0032 0.0070 -0.0027 2389 PHE 308 N -0.0035 0.0075 -0.0030 2390 PHE 308 H -0.0033 0.0076 -0.0033 2391 PHE 308 CA -0.0041 0.0078 -0.0024 2392 PHE 308 CB -0.0044 0.0081 -0.0024 2393 PHE 308 CG -0.0050 0.0084 -0.0017 2394 PHE 308 CD1 -0.0051 0.0079 -0.0010 2395 PHE 308 CE1 -0.0057 0.0081 -0.0004 2396 PHE 308 CZ -0.0062 0.0088 -0.0005 2397 PHE 308 CE2 -0.0061 0.0093 -0.0012 2398 PHE 308 CD2 -0.0055 0.0091 -0.0018 2399 PHE 308 C -0.0044 0.0083 -0.0025 2400 PHE 308 O -0.0048 0.0083 -0.0019 2401 CYS 309 N -0.0009 0.0092 -0.0039 2402 CYS 309 H -0.0008 0.0094 -0.0038 2403 CYS 309 CA -0.0008 0.0090 -0.0038 2404 CYS 309 CB -0.0006 0.0090 -0.0036 2405 CYS 309 SG -0.0007 0.0093 -0.0036 2406 CYS 309 C -0.0007 0.0088 -0.0037 2407 CYS 309 O -0.0008 0.0085 -0.0038 2408 ASP 310 N -0.0007 0.0089 -0.0036 2409 ASP 310 H -0.0007 0.0091 -0.0036 2410 ASP 310 CA -0.0006 0.0087 -0.0035 2411 ASP 310 CB -0.0005 0.0089 -0.0034 2412 ASP 310 CG -0.0004 0.0090 -0.0032 2413 ASP 310 OD1 -0.0003 0.0089 -0.0031 2414 ASP 310 OD2 -0.0003 0.0092 -0.0030 2415 ASP 310 C -0.0008 0.0086 -0.0037 2416 ASP 310 O -0.0007 0.0084 -0.0037 2417 MET 311 N -0.0003 0.0108 -0.0047 2418 MET 311 H -0.0002 0.0109 -0.0049 2419 MET 311 CA -0.0003 0.0108 -0.0048 2420 MET 311 CB 0.0001 0.0111 -0.0051 2421 MET 311 CG 0.0004 0.0114 -0.0049 2422 MET 311 SD 0.0005 0.0116 -0.0044 2423 MET 311 CE 0.0005 0.0116 -0.0046 2424 MET 311 C -0.0006 0.0105 -0.0049 2425 MET 311 O -0.0007 0.0105 -0.0048 2426 LEU 312 N -0.0008 0.0103 -0.0052 2427 LEU 312 H -0.0007 0.0103 -0.0054 2428 LEU 312 CA -0.0011 0.0100 -0.0054 2429 LEU 312 CB -0.0012 0.0097 -0.0058 2430 LEU 312 CG -0.0010 0.0099 -0.0063 2431 LEU 312 CD1 -0.0012 0.0096 -0.0066 2432 LEU 312 CD2 -0.0010 0.0099 -0.0064 2433 LEU 312 C -0.0014 0.0098 -0.0050 2434 LEU 312 O -0.0015 0.0096 -0.0049 2435 ARG 313 N 0.0023 0.0093 -0.0065 2436 ARG 313 H 0.0024 0.0097 -0.0063 2437 ARG 313 CA 0.0022 0.0088 -0.0058 2438 ARG 313 CB 0.0022 0.0089 -0.0049 2439 ARG 313 CG 0.0021 0.0086 -0.0049 2440 ARG 313 CD 0.0021 0.0088 -0.0040 2441 ARG 313 NE 0.0021 0.0085 -0.0041 2442 ARG 313 HE 0.0021 0.0083 -0.0046 2443 ARG 313 CZ 0.0021 0.0086 -0.0035 2444 ARG 313 NH1 0.0021 0.0089 -0.0027 2445 ARG 313 1HH1 0.0022 0.0090 -0.0026 2446 ARG 313 2HH1 0.0021 0.0090 -0.0022 2447 ARG 313 NH2 0.0021 0.0085 -0.0036 2448 ARG 313 1HH2 0.0021 0.0083 -0.0041 2449 ARG 313 2HH2 0.0021 0.0086 -0.0031 2450 ARG 313 C 0.0022 0.0090 -0.0058 2451 ARG 313 O 0.0021 0.0084 -0.0057 2452 LEU 314 N 0.0024 0.0098 -0.0059 2453 LEU 314 H 0.0025 0.0103 -0.0059 2454 LEU 314 CA 0.0024 0.0100 -0.0059 2455 LEU 314 CB 0.0026 0.0110 -0.0059 2456 LEU 314 CG 0.0027 0.0115 -0.0052 2457 LEU 314 CD1 0.0029 0.0124 -0.0054 2458 LEU 314 CD2 0.0026 0.0113 -0.0044 2459 LEU 314 C 0.0024 0.0097 -0.0066 2460 LEU 314 O 0.0023 0.0094 -0.0065 2461 PHE 315 N 0.0031 0.0123 -0.0092 2462 PHE 315 H 0.0032 0.0132 -0.0093 2463 PHE 315 CA 0.0025 0.0116 -0.0105 2464 PHE 315 CB 0.0020 0.0124 -0.0118 2465 PHE 315 CG 0.0013 0.0116 -0.0131 2466 PHE 315 CD1 0.0011 0.0116 -0.0135 2467 PHE 315 CE1 0.0005 0.0109 -0.0148 2468 PHE 315 CZ 0.0001 0.0102 -0.0156 2469 PHE 315 CE2 0.0002 0.0103 -0.0152 2470 PHE 315 CD2 0.0009 0.0110 -0.0140 2471 PHE 315 C 0.0024 0.0099 -0.0104 2472 PHE 315 O 0.0020 0.0090 -0.0109 2473 ASP 316 N 0.0026 0.0096 -0.0097 2474 ASP 316 H 0.0029 0.0104 -0.0093 2475 ASP 316 CA 0.0025 0.0080 -0.0095 2476 ASP 316 CB 0.0027 0.0078 -0.0091 2477 ASP 316 CG 0.0022 0.0081 -0.0103 2478 ASP 316 OD1 0.0023 0.0082 -0.0100 2479 ASP 316 OD2 0.0017 0.0083 -0.0116 2480 ASP 316 C 0.0029 0.0071 -0.0085 2481 ASP 316 O 0.0026 0.0058 -0.0088 2482 PHE 317 N 0.0040 0.0056 -0.0076 2483 PHE 317 H 0.0048 0.0071 -0.0076 2484 PHE 317 CA 0.0045 0.0045 -0.0056 2485 PHE 317 CB 0.0061 0.0056 -0.0039 2486 PHE 317 CG 0.0064 0.0041 -0.0019 2487 PHE 317 CD1 0.0061 0.0028 -0.0010 2488 PHE 317 CE1 0.0064 0.0014 0.0008 2489 PHE 317 CZ 0.0069 0.0013 0.0019 2490 PHE 317 CE2 0.0072 0.0026 0.0011 2491 PHE 317 CD2 0.0069 0.0040 -0.0008 2492 PHE 317 C 0.0040 0.0039 -0.0059 2493 PHE 317 O 0.0037 0.0022 -0.0049 2494 ASN 318 N 0.0040 0.0052 -0.0072 2495 ASN 318 H 0.0044 0.0066 -0.0079 2496 ASN 318 CA 0.0036 0.0049 -0.0076 2497 ASN 318 CB 0.0037 0.0067 -0.0092 2498 ASN 318 CG 0.0033 0.0066 -0.0098 2499 ASN 318 OD1 0.0039 0.0065 -0.0085 2500 ASN 318 ND2 0.0023 0.0067 -0.0118 2501 ASN 318 1HD2 0.0020 0.0067 -0.0123 2502 ASN 318 2HD2 0.0018 0.0068 -0.0128 2503 ASN 318 C 0.0021 0.0030 -0.0086 2504 ASN 318 O 0.0017 0.0017 -0.0079 2505 LYS 319 N 0.0027 0.0014 -0.0132 2506 LYS 319 H 0.0029 0.0029 -0.0132 2507 LYS 319 CA 0.0016 -0.0010 -0.0148 2508 LYS 319 CB 0.0010 -0.0007 -0.0160 2509 LYS 319 CG -0.0001 -0.0031 -0.0177 2510 LYS 319 CD -0.0006 -0.0026 -0.0187 2511 LYS 319 CE -0.0016 -0.0051 -0.0202 2512 LYS 319 NZ -0.0019 -0.0046 -0.0209 2513 LYS 319 HZ1 -0.0022 -0.0027 -0.0221 2514 LYS 319 HZ2 -0.0011 -0.0044 -0.0192 2515 LYS 319 HZ3 -0.0026 -0.0063 -0.0218 2516 LYS 319 C 0.0019 -0.0037 -0.0131 2517 LYS 319 O 0.0013 -0.0058 -0.0138 2518 GLN 320 N 0.0030 -0.0038 -0.0108 2519 GLN 320 H 0.0036 -0.0021 -0.0102 2520 GLN 320 CA 0.0035 -0.0063 -0.0091 2521 GLN 320 CB 0.0046 -0.0061 -0.0069 2522 GLN 320 CG 0.0041 -0.0061 -0.0079 2523 GLN 320 CD 0.0052 -0.0057 -0.0056 2524 GLN 320 OE1 0.0063 -0.0057 -0.0033 2525 GLN 320 NE2 0.0049 -0.0053 -0.0064 2526 GLN 320 1HE2 0.0056 -0.0050 -0.0051 2527 GLN 320 2HE2 0.0040 -0.0052 -0.0083 2528 GLN 320 C 0.0040 -0.0071 -0.0078 2529 GLN 320 O 0.0037 -0.0095 -0.0075 2530 ALA 321 N 0.0054 -0.0068 -0.0058 2531 ALA 321 H 0.0055 -0.0049 -0.0061 2532 ALA 321 CA 0.0060 -0.0072 -0.0047 2533 ALA 321 CB 0.0069 -0.0049 -0.0038 2534 ALA 321 C 0.0050 -0.0083 -0.0062 2535 ALA 321 O 0.0052 -0.0100 -0.0054 2536 ILE 322 N 0.0038 -0.0075 -0.0084 2537 ILE 322 H 0.0036 -0.0061 -0.0090 2538 ILE 322 CA 0.0028 -0.0085 -0.0099 2539 ILE 322 CB 0.0017 -0.0070 -0.0122 2540 ILE 322 CG2 0.0005 -0.0084 -0.0139 2541 ILE 322 CG1 0.0022 -0.0043 -0.0120 2542 ILE 322 CD1 0.0012 -0.0025 -0.0140 2543 ILE 322 C 0.0023 -0.0113 -0.0102 2544 ILE 322 O 0.0020 -0.0129 -0.0102 2545 GLN 323 N 0.0022 -0.0139 -0.0131 2546 GLN 323 H 0.0026 -0.0125 -0.0135 2547 GLN 323 CA 0.0010 -0.0171 -0.0133 2548 GLN 323 CB 0.0004 -0.0177 -0.0141 2549 GLN 323 CG -0.0005 -0.0167 -0.0174 2550 GLN 323 CD -0.0009 -0.0171 -0.0179 2551 GLN 323 OE1 -0.0002 -0.0175 -0.0158 2552 GLN 323 NE2 -0.0020 -0.0169 -0.0208 2553 GLN 323 1HE2 -0.0023 -0.0172 -0.0213 2554 GLN 323 2HE2 -0.0025 -0.0166 -0.0225 2555 GLN 323 C 0.0015 -0.0190 -0.0102 2556 GLN 323 O 0.0006 -0.0215 -0.0101 2557 ARG 324 N 0.0030 -0.0178 -0.0077 2558 ARG 324 H 0.0036 -0.0157 -0.0079 2559 ARG 324 CA 0.0036 -0.0193 -0.0047 2560 ARG 324 CB 0.0051 -0.0178 -0.0023 2561 ARG 324 CG 0.0050 -0.0180 -0.0024 2562 ARG 324 CD 0.0066 -0.0163 0.0000 2563 ARG 324 NE 0.0063 -0.0163 -0.0007 2564 ARG 324 HE 0.0052 -0.0172 -0.0026 2565 ARG 324 CZ 0.0074 -0.0152 0.0010 2566 ARG 324 NH1 0.0089 -0.0140 0.0037 2567 ARG 324 1HH1 0.0092 -0.0141 0.0044 2568 ARG 324 2HH1 0.0097 -0.0132 0.0049 2569 ARG 324 NH2 0.0071 -0.0151 0.0001 2570 ARG 324 1HH2 0.0060 -0.0160 -0.0018 2571 ARG 324 2HH2 0.0079 -0.0143 0.0014 2572 ARG 324 C 0.0039 -0.0194 -0.0038 2573 ARG 324 O 0.0034 -0.0219 -0.0028 2574 LEU 325 N 0.0055 -0.0166 -0.0042 2575 LEU 325 H 0.0056 -0.0149 -0.0047 2576 LEU 325 CA 0.0056 -0.0163 -0.0040 2577 LEU 325 CB 0.0065 -0.0161 -0.0012 2578 LEU 325 CG 0.0067 -0.0159 -0.0006 2579 LEU 325 CD1 0.0061 -0.0183 -0.0014 2580 LEU 325 CD2 0.0077 -0.0156 0.0023 2581 LEU 325 C 0.0055 -0.0138 -0.0055 2582 LEU 325 O 0.0059 -0.0117 -0.0051 2583 LYS 326 N 0.0048 -0.0142 -0.0075 2584 LYS 326 H 0.0044 -0.0160 -0.0078 2585 LYS 326 CA 0.0046 -0.0120 -0.0091 2586 LYS 326 CB 0.0036 -0.0127 -0.0119 2587 LYS 326 CG 0.0034 -0.0105 -0.0137 2588 LYS 326 CD 0.0024 -0.0112 -0.0165 2589 LYS 326 CE 0.0022 -0.0088 -0.0182 2590 LYS 326 NZ 0.0012 -0.0095 -0.0209 2591 LYS 326 HZ1 0.0009 -0.0115 -0.0211 2592 LYS 326 HZ2 0.0010 -0.0086 -0.0219 2593 LYS 326 HZ3 0.0011 -0.0087 -0.0217 2594 LYS 326 C 0.0050 -0.0110 -0.0083 2595 LYS 326 O 0.0055 -0.0086 -0.0080 2596 THR 327 N 0.0053 -0.0113 -0.0060 2597 THR 327 H 0.0056 -0.0127 -0.0062 2598 THR 327 CA 0.0051 -0.0110 -0.0063 2599 THR 327 CB 0.0052 -0.0127 -0.0073 2600 THR 327 CG2 0.0050 -0.0124 -0.0076 2601 THR 327 OG1 0.0047 -0.0132 -0.0090 2602 THR 327 HG1 0.0041 -0.0122 -0.0097 2603 THR 327 C 0.0056 -0.0103 -0.0046 2604 THR 327 O 0.0051 -0.0088 -0.0046 2605 GLU 328 N 0.0065 -0.0112 -0.0030 2606 GLU 328 H 0.0068 -0.0123 -0.0029 2607 GLU 328 CA 0.0069 -0.0105 -0.0014 2608 GLU 328 CB 0.0079 -0.0121 -0.0002 2609 GLU 328 CG 0.0083 -0.0115 0.0014 2610 GLU 328 CD 0.0092 -0.0131 0.0024 2611 GLU 328 OE1 0.0096 -0.0148 0.0020 2612 GLU 328 OE2 0.0096 -0.0127 0.0037 2613 GLU 328 C 0.0068 -0.0088 -0.0003 2614 GLU 328 O 0.0071 -0.0087 0.0004 2615 ALA 329 N 0.0048 -0.0056 0.0012 2616 ALA 329 H 0.0044 -0.0054 -0.0002 2617 ALA 329 CA 0.0035 -0.0045 0.0026 2618 ALA 329 CB 0.0018 -0.0034 0.0015 2619 ALA 329 C 0.0036 -0.0045 0.0042 2620 ALA 329 O 0.0032 -0.0041 0.0059 2621 GLN 330 N 0.0042 -0.0049 0.0035 2622 GLN 330 H 0.0045 -0.0053 0.0021 2623 GLN 330 CA 0.0043 -0.0049 0.0048 2624 GLN 330 CB 0.0050 -0.0055 0.0037 2625 GLN 330 CG 0.0037 -0.0047 0.0021 2626 GLN 330 CD 0.0044 -0.0053 0.0007 2627 GLN 330 OE1 0.0058 -0.0063 0.0010 2628 GLN 330 NE2 0.0034 -0.0047 -0.0008 2629 GLN 330 1HE2 0.0037 -0.0050 -0.0017 2630 GLN 330 2HE2 0.0022 -0.0039 -0.0010 2631 GLN 330 C 0.0055 -0.0057 0.0066 2632 GLN 330 O 0.0051 -0.0052 0.0084 2633 MET 331 N 0.0090 -0.0069 0.0068 2634 MET 331 H 0.0085 -0.0079 0.0054 2635 MET 331 CA 0.0096 -0.0078 0.0078 2636 MET 331 CB 0.0095 -0.0104 0.0069 2637 MET 331 CG 0.0103 -0.0126 0.0078 2638 MET 331 SD 0.0102 -0.0157 0.0066 2639 MET 331 CE 0.0108 -0.0157 0.0080 2640 MET 331 C 0.0091 -0.0061 0.0074 2641 MET 331 O 0.0098 -0.0056 0.0090 2642 SER 332 N 0.0081 -0.0048 0.0054 2643 SER 332 H 0.0076 -0.0051 0.0042 2644 SER 332 CA 0.0076 -0.0031 0.0049 2645 SER 332 CB 0.0063 -0.0021 0.0024 2646 SER 332 OG 0.0059 -0.0042 0.0008 2647 SER 332 HG 0.0051 -0.0036 -0.0007 2648 SER 332 C 0.0080 -0.0008 0.0066 2649 SER 332 O 0.0082 -0.0000 0.0074 2650 ILE 333 N 0.0070 0.0005 0.0050 2651 ILE 333 H 0.0068 -0.0001 0.0040 2652 ILE 333 CA 0.0069 0.0022 0.0066 2653 ILE 333 CB 0.0063 0.0029 0.0063 2654 ILE 333 CG2 0.0064 0.0046 0.0081 2655 ILE 333 CG1 0.0049 0.0038 0.0044 2656 ILE 333 CD1 0.0044 0.0042 0.0038 2657 ILE 333 C 0.0082 0.0016 0.0086 2658 ILE 333 O 0.0083 0.0028 0.0100 2659 GLN 334 N 0.0093 -0.0002 0.0088 2660 GLN 334 H 0.0092 -0.0012 0.0076 2661 GLN 334 CA 0.0106 -0.0009 0.0107 2662 GLN 334 CB 0.0116 -0.0029 0.0106 2663 GLN 334 CG 0.0115 -0.0029 0.0105 2664 GLN 334 CD 0.0118 -0.0015 0.0123 2665 GLN 334 OE1 0.0127 -0.0016 0.0141 2666 GLN 334 NE2 0.0109 -0.0001 0.0120 2667 GLN 334 1HE2 0.0110 0.0008 0.0132 2668 GLN 334 2HE2 0.0101 -0.0000 0.0106 2669 GLN 334 C 0.0110 -0.0010 0.0114 2670 GLN 334 O 0.0116 -0.0004 0.0132 2671 LEU 335 N 0.0097 -0.0031 0.0087 2672 LEU 335 H 0.0091 -0.0035 0.0075 2673 LEU 335 CA 0.0093 -0.0036 0.0078 2674 LEU 335 CB 0.0081 -0.0051 0.0054 2675 LEU 335 CG 0.0077 -0.0080 0.0055 2676 LEU 335 CD1 0.0065 -0.0090 0.0028 2677 LEU 335 CD2 0.0081 -0.0098 0.0072 2678 LEU 335 C 0.0094 -0.0011 0.0074 2679 LEU 335 O 0.0098 -0.0010 0.0082 2680 ILE 336 N 0.0092 0.0010 0.0062 2681 ILE 336 H 0.0090 0.0010 0.0055 2682 ILE 336 CA 0.0094 0.0034 0.0058 2683 ILE 336 CB 0.0090 0.0056 0.0039 2684 ILE 336 CG2 0.0078 0.0044 0.0014 2685 ILE 336 CG1 0.0094 0.0070 0.0047 2686 ILE 336 CD1 0.0091 0.0095 0.0030 2687 ILE 336 C 0.0106 0.0047 0.0081 2688 ILE 336 O 0.0108 0.0056 0.0085 2689 ASN 337 N 0.0081 0.0049 0.0064 2690 ASN 337 H 0.0077 0.0034 0.0056 2691 ASN 337 CA 0.0097 0.0068 0.0099 2692 ASN 337 CB 0.0106 0.0062 0.0118 2693 ASN 337 CG 0.0097 0.0087 0.0099 2694 ASN 337 OD1 0.0086 0.0113 0.0077 2695 ASN 337 ND2 0.0102 0.0079 0.0109 2696 ASN 337 1HD2 0.0097 0.0096 0.0099 2697 ASN 337 2HD2 0.0111 0.0058 0.0126 2698 ASN 337 C 0.0109 0.0056 0.0124 2699 ASN 337 O 0.0119 0.0080 0.0143 2700 LYS 338 N 0.0109 0.0017 0.0122 2701 LYS 338 H 0.0102 -0.0002 0.0107 2702 LYS 338 CA 0.0119 0.0001 0.0144 2703 LYS 338 CB 0.0120 -0.0044 0.0143 2704 LYS 338 CG 0.0129 -0.0063 0.0163 2705 LYS 338 CD 0.0129 -0.0108 0.0163 2706 LYS 338 CE 0.0141 -0.0128 0.0186 2707 LYS 338 NZ 0.0159 -0.0120 0.0224 2708 LYS 338 HZ1 0.0162 -0.0092 0.0230 2709 LYS 338 HZ2 0.0161 -0.0122 0.0229 2710 LYS 338 HZ3 0.0167 -0.0141 0.0239 2711 LYS 338 C 0.0113 0.0015 0.0131 2712 LYS 338 O 0.0124 0.0024 0.0153 2713 ALA 339 N 0.0084 0.0029 0.0045 2714 ALA 339 H 0.0083 0.0028 0.0043 2715 ALA 339 CA 0.0082 0.0029 0.0032 2716 ALA 339 CB 0.0076 0.0021 0.0019 2717 ALA 339 C 0.0088 0.0042 0.0024 2718 ALA 339 O 0.0086 0.0042 0.0014 2719 VAL 340 N 0.0095 0.0054 0.0030 2720 VAL 340 H 0.0096 0.0054 0.0038 2721 VAL 340 CA 0.0102 0.0068 0.0023 2722 VAL 340 CB 0.0109 0.0079 0.0032 2723 VAL 340 CG1 0.0116 0.0094 0.0028 2724 VAL 340 CG2 0.0109 0.0079 0.0030 2725 VAL 340 C 0.0103 0.0070 0.0022 2726 VAL 340 O 0.0104 0.0075 0.0010 2727 ASN 341 N 0.0110 0.0044 -0.0032 2728 ASN 341 H 0.0114 0.0038 -0.0032 2729 ASN 341 CA 0.0116 0.0054 -0.0036 2730 ASN 341 CB 0.0128 0.0055 -0.0040 2731 ASN 341 CG 0.0137 0.0046 -0.0041 2732 ASN 341 OD1 0.0137 0.0041 -0.0040 2733 ASN 341 ND2 0.0146 0.0045 -0.0044 2734 ASN 341 1HD2 0.0153 0.0039 -0.0045 2735 ASN 341 2HD2 0.0146 0.0049 -0.0045 2736 ASN 341 C 0.0109 0.0066 -0.0036 2737 ASN 341 O 0.0110 0.0074 -0.0038 2738 ALA 342 N 0.0102 0.0066 -0.0033 2739 ALA 342 H 0.0101 0.0059 -0.0031 2740 ALA 342 CA 0.0095 0.0076 -0.0033 2741 ALA 342 CB 0.0091 0.0074 -0.0031 2742 ALA 342 C 0.0084 0.0077 -0.0029 2743 ALA 342 O 0.0080 0.0087 -0.0030 2744 LEU 343 N 0.0063 0.0079 -0.0022 2745 LEU 343 H 0.0064 0.0076 -0.0024 2746 LEU 343 CA 0.0057 0.0080 -0.0024 2747 LEU 343 CB 0.0054 0.0076 -0.0027 2748 LEU 343 CG 0.0056 0.0072 -0.0030 2749 LEU 343 CD1 0.0053 0.0068 -0.0033 2750 LEU 343 CD2 0.0054 0.0073 -0.0030 2751 LEU 343 C 0.0054 0.0084 -0.0022 2752 LEU 343 O 0.0051 0.0087 -0.0021 2753 ILE 344 N 0.0055 0.0085 -0.0021 2754 ILE 344 H 0.0057 0.0082 -0.0022 2755 ILE 344 CA 0.0052 0.0088 -0.0020 2756 ILE 344 CB 0.0048 0.0087 -0.0023 2757 ILE 344 CG2 0.0045 0.0091 -0.0021 2758 ILE 344 CG1 0.0044 0.0085 -0.0025 2759 ILE 344 CD1 0.0040 0.0083 -0.0028 2760 ILE 344 C 0.0056 0.0091 -0.0017 2761 ILE 344 O 0.0060 0.0088 -0.0017 2762 ASN 345 N 0.0044 0.0067 -0.0023 2763 ASN 345 H 0.0046 0.0064 -0.0020 2764 ASN 345 CA 0.0042 0.0063 -0.0029 2765 ASN 345 CB 0.0043 0.0059 -0.0031 2766 ASN 345 CG 0.0040 0.0055 -0.0038 2767 ASN 345 OD1 0.0038 0.0057 -0.0043 2768 ASN 345 ND2 0.0042 0.0050 -0.0040 2769 ASN 345 1HD2 0.0040 0.0048 -0.0045 2770 ASN 345 2HD2 0.0044 0.0049 -0.0036 2771 ASN 345 C 0.0043 0.0058 -0.0030 2772 ASN 345 O 0.0047 0.0054 -0.0027 2773 ASP 346 N 0.0041 0.0060 -0.0035 2774 ASP 346 H 0.0038 0.0063 -0.0038 2775 ASP 346 CA 0.0041 0.0056 -0.0037 2776 ASP 346 CB 0.0037 0.0059 -0.0042 2777 ASP 346 CG 0.0036 0.0066 -0.0038 2778 ASP 346 OD1 0.0039 0.0067 -0.0032 2779 ASP 346 OD2 0.0033 0.0069 -0.0042 2780 ASP 346 C 0.0043 0.0048 -0.0040 2781 ASP 346 O 0.0045 0.0044 -0.0038 2782 GLN 347 N 0.0027 0.0035 -0.0047 2783 GLN 347 H 0.0028 0.0036 -0.0047 2784 GLN 347 CA 0.0025 0.0031 -0.0046 2785 GLN 347 CB 0.0025 0.0029 -0.0044 2786 GLN 347 CG 0.0023 0.0025 -0.0043 2787 GLN 347 CD 0.0019 0.0025 -0.0045 2788 GLN 347 OE1 0.0017 0.0027 -0.0047 2789 GLN 347 NE2 0.0016 0.0022 -0.0044 2790 GLN 347 1HE2 0.0014 0.0022 -0.0045 2791 GLN 347 2HE2 0.0018 0.0021 -0.0042 2792 GLN 347 C 0.0026 0.0030 -0.0044 2793 GLN 347 O 0.0024 0.0028 -0.0044 2794 LEU 348 N 0.0030 0.0031 -0.0042 2795 LEU 348 H 0.0032 0.0032 -0.0043 2796 LEU 348 CA 0.0032 0.0029 -0.0041 2797 LEU 348 CB 0.0036 0.0030 -0.0039 2798 LEU 348 CG 0.0038 0.0028 -0.0036 2799 LEU 348 CD1 0.0042 0.0030 -0.0035 2800 LEU 348 CD2 0.0036 0.0024 -0.0034 2801 LEU 348 C 0.0031 0.0031 -0.0042 2802 LEU 348 O 0.0030 0.0029 -0.0041 2803 ILE 349 N 0.0044 0.0028 -0.0033 2804 ILE 349 H 0.0037 0.0035 -0.0034 2805 ILE 349 CA 0.0049 0.0033 -0.0026 2806 ILE 349 CB 0.0043 0.0050 -0.0024 2807 ILE 349 CG2 0.0047 0.0054 -0.0019 2808 ILE 349 CG1 0.0047 0.0060 -0.0016 2809 ILE 349 CD1 0.0039 0.0077 -0.0015 2810 ILE 349 C 0.0046 0.0024 -0.0033 2811 ILE 349 O 0.0055 0.0018 -0.0028 2812 MET 350 N 0.0034 0.0021 -0.0043 2813 MET 350 H 0.0027 0.0026 -0.0046 2814 MET 350 CA 0.0030 0.0013 -0.0050 2815 MET 350 CB 0.0015 0.0015 -0.0060 2816 MET 350 CG 0.0009 0.0030 -0.0058 2817 MET 350 SD 0.0017 0.0034 -0.0051 2818 MET 350 CE 0.0013 0.0018 -0.0060 2819 MET 350 C 0.0037 -0.0004 -0.0051 2820 MET 350 O 0.0041 -0.0009 -0.0051 2821 LYS 351 N 0.0049 -0.0010 -0.0071 2822 LYS 351 H 0.0043 -0.0001 -0.0072 2823 LYS 351 CA 0.0054 -0.0019 -0.0074 2824 LYS 351 CB 0.0050 -0.0013 -0.0077 2825 LYS 351 CG 0.0045 -0.0007 -0.0092 2826 LYS 351 CD 0.0042 -0.0003 -0.0094 2827 LYS 351 CE 0.0037 0.0004 -0.0108 2828 LYS 351 NZ 0.0034 0.0008 -0.0108 2829 LYS 351 HZ1 0.0029 0.0014 -0.0116 2830 LYS 351 HZ2 0.0032 0.0013 -0.0098 2831 LYS 351 HZ3 0.0038 0.0001 -0.0110 2832 LYS 351 C 0.0060 -0.0026 -0.0061 2833 LYS 351 O 0.0067 -0.0037 -0.0063 2834 ASN 352 N 0.0057 -0.0020 -0.0049 2835 ASN 352 H 0.0052 -0.0011 -0.0048 2836 ASN 352 CA 0.0062 -0.0025 -0.0035 2837 ASN 352 CB 0.0057 -0.0015 -0.0023 2838 ASN 352 CG 0.0053 -0.0010 -0.0024 2839 ASN 352 OD1 0.0056 -0.0015 -0.0029 2840 ASN 352 ND2 0.0046 0.0002 -0.0019 2841 ASN 352 1HD2 0.0043 0.0007 -0.0021 2842 ASN 352 2HD2 0.0044 0.0006 -0.0015 2843 ASN 352 C 0.0067 -0.0033 -0.0032 2844 ASN 352 O 0.0074 -0.0043 -0.0028 2845 HIS 353 N 0.0061 -0.0035 -0.0019 2846 HIS 353 H 0.0050 -0.0026 -0.0023 2847 HIS 353 CA 0.0066 -0.0035 -0.0013 2848 HIS 353 CB 0.0052 -0.0020 -0.0013 2849 HIS 353 CG 0.0056 -0.0018 -0.0005 2850 HIS 353 ND1 0.0067 -0.0016 0.0012 2851 HIS 353 CE1 0.0067 -0.0015 0.0013 2852 HIS 353 NE2 0.0058 -0.0016 -0.0001 2853 HIS 353 CD2 0.0051 -0.0018 -0.0013 2854 HIS 353 C 0.0071 -0.0050 -0.0025 2855 HIS 353 O 0.0082 -0.0057 -0.0018 2856 LEU 354 N 0.0063 -0.0056 -0.0042 2857 LEU 354 H 0.0055 -0.0050 -0.0048 2858 LEU 354 CA 0.0068 -0.0070 -0.0055 2859 LEU 354 CB 0.0056 -0.0073 -0.0074 2860 LEU 354 CG 0.0041 -0.0061 -0.0080 2861 LEU 354 CD1 0.0030 -0.0064 -0.0099 2862 LEU 354 CD2 0.0044 -0.0063 -0.0077 2863 LEU 354 C 0.0083 -0.0084 -0.0051 2864 LEU 354 O 0.0092 -0.0095 -0.0051 2865 ARG 355 N 0.0096 -0.0093 -0.0073 2866 ARG 355 H 0.0086 -0.0078 -0.0073 2867 ARG 355 CA 0.0108 -0.0107 -0.0065 2868 ARG 355 CB 0.0102 -0.0098 -0.0060 2869 ARG 355 CG 0.0095 -0.0093 -0.0084 2870 ARG 355 CD 0.0088 -0.0082 -0.0079 2871 ARG 355 NE 0.0079 -0.0077 -0.0104 2872 ARG 355 HE 0.0080 -0.0082 -0.0119 2873 ARG 355 CZ 0.0070 -0.0064 -0.0107 2874 ARG 355 NH1 0.0069 -0.0056 -0.0087 2875 ARG 355 1HH1 0.0075 -0.0060 -0.0070 2876 ARG 355 2HH1 0.0062 -0.0047 -0.0090 2877 ARG 355 NH2 0.0062 -0.0059 -0.0130 2878 ARG 355 1HH2 0.0063 -0.0065 -0.0145 2879 ARG 355 2HH2 0.0055 -0.0050 -0.0133 2880 ARG 355 C 0.0119 -0.0116 -0.0042 2881 ARG 355 O 0.0132 -0.0134 -0.0039 2882 ASP 356 N 0.0113 -0.0103 -0.0025 2883 ASP 356 H 0.0102 -0.0088 -0.0028 2884 ASP 356 CA 0.0121 -0.0108 -0.0002 2885 ASP 356 CB 0.0112 -0.0092 0.0011 2886 ASP 356 CG 0.0100 -0.0071 0.0022 2887 ASP 356 OD1 0.0092 -0.0057 0.0028 2888 ASP 356 OD2 0.0099 -0.0069 0.0023 2889 ASP 356 C 0.0132 -0.0126 -0.0008 2890 ASP 356 O 0.0145 -0.0142 0.0002 2891 ILE 357 N 0.0121 -0.0106 0.0011 2892 ILE 357 H 0.0106 -0.0099 0.0006 2893 ILE 357 CA 0.0118 -0.0109 0.0007 2894 ILE 357 CB 0.0092 -0.0099 -0.0004 2895 ILE 357 CG2 0.0088 -0.0105 -0.0010 2896 ILE 357 CG1 0.0082 -0.0072 0.0006 2897 ILE 357 CD1 0.0055 -0.0063 -0.0005 2898 ILE 357 C 0.0127 -0.0135 -0.0003 2899 ILE 357 O 0.0140 -0.0141 0.0002 2900 MET 358 N 0.0123 -0.0151 -0.0015 2901 MET 358 H 0.0113 -0.0146 -0.0018 2902 MET 358 CA 0.0130 -0.0177 -0.0026 2903 MET 358 CB 0.0120 -0.0191 -0.0041 2904 MET 358 CG 0.0094 -0.0188 -0.0057 2905 MET 358 SD 0.0082 -0.0199 -0.0071 2906 MET 358 CE 0.0097 -0.0230 -0.0081 2907 MET 358 C 0.0156 -0.0188 -0.0016 2908 MET 358 O 0.0164 -0.0208 -0.0023 2909 GLY 359 N 0.0202 -0.0199 -0.0035 2910 GLY 359 H 0.0184 -0.0176 -0.0023 2911 GLY 359 CA 0.0234 -0.0215 -0.0017 2912 GLY 359 C 0.0235 -0.0227 -0.0035 2913 GLY 359 O 0.0262 -0.0245 -0.0028 2914 ILE 360 N 0.0206 -0.0217 -0.0060 2915 ILE 360 H 0.0185 -0.0201 -0.0065 2916 ILE 360 CA 0.0201 -0.0225 -0.0081 2917 ILE 360 CB 0.0175 -0.0227 -0.0121 2918 ILE 360 CG2 0.0163 -0.0229 -0.0141 2919 ILE 360 CG1 0.0190 -0.0254 -0.0144 2920 ILE 360 CD1 0.0165 -0.0255 -0.0181 2921 ILE 360 C 0.0188 -0.0200 -0.0056 2922 ILE 360 O 0.0170 -0.0174 -0.0039 2923 PRO 361 N 0.0163 -0.0175 -0.0072 2924 PRO 361 CA 0.0149 -0.0154 -0.0049 2925 PRO 361 CB 0.0151 -0.0156 -0.0045 2926 PRO 361 CG 0.0171 -0.0186 -0.0050 2927 PRO 361 CD 0.0176 -0.0194 -0.0075 2928 PRO 361 C 0.0130 -0.0127 -0.0058 2929 PRO 361 O 0.0124 -0.0118 -0.0085 2930 TYR 362 N 0.0122 -0.0113 -0.0034 2931 TYR 362 H 0.0128 -0.0122 -0.0012 2932 TYR 362 CA 0.0106 -0.0091 -0.0036 2933 TYR 362 CB 0.0111 -0.0098 -0.0034 2934 TYR 362 CG 0.0123 -0.0115 -0.0005 2935 TYR 362 CD1 0.0142 -0.0142 -0.0010 2936 TYR 362 CE1 0.0154 -0.0159 0.0016 2937 TYR 362 CZ 0.0148 -0.0149 0.0046 2938 TYR 362 OH 0.0160 -0.0167 0.0072 2939 TYR 362 HH 0.0172 -0.0184 0.0065 2940 TYR 362 CE2 0.0129 -0.0122 0.0051 2941 TYR 362 CD2 0.0117 -0.0105 0.0025 2942 TYR 362 C 0.0092 -0.0070 -0.0011 2943 TYR 362 O 0.0097 -0.0077 0.0014 2944 CYS 363 N 0.0066 -0.0042 -0.0022 2945 CYS 363 H 0.0062 -0.0038 -0.0037 2946 CYS 363 CA 0.0059 -0.0025 -0.0006 2947 CYS 363 CB 0.0047 -0.0007 -0.0017 2948 CYS 363 SG 0.0038 0.0013 0.0004 2949 CYS 363 C 0.0058 -0.0019 0.0008 2950 CYS 363 O 0.0054 -0.0015 -0.0002 2951 ASN 364 N 0.0061 -0.0018 0.0031 2952 ASN 364 H 0.0065 -0.0022 0.0037 2953 ASN 364 CA 0.0060 -0.0011 0.0047 2954 ASN 364 CB 0.0071 -0.0022 0.0069 2955 ASN 364 CG 0.0082 -0.0043 0.0065 2956 ASN 364 OD1 0.0082 -0.0047 0.0050 2957 ASN 364 ND2 0.0093 -0.0056 0.0080 2958 ASN 364 1HD2 0.0101 -0.0069 0.0079 2959 ASN 364 2HD2 0.0093 -0.0052 0.0093 2960 ASN 364 C 0.0048 0.0010 0.0055 2961 ASN 364 O 0.0046 0.0018 0.0068 2962 TYR 365 N 0.0030 0.0047 0.0016 2963 TYR 365 H 0.0033 0.0049 0.0010 2964 TYR 365 CA 0.0020 0.0053 0.0018 2965 TYR 365 CB 0.0019 0.0053 0.0020 2966 TYR 365 CG 0.0025 0.0055 0.0011 2967 TYR 365 CD1 0.0035 0.0048 0.0010 2968 TYR 365 CE1 0.0040 0.0050 0.0002 2969 TYR 365 CZ 0.0037 0.0058 -0.0006 2970 TYR 365 OH 0.0042 0.0060 -0.0014 2971 TYR 365 HH 0.0048 0.0054 -0.0013 2972 TYR 365 CE2 0.0027 0.0065 -0.0004 2973 TYR 365 CD2 0.0021 0.0063 0.0004 2974 TYR 365 C 0.0012 0.0053 0.0027 2975 TYR 365 O 0.0004 0.0058 0.0029 2976 SER 366 N 0.0015 0.0048 0.0031 2977 SER 366 H 0.0021 0.0045 0.0028 2978 SER 366 CA 0.0007 0.0048 0.0039 2979 SER 366 CB 0.0011 0.0039 0.0047 2980 SER 366 OG 0.0014 0.0033 0.0052 2981 SER 366 HG 0.0018 0.0027 0.0056 2982 SER 366 C 0.0002 0.0054 0.0036 2983 SER 366 O -0.0007 0.0059 0.0039 2984 LYS 367 N -0.0039 0.0029 0.0040 2985 LYS 367 H -0.0035 0.0020 0.0033 2986 LYS 367 CA -0.0041 0.0032 0.0045 2987 LYS 367 CB -0.0037 0.0018 0.0052 2988 LYS 367 CG -0.0038 0.0011 0.0069 2989 LYS 367 CD -0.0035 -0.0002 0.0075 2990 LYS 367 CE -0.0035 -0.0009 0.0092 2991 LYS 367 NZ -0.0031 -0.0022 0.0097 2992 LYS 367 HZ1 -0.0033 -0.0024 0.0110 2993 LYS 367 HZ2 -0.0027 -0.0032 0.0092 2994 LYS 367 HZ3 -0.0032 -0.0020 0.0094 2995 LYS 367 C -0.0041 0.0039 0.0032 2996 LYS 367 O -0.0038 0.0035 0.0018 2997 TYR 368 N -0.0046 0.0051 0.0037 2998 TYR 368 H -0.0049 0.0055 0.0048 2999 TYR 368 CA -0.0047 0.0060 0.0027 3000 TYR 368 CB -0.0052 0.0077 0.0024 3001 TYR 368 CG -0.0051 0.0077 0.0015 3002 TYR 368 CD1 -0.0052 0.0077 0.0023 3003 TYR 368 CE1 -0.0050 0.0077 0.0014 3004 TYR 368 CZ -0.0048 0.0077 -0.0003 3005 TYR 368 OH -0.0047 0.0077 -0.0012 3006 TYR 368 HH -0.0047 0.0075 -0.0005 3007 TYR 368 CE2 -0.0047 0.0077 -0.0011 3008 TYR 368 CD2 -0.0048 0.0077 -0.0002 3009 TYR 368 C -0.0049 0.0062 0.0035 3010 TYR 368 O -0.0052 0.0064 0.0050 3011 TRP 369 N -0.0083 0.0035 0.0033 3012 TRP 369 H -0.0086 0.0034 0.0033 3013 TRP 369 CA -0.0079 0.0031 0.0032 3014 TRP 369 CB -0.0076 0.0028 0.0030 3015 TRP 369 CG -0.0072 0.0030 0.0032 3016 TRP 369 CD1 -0.0071 0.0035 0.0034 3017 TRP 369 NE1 -0.0066 0.0036 0.0034 3018 TRP 369 HE1 -0.0065 0.0039 0.0036 3019 TRP 369 CE2 -0.0064 0.0031 0.0033 3020 TRP 369 CZ2 -0.0059 0.0029 0.0032 3021 TRP 369 CH2 -0.0057 0.0024 0.0030 3022 TRP 369 CZ3 -0.0060 0.0021 0.0028 3023 TRP 369 CE3 -0.0065 0.0022 0.0029 3024 TRP 369 CD2 -0.0067 0.0027 0.0031 3025 TRP 369 C -0.0082 0.0027 0.0030 3026 TRP 369 O -0.0087 0.0026 0.0029 3027 TYR 370 N -0.0079 0.0026 0.0029 3028 TYR 370 H -0.0075 0.0027 0.0030 3029 TYR 370 CA -0.0081 0.0023 0.0028 3030 TYR 370 CB -0.0084 0.0025 0.0029 3031 TYR 370 CG -0.0081 0.0029 0.0031 3032 TYR 370 CD1 -0.0078 0.0027 0.0030 3033 TYR 370 CE1 -0.0075 0.0031 0.0032 3034 TYR 370 CZ -0.0074 0.0036 0.0034 3035 TYR 370 OH -0.0071 0.0039 0.0036 3036 TYR 370 HH -0.0069 0.0038 0.0035 3037 TYR 370 CE2 -0.0077 0.0037 0.0034 3038 TYR 370 CD2 -0.0080 0.0034 0.0033 3039 TYR 370 C -0.0077 0.0019 0.0026 3040 TYR 370 O -0.0072 0.0019 0.0027 3041 LEU 371 N -0.0120 0.0004 0.0024 3042 LEU 371 H -0.0127 0.0001 0.0027 3043 LEU 371 CA -0.0113 -0.0004 0.0018 3044 LEU 371 CB -0.0117 -0.0014 0.0018 3045 LEU 371 CG -0.0119 -0.0011 0.0019 3046 LEU 371 CD1 -0.0124 -0.0021 0.0019 3047 LEU 371 CD2 -0.0109 -0.0007 0.0015 3048 LEU 371 C -0.0112 -0.0009 0.0016 3049 LEU 371 O -0.0119 -0.0010 0.0020 3050 ASN 372 N -0.0103 -0.0011 0.0011 3051 ASN 372 H -0.0097 -0.0009 0.0008 3052 ASN 372 CA -0.0100 -0.0015 0.0008 3053 ASN 372 CB -0.0091 -0.0009 0.0005 3054 ASN 372 CG -0.0092 0.0002 0.0009 3055 ASN 372 OD1 -0.0098 0.0004 0.0013 3056 ASN 372 ND2 -0.0086 0.0010 0.0008 3057 ASN 372 1HD2 -0.0086 0.0018 0.0010 3058 ASN 372 2HD2 -0.0081 0.0008 0.0004 3059 ASN 372 C -0.0096 -0.0026 0.0003 3060 ASN 372 O -0.0090 -0.0026 -0.0000 3061 HIS 373 N -0.0147 -0.0027 -0.0003 3062 HIS 373 H -0.0157 -0.0026 0.0002 3063 HIS 373 CA -0.0143 -0.0039 -0.0014 3064 HIS 373 CB -0.0157 -0.0050 -0.0017 3065 HIS 373 CG -0.0154 -0.0063 -0.0029 3066 HIS 373 ND1 -0.0147 -0.0068 -0.0035 3067 HIS 373 CE1 -0.0147 -0.0080 -0.0045 3068 HIS 373 NE2 -0.0152 -0.0082 -0.0045 3069 HIS 373 CD2 -0.0157 -0.0072 -0.0035 3070 HIS 373 C -0.0133 -0.0037 -0.0016 3071 HIS 373 O -0.0137 -0.0033 -0.0011 3072 THR 374 N -0.0120 -0.0041 -0.0024 3073 THR 374 H -0.0117 -0.0044 -0.0028 3074 THR 374 CA -0.0109 -0.0039 -0.0026 3075 THR 374 CB -0.0094 -0.0042 -0.0034 3076 THR 374 CG2 -0.0082 -0.0040 -0.0037 3077 THR 374 OG1 -0.0088 -0.0034 -0.0030 3078 THR 374 HG1 -0.0094 -0.0038 -0.0031 3079 THR 374 C -0.0114 -0.0046 -0.0030 3080 THR 374 O -0.0112 -0.0040 -0.0026 3081 ILE 375 N -0.0131 -0.0063 -0.0041 3082 ILE 375 H -0.0132 -0.0069 -0.0047 3083 ILE 375 CA -0.0139 -0.0065 -0.0044 3084 ILE 375 CB -0.0142 -0.0076 -0.0057 3085 ILE 375 CG2 -0.0152 -0.0078 -0.0061 3086 ILE 375 CG1 -0.0125 -0.0083 -0.0063 3087 ILE 375 CD1 -0.0126 -0.0094 -0.0076 3088 ILE 375 C -0.0155 -0.0058 -0.0038 3089 ILE 375 O -0.0157 -0.0053 -0.0032 3090 THR 376 N -0.0165 -0.0058 -0.0039 3091 THR 376 H -0.0163 -0.0062 -0.0043 3092 THR 376 CA -0.0180 -0.0052 -0.0034 3093 THR 376 CB -0.0193 -0.0057 -0.0042 3094 THR 376 CG2 -0.0195 -0.0068 -0.0055 3095 THR 376 OG1 -0.0189 -0.0058 -0.0042 3096 THR 376 HG1 -0.0198 -0.0060 -0.0046 3097 THR 376 C -0.0182 -0.0041 -0.0021 3098 THR 376 O -0.0192 -0.0035 -0.0015 3099 GLY 377 N -0.0135 -0.0030 -0.0015 3100 GLY 377 H -0.0135 -0.0029 -0.0014 3101 GLY 377 CA -0.0136 -0.0026 -0.0015 3102 GLY 377 C -0.0140 -0.0025 -0.0010 3103 GLY 377 O -0.0141 -0.0022 -0.0010 3104 LYS 378 N -0.0142 -0.0028 -0.0006 3105 LYS 378 H -0.0141 -0.0030 -0.0006 3106 LYS 378 CA -0.0146 -0.0028 -0.0000 3107 LYS 378 CB -0.0147 -0.0033 0.0004 3108 LYS 378 CG -0.0151 -0.0034 0.0009 3109 LYS 378 CD -0.0152 -0.0039 0.0013 3110 LYS 378 CE -0.0156 -0.0040 0.0018 3111 LYS 378 NZ -0.0160 -0.0034 0.0021 3112 LYS 378 HZ1 -0.0162 -0.0036 0.0024 3113 LYS 378 HZ2 -0.0159 -0.0031 0.0018 3114 LYS 378 HZ3 -0.0161 -0.0033 0.0022 3115 LYS 378 C -0.0148 -0.0022 0.0001 3116 LYS 378 O -0.0148 -0.0020 -0.0000 3117 THR 379 N -0.0118 -0.0008 -0.0004 3118 THR 379 H -0.0118 -0.0009 -0.0004 3119 THR 379 CA -0.0121 -0.0002 -0.0004 3120 THR 379 CB -0.0121 0.0003 -0.0006 3121 THR 379 CG2 -0.0116 0.0004 -0.0012 3122 THR 379 OG1 -0.0122 0.0002 -0.0005 3123 THR 379 HG1 -0.0123 0.0006 -0.0005 3124 THR 379 C -0.0126 -0.0002 0.0002 3125 THR 379 O -0.0127 -0.0006 0.0004 3126 SER 380 N -0.0129 0.0002 0.0003 3127 SER 380 H -0.0128 0.0004 0.0000 3128 SER 380 CA -0.0134 0.0003 0.0007 3129 SER 380 CB -0.0136 0.0005 0.0009 3130 SER 380 OG -0.0136 0.0011 0.0006 3131 SER 380 HG -0.0139 0.0013 0.0008 3132 SER 380 C -0.0136 0.0007 0.0007 3133 SER 380 O -0.0133 0.0010 0.0004 3134 LEU 381 N -0.0089 0.0050 -0.0001 3135 LEU 381 H -0.0091 0.0048 -0.0003 3136 LEU 381 CA -0.0091 0.0052 -0.0005 3137 LEU 381 CB -0.0093 0.0054 -0.0011 3138 LEU 381 CG -0.0094 0.0057 -0.0015 3139 LEU 381 CD1 -0.0092 0.0063 -0.0013 3140 LEU 381 CD2 -0.0096 0.0058 -0.0021 3141 LEU 381 C -0.0092 0.0047 -0.0004 3142 LEU 381 O -0.0093 0.0042 -0.0006 3143 PRO 382 N -0.0091 0.0048 -0.0003 3144 PRO 382 CA -0.0091 0.0043 -0.0002 3145 PRO 382 CB -0.0090 0.0046 -0.0000 3146 PRO 382 CG -0.0088 0.0052 0.0003 3147 PRO 382 CD -0.0089 0.0054 -0.0001 3148 PRO 382 C -0.0094 0.0040 -0.0007 3149 PRO 382 O -0.0096 0.0043 -0.0012 3150 LYS 383 N -0.0064 0.0034 0.0014 3151 LYS 383 H -0.0058 0.0030 0.0017 3152 LYS 383 CA -0.0075 0.0033 0.0011 3153 LYS 383 CB -0.0080 0.0021 0.0013 3154 LYS 383 CG -0.0083 0.0014 0.0013 3155 LYS 383 CD -0.0089 0.0002 0.0015 3156 LYS 383 CE -0.0092 -0.0004 0.0016 3157 LYS 383 NZ -0.0098 -0.0016 0.0017 3158 LYS 383 HZ1 -0.0106 -0.0015 0.0013 3159 LYS 383 HZ2 -0.0097 -0.0022 0.0018 3160 LYS 383 HZ3 -0.0094 -0.0019 0.0018 3161 LYS 383 C -0.0074 0.0040 0.0010 3162 LYS 383 O -0.0065 0.0040 0.0013 3163 CYS 384 N -0.0083 0.0045 0.0006 3164 CYS 384 H -0.0090 0.0044 0.0004 3165 CYS 384 CA -0.0084 0.0052 0.0004 3166 CYS 384 CB -0.0095 0.0057 -0.0001 3167 CYS 384 SG -0.0096 0.0068 -0.0004 3168 CYS 384 C -0.0082 0.0045 0.0006 3169 CYS 384 O -0.0088 0.0035 0.0007 3170 TRP 385 N -0.0012 0.0028 0.0022 3171 TRP 385 H -0.0021 0.0027 0.0035 3172 TRP 385 CA -0.0007 0.0011 0.0028 3173 TRP 385 CB -0.0024 0.0009 0.0054 3174 TRP 385 CG -0.0021 -0.0004 0.0060 3175 TRP 385 CD1 -0.0018 -0.0028 0.0074 3176 TRP 385 NE1 -0.0017 -0.0031 0.0075 3177 TRP 385 HE1 -0.0014 -0.0047 0.0084 3178 TRP 385 CE2 -0.0019 -0.0008 0.0060 3179 TRP 385 CZ2 -0.0019 -0.0001 0.0055 3180 TRP 385 CH2 -0.0022 0.0024 0.0039 3181 TRP 385 CZ3 -0.0025 0.0041 0.0029 3182 TRP 385 CE3 -0.0025 0.0034 0.0034 3183 TRP 385 CD2 -0.0022 0.0009 0.0050 3184 TRP 385 C 0.0009 -0.0015 0.0026 3185 TRP 385 O 0.0007 -0.0028 0.0040 3186 LEU 386 N 0.0027 -0.0022 0.0007 3187 LEU 386 H 0.0028 -0.0011 -0.0003 3188 LEU 386 CA 0.0045 -0.0045 -0.0000 3189 LEU 386 CB 0.0063 -0.0044 -0.0025 3190 LEU 386 CG 0.0065 -0.0021 -0.0047 3191 LEU 386 CD1 0.0083 -0.0022 -0.0071 3192 LEU 386 CD2 0.0065 -0.0016 -0.0051 3193 LEU 386 C 0.0046 -0.0071 0.0018 3194 LEU 386 O 0.0039 -0.0073 0.0031 3195 VAL 387 N 0.0091 -0.0098 0.0029 3196 VAL 387 H 0.0089 -0.0090 0.0017 3197 VAL 387 CA 0.0105 -0.0127 0.0056 3198 VAL 387 CB 0.0098 -0.0127 0.0080 3199 VAL 387 CG1 0.0113 -0.0158 0.0108 3200 VAL 387 CG2 0.0070 -0.0098 0.0098 3201 VAL 387 C 0.0131 -0.0152 0.0032 3202 VAL 387 O 0.0136 -0.0147 0.0004 3203 SER 388 N 0.0149 -0.0179 0.0042 3204 SER 388 H 0.0145 -0.0183 0.0064 3205 SER 388 CA 0.0175 -0.0204 0.0022 3206 SER 388 CB 0.0190 -0.0223 0.0019 3207 SER 388 OG 0.0181 -0.0203 -0.0003 3208 SER 388 HG 0.0193 -0.0217 -0.0008 3209 SER 388 C 0.0187 -0.0227 0.0038 3210 SER 388 O 0.0195 -0.0230 0.0019 3211 ASN 389 N 0.0233 -0.0260 0.0087 3212 ASN 389 H 0.0218 -0.0255 0.0094 3213 ASN 389 CA 0.0254 -0.0291 0.0123 3214 ASN 389 CB 0.0298 -0.0319 0.0129 3215 ASN 389 CG 0.0336 -0.0319 0.0085 3216 ASN 389 OD1 0.0358 -0.0326 0.0073 3217 ASN 389 ND2 0.0345 -0.0311 0.0059 3218 ASN 389 1HD2 0.0370 -0.0311 0.0029 3219 ASN 389 2HD2 0.0327 -0.0306 0.0069 3220 ASN 389 C 0.0219 -0.0293 0.0169 3221 ASN 389 O 0.0199 -0.0290 0.0186 3222 GLY 390 N 0.0212 -0.0299 0.0190 3223 GLY 390 H 0.0229 -0.0303 0.0177 3224 GLY 390 CA 0.0178 -0.0302 0.0233 3225 GLY 390 C 0.0141 -0.0276 0.0225 3226 GLY 390 O 0.0107 -0.0272 0.0257 3227 SER 391 N 0.0077 -0.0236 0.0096 3228 SER 391 H 0.0087 -0.0248 0.0073 3229 SER 391 CA 0.0066 -0.0210 0.0118 3230 SER 391 CB 0.0063 -0.0234 0.0141 3231 SER 391 OG 0.0075 -0.0254 0.0115 3232 SER 391 HG 0.0073 -0.0236 0.0111 3233 SER 391 C 0.0067 -0.0177 0.0092 3234 SER 391 O 0.0079 -0.0180 0.0057 3235 TYR 392 N 0.0055 -0.0143 0.0112 3236 TYR 392 H 0.0046 -0.0143 0.0140 3237 TYR 392 CA 0.0053 -0.0107 0.0095 3238 TYR 392 CB 0.0038 -0.0072 0.0123 3239 TYR 392 CG 0.0036 -0.0058 0.0123 3240 TYR 392 CD1 0.0030 -0.0075 0.0150 3241 TYR 392 CE1 0.0028 -0.0062 0.0150 3242 TYR 392 CZ 0.0030 -0.0031 0.0123 3243 TYR 392 OH 0.0028 -0.0018 0.0123 3244 TYR 392 HH 0.0026 -0.0035 0.0142 3245 TYR 392 CE2 0.0035 -0.0013 0.0097 3246 TYR 392 CD2 0.0038 -0.0026 0.0097 3247 TYR 392 C 0.0057 -0.0117 0.0090 3248 TYR 392 O 0.0055 -0.0143 0.0112 3249 LEU 393 N 0.0030 -0.0105 0.0068 3250 LEU 393 H 0.0035 -0.0093 0.0056 3251 LEU 393 CA 0.0033 -0.0099 0.0061 3252 LEU 393 CB 0.0048 -0.0080 0.0034 3253 LEU 393 CG 0.0068 -0.0099 0.0012 3254 LEU 393 CD1 0.0081 -0.0078 -0.0015 3255 LEU 393 CD2 0.0074 -0.0125 0.0011 3256 LEU 393 C 0.0017 -0.0085 0.0081 3257 LEU 393 O 0.0001 -0.0072 0.0098 3258 ASN 394 N 0.0020 -0.0091 0.0078 3259 ASN 394 H 0.0032 -0.0103 0.0064 3260 ASN 394 CA 0.0006 -0.0080 0.0094 3261 ASN 394 CB 0.0012 -0.0096 0.0092 3262 ASN 394 CG 0.0012 -0.0130 0.0103 3263 ASN 394 OD1 -0.0003 -0.0139 0.0126 3264 ASN 394 ND2 0.0028 -0.0151 0.0086 3265 ASN 394 1HD2 0.0029 -0.0174 0.0092 3266 ASN 394 2HD2 0.0039 -0.0144 0.0068 3267 ASN 394 C 0.0004 -0.0046 0.0086 3268 ASN 394 O 0.0017 -0.0034 0.0063 3269 GLU 395 N -0.0030 -0.0045 0.0083 3270 GLU 395 H -0.0036 -0.0050 0.0091 3271 GLU 395 CA -0.0036 -0.0028 0.0078 3272 GLU 395 CB -0.0050 -0.0022 0.0087 3273 GLU 395 CG -0.0061 -0.0025 0.0100 3274 GLU 395 CD -0.0062 -0.0041 0.0110 3275 GLU 395 OE1 -0.0070 -0.0045 0.0120 3276 GLU 395 OE2 -0.0054 -0.0050 0.0108 3277 GLU 395 C -0.0027 -0.0022 0.0066 3278 GLU 395 O -0.0026 -0.0010 0.0058 3279 THR 396 N -0.0021 -0.0030 0.0065 3280 THR 396 H -0.0022 -0.0039 0.0072 3281 THR 396 CA -0.0012 -0.0025 0.0054 3282 THR 396 CB -0.0008 -0.0037 0.0057 3283 THR 396 CG2 0.0001 -0.0032 0.0046 3284 THR 396 OG1 -0.0019 -0.0037 0.0068 3285 THR 396 HG1 -0.0016 -0.0046 0.0070 3286 THR 396 C -0.0000 -0.0024 0.0043 3287 THR 396 O 0.0004 -0.0014 0.0032 3288 HIS 397 N 0.0002 -0.0052 0.0055 3289 HIS 397 H -0.0003 -0.0062 0.0071 3290 HIS 397 CA 0.0015 -0.0052 0.0036 3291 HIS 397 CB 0.0021 -0.0070 0.0046 3292 HIS 397 CG 0.0036 -0.0073 0.0028 3293 HIS 397 ND1 0.0032 -0.0059 0.0020 3294 HIS 397 CE1 0.0050 -0.0068 0.0004 3295 HIS 397 NE2 0.0065 -0.0086 0.0002 3296 HIS 397 CD2 0.0057 -0.0089 0.0016 3297 HIS 397 C 0.0006 -0.0027 0.0024 3298 HIS 397 O 0.0016 -0.0019 0.0002 3299 PHE 398 N -0.0014 -0.0014 0.0038 3300 PHE 398 H -0.0022 -0.0020 0.0056 3301 PHE 398 CA -0.0025 0.0009 0.0030 3302 PHE 398 CB -0.0037 0.0012 0.0044 3303 PHE 398 CG -0.0024 -0.0003 0.0041 3304 PHE 398 CD1 -0.0021 -0.0025 0.0059 3305 PHE 398 CE1 -0.0009 -0.0038 0.0055 3306 PHE 398 CZ 0.0001 -0.0030 0.0034 3307 PHE 398 CE2 -0.0002 -0.0008 0.0016 3308 PHE 398 CD2 -0.0014 0.0005 0.0020 3309 PHE 398 C -0.0038 0.0030 0.0028 3310 PHE 398 O -0.0051 0.0050 0.0026 3311 SER 399 N -0.0049 -0.0001 0.0045 3312 SER 399 H -0.0040 0.0002 0.0046 3313 SER 399 CA -0.0049 -0.0008 0.0032 3314 SER 399 CB -0.0035 -0.0009 0.0024 3315 SER 399 OG -0.0023 -0.0003 0.0029 3316 SER 399 HG -0.0015 -0.0004 0.0024 3317 SER 399 C -0.0060 -0.0015 0.0025 3318 SER 399 O -0.0067 -0.0020 0.0019 3319 ASP 400 N -0.0064 -0.0015 0.0026 3320 ASP 400 H -0.0058 -0.0011 0.0032 3321 ASP 400 CA -0.0075 -0.0021 0.0020 3322 ASP 400 CB -0.0075 -0.0020 0.0022 3323 ASP 400 CG -0.0063 -0.0022 0.0014 3324 ASP 400 OD1 -0.0055 -0.0024 0.0005 3325 ASP 400 OD2 -0.0061 -0.0019 0.0017 3326 ASP 400 C -0.0089 -0.0022 0.0025 3327 ASP 400 O -0.0098 -0.0028 0.0018 3328 ASP 401 N -0.0104 -0.0014 0.0025 3329 ASP 401 H -0.0097 -0.0011 0.0031 3330 ASP 401 CA -0.0116 -0.0012 0.0031 3331 ASP 401 CB -0.0116 -0.0006 0.0045 3332 ASP 401 CG -0.0129 -0.0005 0.0051 3333 ASP 401 OD1 -0.0138 -0.0007 0.0048 3334 ASP 401 OD2 -0.0130 -0.0001 0.0058 3335 ASP 401 C -0.0120 -0.0014 0.0029 3336 ASP 401 O -0.0131 -0.0016 0.0027 3337 ILE 402 N -0.0111 -0.0013 0.0029 3338 ILE 402 H -0.0102 -0.0011 0.0031 3339 ILE 402 CA -0.0113 -0.0014 0.0027 3340 ILE 402 CB -0.0101 -0.0012 0.0029 3341 ILE 402 CG2 -0.0102 -0.0014 0.0025 3342 ILE 402 CG1 -0.0098 -0.0005 0.0042 3343 ILE 402 CD1 -0.0085 -0.0002 0.0045 3344 ILE 402 C -0.0117 -0.0020 0.0015 3345 ILE 402 O -0.0126 -0.0022 0.0013 3346 GLU 403 N -0.0119 -0.0035 0.0022 3347 GLU 403 H -0.0114 -0.0028 0.0024 3348 GLU 403 CA -0.0121 -0.0048 0.0011 3349 GLU 403 CB -0.0114 -0.0049 0.0005 3350 GLU 403 CG -0.0098 -0.0044 -0.0001 3351 GLU 403 CD -0.0091 -0.0045 -0.0006 3352 GLU 403 OE1 -0.0099 -0.0048 -0.0004 3353 GLU 403 OE2 -0.0078 -0.0041 -0.0012 3354 GLU 403 C -0.0136 -0.0056 0.0014 3355 GLU 403 O -0.0141 -0.0066 0.0007 3356 GLN 404 N -0.0145 -0.0050 0.0024 3357 GLN 404 H -0.0141 -0.0042 0.0030 3358 GLN 404 CA -0.0160 -0.0057 0.0029 3359 GLN 404 CB -0.0167 -0.0049 0.0040 3360 GLN 404 CG -0.0162 -0.0049 0.0038 3361 GLN 404 CD -0.0168 -0.0040 0.0050 3362 GLN 404 OE1 -0.0176 -0.0036 0.0060 3363 GLN 404 NE2 -0.0162 -0.0037 0.0049 3364 GLN 404 1HE2 -0.0164 -0.0031 0.0056 3365 GLN 404 2HE2 -0.0154 -0.0040 0.0041 3366 GLN 404 C -0.0167 -0.0059 0.0031 3367 GLN 404 O -0.0177 -0.0069 0.0029 3368 GLN 405 N -0.0156 -0.0036 0.0035 3369 GLN 405 H -0.0151 -0.0030 0.0036 3370 GLN 405 CA -0.0158 -0.0036 0.0036 3371 GLN 405 CB -0.0153 -0.0026 0.0039 3372 GLN 405 CG -0.0157 -0.0016 0.0047 3373 GLN 405 CD -0.0151 -0.0007 0.0048 3374 GLN 405 OE1 -0.0146 -0.0007 0.0045 3375 GLN 405 NE2 -0.0150 0.0003 0.0054 3376 GLN 405 1HE2 -0.0146 0.0009 0.0055 3377 GLN 405 2HE2 -0.0154 0.0003 0.0056 3378 GLN 405 C -0.0154 -0.0044 0.0029 3379 GLN 405 O -0.0159 -0.0049 0.0029 3380 ALA 406 N -0.0145 -0.0046 0.0023 3381 ALA 406 H -0.0140 -0.0042 0.0023 3382 ALA 406 CA -0.0140 -0.0054 0.0016 3383 ALA 406 CB -0.0129 -0.0053 0.0010 3384 ALA 406 C -0.0146 -0.0065 0.0013 3385 ALA 406 O -0.0148 -0.0071 0.0010 3386 ASP 407 N -0.0171 -0.0086 0.0028 3387 ASP 407 H -0.0170 -0.0081 0.0030 3388 ASP 407 CA -0.0177 -0.0096 0.0026 3389 ASP 407 CB -0.0182 -0.0098 0.0028 3390 ASP 407 CG -0.0187 -0.0110 0.0025 3391 ASP 407 OD1 -0.0181 -0.0117 0.0020 3392 ASP 407 OD2 -0.0197 -0.0111 0.0028 3393 ASP 407 C -0.0186 -0.0097 0.0030 3394 ASP 407 O -0.0189 -0.0106 0.0028 3395 ASN 408 N -0.0191 -0.0088 0.0035 3396 ASN 408 H -0.0189 -0.0081 0.0037 3397 ASN 408 CA -0.0200 -0.0088 0.0039 3398 ASN 408 CB -0.0204 -0.0077 0.0046 3399 ASN 408 CG -0.0210 -0.0075 0.0049 3400 ASN 408 OD1 -0.0214 -0.0083 0.0047 3401 ASN 408 ND2 -0.0210 -0.0065 0.0053 3402 ASN 408 1HD2 -0.0213 -0.0063 0.0055 3403 ASN 408 2HD2 -0.0207 -0.0059 0.0054 3404 ASN 408 C -0.0197 -0.0089 0.0037 3405 ASN 408 O -0.0203 -0.0095 0.0038 3406 MET 409 N -0.0203 -0.0075 0.0042 3407 MET 409 H -0.0201 -0.0070 0.0041 3408 MET 409 CA -0.0196 -0.0077 0.0038 3409 MET 409 CB -0.0186 -0.0069 0.0034 3410 MET 409 CG -0.0187 -0.0056 0.0035 3411 MET 409 SD -0.0191 -0.0053 0.0037 3412 MET 409 CE -0.0178 -0.0057 0.0031 3413 MET 409 C -0.0192 -0.0089 0.0036 3414 MET 409 O -0.0192 -0.0094 0.0035 3415 ILE 410 N -0.0191 -0.0095 0.0035 3416 ILE 410 H -0.0192 -0.0091 0.0035 3417 ILE 410 CA -0.0188 -0.0108 0.0033 3418 ILE 410 CB -0.0185 -0.0112 0.0032 3419 ILE 410 CG2 -0.0184 -0.0125 0.0030 3420 ILE 410 CG1 -0.0175 -0.0105 0.0027 3421 ILE 410 CD1 -0.0174 -0.0106 0.0026 3422 ILE 410 C -0.0197 -0.0115 0.0037 3423 ILE 410 O -0.0195 -0.0123 0.0035 3424 THR 411 N -0.0189 -0.0118 0.0046 3425 THR 411 H -0.0193 -0.0108 0.0046 3426 THR 411 CA -0.0199 -0.0128 0.0054 3427 THR 411 CB -0.0215 -0.0121 0.0062 3428 THR 411 CG2 -0.0225 -0.0131 0.0071 3429 THR 411 OG1 -0.0217 -0.0121 0.0064 3430 THR 411 HG1 -0.0212 -0.0113 0.0058 3431 THR 411 C -0.0195 -0.0128 0.0052 3432 THR 411 O -0.0195 -0.0141 0.0055 3433 GLU 412 N -0.0193 -0.0114 0.0047 3434 GLU 412 H -0.0193 -0.0103 0.0044 3435 GLU 412 CA -0.0189 -0.0112 0.0045 3436 GLU 412 CB -0.0188 -0.0094 0.0039 3437 GLU 412 CG -0.0203 -0.0083 0.0045 3438 GLU 412 CD -0.0201 -0.0065 0.0040 3439 GLU 412 OE1 -0.0189 -0.0060 0.0031 3440 GLU 412 OE2 -0.0213 -0.0054 0.0044 3441 GLU 412 C -0.0175 -0.0122 0.0039 3442 GLU 412 O -0.0174 -0.0129 0.0040 3443 MET 413 N -0.0229 -0.0114 0.0056 3444 MET 413 H -0.0238 -0.0108 0.0054 3445 MET 413 CA -0.0239 -0.0114 0.0051 3446 MET 413 CB -0.0263 -0.0108 0.0044 3447 MET 413 CG -0.0273 -0.0124 0.0031 3448 MET 413 SD -0.0301 -0.0118 0.0021 3449 MET 413 CE -0.0304 -0.0122 0.0017 3450 MET 413 C -0.0230 -0.0100 0.0062 3451 MET 413 O -0.0225 -0.0106 0.0061 3452 LEU 414 N -0.0226 -0.0083 0.0073 3453 LEU 414 H -0.0229 -0.0078 0.0073 3454 LEU 414 CA -0.0217 -0.0068 0.0084 3455 LEU 414 CB -0.0216 -0.0048 0.0094 3456 LEU 414 CG -0.0237 -0.0035 0.0091 3457 LEU 414 CD1 -0.0235 -0.0017 0.0101 3458 LEU 414 CD2 -0.0249 -0.0027 0.0090 3459 LEU 414 C -0.0196 -0.0077 0.0089 3460 LEU 414 O -0.0190 -0.0074 0.0093 3461 GLN 415 N -0.0173 -0.0088 0.0084 3462 GLN 415 H -0.0183 -0.0103 0.0076 3463 GLN 415 CA -0.0124 -0.0100 0.0084 3464 GLN 415 CB -0.0092 -0.0127 0.0076 3465 GLN 415 CG -0.0078 -0.0095 0.0091 3466 GLN 415 CD -0.0047 -0.0120 0.0084 3467 GLN 415 OE1 -0.0032 -0.0160 0.0069 3468 GLN 415 NE2 -0.0036 -0.0092 0.0097 3469 GLN 415 1HE2 -0.0014 -0.0105 0.0094 3470 GLN 415 2HE2 -0.0049 -0.0059 0.0109 3471 GLN 415 C -0.0124 -0.0125 0.0074 3472 GLN 415 O -0.0090 -0.0120 0.0080 3473 LYS 416 N -0.0163 -0.0152 0.0058 3474 LYS 416 H -0.0190 -0.0155 0.0054 3475 LYS 416 CA -0.0170 -0.0177 0.0047 3476 LYS 416 CB -0.0215 -0.0209 0.0029 3477 LYS 416 CG -0.0226 -0.0237 0.0015 3478 LYS 416 CD -0.0267 -0.0271 -0.0003 3479 LYS 416 CE -0.0285 -0.0295 -0.0015 3480 LYS 416 NZ -0.0245 -0.0325 -0.0024 3481 LYS 416 HZ1 -0.0226 -0.0342 -0.0029 3482 LYS 416 HZ2 -0.0261 -0.0349 -0.0036 3483 LYS 416 HZ3 -0.0221 -0.0306 -0.0013 3484 LYS 416 C -0.0178 -0.0142 0.0060 3485 LYS 416 O -0.0160 -0.0150 0.0059 3486 GLU 417 N -0.0237 -0.0045 0.0094 3487 GLU 417 H -0.0255 -0.0048 0.0095 3488 GLU 417 CA -0.0259 0.0023 0.0118 3489 GLU 417 CB -0.0321 0.0068 0.0139 3490 GLU 417 CG -0.0404 0.0027 0.0134 3491 GLU 417 CD -0.0464 0.0069 0.0154 3492 GLU 417 OE1 -0.0534 0.0041 0.0152 3493 GLU 417 OE2 -0.0442 0.0129 0.0170 3494 GLU 417 C -0.0188 0.0075 0.0127 3495 GLU 417 O -0.0187 0.0111 0.0139 3496 TYR 418 N -0.0127 0.0079 0.0122 3497 TYR 418 H -0.0130 0.0050 0.0113 3498 TYR 418 CA -0.0055 0.0128 0.0131 3499 TYR 418 CB 0.0003 0.0128 0.0124 3500 TYR 418 CG -0.0029 0.0172 0.0142 3501 TYR 418 CD1 -0.0044 0.0250 0.0168 3502 TYR 418 CE1 -0.0074 0.0290 0.0184 3503 TYR 418 CZ -0.0087 0.0252 0.0173 3504 TYR 418 OH -0.0116 0.0292 0.0189 3505 TYR 418 HH -0.0122 0.0345 0.0206 3506 TYR 418 CE2 -0.0070 0.0174 0.0147 3507 TYR 418 CD2 -0.0041 0.0135 0.0131 3508 TYR 418 C -0.0005 0.0111 0.0120 3509 TYR 418 O 0.0030 0.0165 0.0134 3510 ILE 419 N 0.0044 0.0083 0.0101 3511 ILE 419 H -0.0002 0.0005 0.0088 3512 ILE 419 CA 0.0119 0.0043 0.0083 3513 ILE 419 CB 0.0142 -0.0112 0.0046 3514 ILE 419 CG2 0.0236 -0.0156 0.0026 3515 ILE 419 CG1 0.0003 -0.0199 0.0042 3516 ILE 419 CD1 0.0021 -0.0352 0.0006 3517 ILE 419 C 0.0054 0.0099 0.0103 3518 ILE 419 O 0.0130 0.0130 0.0102 3519 ASP 420 N -0.0089 0.0114 0.0122 3520 ASP 420 H -0.0148 0.0091 0.0123 3521 ASP 420 CA -0.0166 0.0166 0.0142 3522 ASP 420 CB -0.0326 0.0132 0.0152 3523 ASP 420 CG -0.0355 -0.0020 0.0121 3524 ASP 420 OD1 -0.0349 -0.0053 0.0113 3525 ASP 420 OD2 -0.0384 -0.0105 0.0105 3526 ASP 420 C -0.0146 0.0324 0.0175 3527 ASP 420 O -0.0176 0.0397 0.0195 3528 ASP 420 OXT -0.0101 0.0374 0.0182