1 ASN 8 N 0.0149 0.0158 -0.0054 2 ASN 8 CA 0.0150 0.0158 -0.0053 3 ASN 8 C 0.0158 0.0149 -0.0044 4 ASN 8 O 0.0157 0.0145 -0.0041 5 ASN 8 CB 0.0157 0.0170 -0.0058 6 SER 9 N 0.0166 0.0147 -0.0038 7 SER 9 CA 0.0174 0.0139 -0.0029 8 SER 9 C 0.0168 0.0128 -0.0024 9 SER 9 O 0.0163 0.0128 -0.0026 10 SER 9 CB 0.0188 0.0143 -0.0026 11 SER 9 OG 0.0196 0.0137 -0.0018 12 PHE 10 N 0.0168 0.0118 -0.0017 13 PHE 10 CA 0.0163 0.0107 -0.0012 14 PHE 10 C 0.0172 0.0099 -0.0003 15 PHE 10 O 0.0174 0.0096 0.0000 16 PHE 10 CB 0.0149 0.0102 -0.0014 17 PHE 10 CG 0.0140 0.0108 -0.0023 18 PHE 10 CD1 0.0136 0.0110 -0.0026 19 PHE 10 CD2 0.0134 0.0114 -0.0029 20 PHE 10 CE1 0.0127 0.0116 -0.0034 21 PHE 10 CE2 0.0126 0.0120 -0.0038 22 PHE 10 CZ 0.0122 0.0121 -0.0040 23 HIS 11 N 0.0175 0.0098 0.0002 24 HIS 11 CA 0.0185 0.0092 0.0011 25 HIS 11 C 0.0180 0.0080 0.0018 26 HIS 11 O 0.0188 0.0074 0.0026 27 HIS 11 CB 0.0196 0.0097 0.0012 28 HIS 11 CG 0.0200 0.0110 0.0005 29 HIS 11 CD2 0.0194 0.0118 -0.0003 30 HIS 11 ND1 0.0213 0.0115 0.0007 31 HIS 11 CE1 0.0214 0.0126 -0.0000 32 HIS 11 NE2 0.0203 0.0128 -0.0007 33 PHE 12 N 0.0168 0.0076 0.0015 34 PHE 12 CA 0.0162 0.0064 0.0021 35 PHE 12 C 0.0152 0.0059 0.0021 36 PHE 12 O 0.0145 0.0049 0.0024 37 PHE 12 CB 0.0156 0.0064 0.0018 38 PHE 12 CG 0.0165 0.0066 0.0021 39 PHE 12 CD1 0.0171 0.0058 0.0030 40 PHE 12 CD2 0.0167 0.0076 0.0015 41 PHE 12 CE1 0.0180 0.0060 0.0032 42 PHE 12 CE2 0.0176 0.0079 0.0017 43 PHE 12 CZ 0.0182 0.0070 0.0025 44 LYS 13 N 0.0150 0.0064 0.0016 45 LYS 13 CA 0.0140 0.0059 0.0015 46 LYS 13 C 0.0141 0.0048 0.0024 47 LYS 13 O 0.0132 0.0040 0.0025 48 LYS 13 CB 0.0142 0.0067 0.0010 49 LYS 13 CG 0.0133 0.0063 0.0009 50 LYS 13 CD 0.0132 0.0073 0.0002 51 LYS 13 CE 0.0129 0.0069 0.0003 52 LYS 13 NZ 0.0139 0.0064 0.0011 53 GLU 14 N 0.0150 0.0047 0.0030 54 GLU 14 CA 0.0151 0.0037 0.0038 55 GLU 14 C 0.0148 0.0029 0.0043 56 GLU 14 O 0.0143 0.0020 0.0048 57 GLU 14 CB 0.0164 0.0038 0.0043 58 GLU 14 CG 0.0164 0.0041 0.0041 59 GLU 14 CD 0.0161 0.0051 0.0032 60 GLU 14 OE1 0.0168 0.0059 0.0028 61 GLU 14 OE2 0.0152 0.0051 0.0028 62 ALA 15 N 0.0149 0.0032 0.0041 63 ALA 15 CA 0.0145 0.0025 0.0045 64 ALA 15 C 0.0131 0.0021 0.0042 65 ALA 15 O 0.0126 0.0012 0.0047 66 ALA 15 CB 0.0149 0.0030 0.0043 67 TRP 16 N 0.0125 0.0029 0.0034 68 TRP 16 CA 0.0112 0.0026 0.0030 69 TRP 16 C 0.0108 0.0019 0.0034 70 TRP 16 O 0.0100 0.0011 0.0037 71 TRP 16 CB 0.0108 0.0036 0.0021 72 TRP 16 CG 0.0109 0.0043 0.0016 73 TRP 16 CD1 0.0118 0.0052 0.0013 74 TRP 16 CD2 0.0101 0.0042 0.0013 75 TRP 16 CE2 0.0106 0.0051 0.0009 76 TRP 16 CE3 0.0090 0.0035 0.0014 77 TRP 16 NE1 0.0117 0.0056 0.0009 78 TRP 16 CZ2 0.0101 0.0052 0.0005 79 TRP 16 CZ3 0.0085 0.0037 0.0010 80 TRP 16 CH2 0.0090 0.0045 0.0006 81 LYS 17 N 0.0111 0.0022 0.0035 82 LYS 17 CA 0.0107 0.0016 0.0038 83 LYS 17 C 0.0110 0.0006 0.0048 84 LYS 17 O 0.0102 -0.0001 0.0050 85 LYS 17 CB 0.0113 0.0022 0.0036 86 LYS 17 CG 0.0109 0.0031 0.0026 87 LYS 17 CD 0.0116 0.0038 0.0024 88 LYS 17 CE 0.0110 0.0037 0.0021 89 LYS 17 NZ 0.0117 0.0035 0.0027 90 HIS 18 N 0.0120 0.0006 0.0053 91 HIS 18 CA 0.0122 -0.0004 0.0062 92 HIS 18 C 0.0113 -0.0010 0.0063 93 HIS 18 O 0.0109 -0.0019 0.0068 94 HIS 18 CB 0.0134 -0.0002 0.0066 95 HIS 18 CG 0.0139 -0.0010 0.0076 96 HIS 18 CD2 0.0142 -0.0015 0.0081 97 HIS 18 ND1 0.0143 -0.0015 0.0081 98 HIS 18 CE1 0.0147 -0.0022 0.0089 99 HIS 18 NE2 0.0147 -0.0022 0.0089 100 ALA 19 N 0.0110 -0.0005 0.0057 101 ALA 19 CA 0.0101 -0.0011 0.0057 102 ALA 19 C 0.0089 -0.0014 0.0055 103 ALA 19 O 0.0082 -0.0023 0.0059 104 ALA 19 CB 0.0100 -0.0004 0.0052 105 ILE 20 N 0.0083 -0.0010 0.0049 106 ILE 20 CA 0.0073 -0.0012 0.0046 107 ILE 20 C 0.0071 -0.0020 0.0053 108 ILE 20 O 0.0062 -0.0026 0.0055 109 ILE 20 CB 0.0071 -0.0005 0.0038 110 ILE 20 CG1 0.0071 0.0002 0.0030 111 ILE 20 CG2 0.0061 -0.0008 0.0035 112 ILE 20 CD1 0.0075 0.0011 0.0023 113 GLN 21 N 0.0079 -0.0020 0.0058 114 GLN 21 CA 0.0078 -0.0027 0.0065 115 GLN 21 C 0.0078 -0.0034 0.0073 116 GLN 21 O 0.0072 -0.0041 0.0077 117 GLN 21 CB 0.0088 -0.0025 0.0067 118 GLN 21 CG 0.0085 -0.0029 0.0071 119 GLN 21 CD 0.0075 -0.0028 0.0064 120 GLN 21 NE2 0.0068 -0.0034 0.0068 121 GLN 21 OE1 0.0074 -0.0021 0.0056 122 LYS 22 N 0.0084 -0.0033 0.0075 123 LYS 22 CA 0.0084 -0.0040 0.0082 124 LYS 22 C 0.0072 -0.0044 0.0080 125 LYS 22 O 0.0068 -0.0052 0.0086 126 LYS 22 CB 0.0092 -0.0038 0.0083 127 LYS 22 CG 0.0103 -0.0038 0.0090 128 LYS 22 CD 0.0105 -0.0046 0.0099 129 LYS 22 CE 0.0116 -0.0044 0.0102 130 ALA 23 N 0.0065 -0.0037 0.0073 131 ALA 23 CA 0.0055 -0.0040 0.0070 132 ALA 23 C 0.0046 -0.0046 0.0071 133 ALA 23 O 0.0039 -0.0052 0.0074 134 ALA 23 CB 0.0053 -0.0034 0.0060 135 LYS 24 N 0.0046 -0.0044 0.0068 136 LYS 24 CA 0.0038 -0.0049 0.0069 137 LYS 24 C 0.0037 -0.0057 0.0079 138 LYS 24 O 0.0028 -0.0062 0.0080 139 LYS 24 CB 0.0040 -0.0045 0.0066 140 LYS 24 CG 0.0033 -0.0042 0.0056 141 LYS 24 CD 0.0036 -0.0038 0.0054 142 LYS 24 CE 0.0043 -0.0029 0.0047 143 LYS 24 NZ 0.0048 -0.0025 0.0045 144 HIS 25 N 0.0045 -0.0058 0.0086 145 HIS 25 CA 0.0045 -0.0065 0.0096 146 HIS 25 C 0.0045 -0.0069 0.0101 147 HIS 25 O 0.0047 -0.0074 0.0110 148 HIS 25 CB 0.0053 -0.0065 0.0102 149 HIS 25 CG 0.0054 -0.0061 0.0097 150 HIS 25 CD2 0.0062 -0.0056 0.0096 151 HIS 25 ND1 0.0045 -0.0064 0.0094 152 HIS 25 CE1 0.0047 -0.0060 0.0091 153 HIS 25 NE2 0.0057 -0.0055 0.0092 154 MET 26 N 0.0043 -0.0054 0.0086 155 MET 26 CA 0.0041 -0.0060 0.0092 156 MET 26 C 0.0025 -0.0066 0.0096 157 MET 26 O 0.0014 -0.0061 0.0089 158 MET 26 CB 0.0044 -0.0054 0.0086 159 MET 26 CG 0.0050 -0.0060 0.0093 160 MET 26 SD 0.0070 -0.0061 0.0097 161 MET 26 CE 0.0076 -0.0065 0.0103 162 PRO 27 N 0.0024 -0.0077 0.0106 163 PRO 27 CA 0.0009 -0.0083 0.0111 164 PRO 27 C -0.0000 -0.0081 0.0107 165 PRO 27 O 0.0006 -0.0079 0.0106 166 PRO 27 CB 0.0012 -0.0094 0.0123 167 PRO 27 CG 0.0027 -0.0094 0.0125 168 PRO 27 CD 0.0036 -0.0083 0.0115 169 ASP 28 N -0.0015 -0.0082 0.0106 170 ASP 28 CA -0.0025 -0.0080 0.0103 171 ASP 28 C -0.0025 -0.0090 0.0113 172 ASP 28 O -0.0030 -0.0099 0.0121 173 ASP 28 CB -0.0041 -0.0079 0.0099 174 ASP 28 CG -0.0052 -0.0078 0.0096 175 ASP 28 OD1 -0.0046 -0.0075 0.0095 176 ASP 28 OD2 -0.0066 -0.0078 0.0095 177 PRO 29 N -0.0017 -0.0076 0.0112 178 PRO 29 CA -0.0014 -0.0080 0.0125 179 PRO 29 C -0.0028 -0.0085 0.0129 180 PRO 29 O -0.0027 -0.0090 0.0142 181 PRO 29 CB -0.0000 -0.0075 0.0119 182 PRO 29 CG -0.0003 -0.0068 0.0102 183 PRO 29 CD -0.0008 -0.0068 0.0099 184 TRP 30 N -0.0041 -0.0085 0.0119 185 TRP 30 CA -0.0055 -0.0089 0.0122 186 TRP 30 C -0.0069 -0.0094 0.0125 187 TRP 30 O -0.0083 -0.0097 0.0123 188 TRP 30 CB -0.0059 -0.0085 0.0108 189 TRP 30 CG -0.0048 -0.0082 0.0108 190 TRP 30 CD1 -0.0034 -0.0083 0.0118 191 TRP 30 CD2 -0.0049 -0.0078 0.0096 192 TRP 30 CE2 -0.0036 -0.0076 0.0100 193 TRP 30 CE3 -0.0059 -0.0075 0.0083 194 TRP 30 NE1 -0.0027 -0.0079 0.0113 195 TRP 30 CZ2 -0.0033 -0.0072 0.0092 196 TRP 30 CZ3 -0.0057 -0.0071 0.0075 197 TRP 30 CH2 -0.0044 -0.0070 0.0079 198 ALA 31 N -0.0067 -0.0095 0.0128 199 ALA 31 CA -0.0080 -0.0099 0.0130 200 ALA 31 C -0.0091 -0.0107 0.0143 201 ALA 31 O -0.0105 -0.0110 0.0141 202 ALA 31 CB -0.0074 -0.0099 0.0134 203 GLU 32 N -0.0085 -0.0104 0.0162 204 GLU 32 CA -0.0092 -0.0110 0.0174 205 GLU 32 C -0.0099 -0.0111 0.0170 206 GLU 32 O -0.0105 -0.0115 0.0180 207 GLU 32 CB -0.0082 -0.0110 0.0187 208 GLU 32 CG -0.0073 -0.0108 0.0190 209 GLU 32 CD -0.0081 -0.0112 0.0192 210 GLU 32 OE1 -0.0088 -0.0117 0.0203 211 GLU 32 OE2 -0.0081 -0.0109 0.0183 212 PHE 33 N -0.0097 -0.0107 0.0158 213 PHE 33 CA -0.0104 -0.0108 0.0154 214 PHE 33 C -0.0118 -0.0109 0.0145 215 PHE 33 O -0.0126 -0.0111 0.0142 216 PHE 33 CB -0.0094 -0.0102 0.0145 217 PHE 33 CG -0.0080 -0.0100 0.0154 218 PHE 33 CD1 -0.0080 -0.0104 0.0166 219 PHE 33 CD2 -0.0067 -0.0095 0.0149 220 PHE 33 CE1 -0.0067 -0.0102 0.0174 221 PHE 33 CE2 -0.0054 -0.0094 0.0156 222 PHE 33 CZ -0.0054 -0.0097 0.0169 223 HIS 34 N -0.0121 -0.0109 0.0140 224 HIS 34 CA -0.0135 -0.0112 0.0134 225 HIS 34 C -0.0140 -0.0110 0.0121 226 HIS 34 O -0.0152 -0.0113 0.0121 227 HIS 34 CB -0.0146 -0.0118 0.0145 228 HIS 34 CG -0.0142 -0.0120 0.0157 229 HIS 34 CD2 -0.0138 -0.0123 0.0171 230 HIS 34 ND1 -0.0142 -0.0120 0.0155 231 HIS 34 CE1 -0.0138 -0.0122 0.0167 232 HIS 34 NE2 -0.0135 -0.0124 0.0177 233 LEU 35 N -0.0129 -0.0104 0.0113 234 LEU 35 CA -0.0132 -0.0101 0.0100 235 LEU 35 C -0.0142 -0.0101 0.0090 236 LEU 35 O -0.0150 -0.0101 0.0081 237 LEU 35 CB -0.0120 -0.0094 0.0094 238 LEU 35 CG -0.0109 -0.0093 0.0103 239 LEU 35 CD1 -0.0095 -0.0087 0.0097 240 LEU 35 CD2 -0.0114 -0.0096 0.0104 241 GLU 36 N -0.0142 -0.0101 0.0091 242 GLU 36 CA -0.0152 -0.0101 0.0082 243 GLU 36 C -0.0167 -0.0108 0.0084 244 GLU 36 O -0.0176 -0.0108 0.0075 245 GLU 36 CB -0.0148 -0.0101 0.0084 246 GLU 36 CG -0.0133 -0.0094 0.0081 247 GLU 36 CD -0.0123 -0.0095 0.0094 248 GLU 36 OE1 -0.0124 -0.0099 0.0103 249 GLU 36 OE2 -0.0114 -0.0093 0.0095 250 ASP 37 N -0.0169 -0.0113 0.0097 251 ASP 37 CA -0.0183 -0.0119 0.0100 252 ASP 37 C -0.0188 -0.0119 0.0095 253 ASP 37 O -0.0201 -0.0124 0.0096 254 ASP 37 CB -0.0183 -0.0124 0.0116 255 ASP 37 CG -0.0176 -0.0124 0.0122 256 ASP 37 OD1 -0.0176 -0.0122 0.0115 257 ASP 37 OD2 -0.0172 -0.0127 0.0135 258 ILE 38 N -0.0180 -0.0113 0.0092 259 ILE 38 CA -0.0184 -0.0112 0.0087 260 ILE 38 C -0.0192 -0.0111 0.0074 261 ILE 38 O -0.0188 -0.0107 0.0065 262 ILE 38 CB -0.0171 -0.0108 0.0086 263 ILE 38 CG1 -0.0164 -0.0110 0.0101 264 ILE 38 CG2 -0.0175 -0.0107 0.0080 265 ILE 38 CD1 -0.0150 -0.0106 0.0100 266 ALA 39 N -0.0203 -0.0113 0.0072 267 ALA 39 CA -0.0211 -0.0112 0.0059 268 ALA 39 C -0.0202 -0.0106 0.0047 269 ALA 39 O -0.0194 -0.0104 0.0048 270 ALA 39 CB -0.0222 -0.0116 0.0059 271 THR 40 N -0.0204 -0.0103 0.0037 272 THR 40 CA -0.0196 -0.0098 0.0025 273 THR 40 C -0.0199 -0.0097 0.0018 274 THR 40 O -0.0211 -0.0100 0.0016 275 THR 40 CB -0.0198 -0.0095 0.0016 276 THR 40 CG2 -0.0187 -0.0089 0.0006 277 THR 40 OG1 -0.0197 -0.0097 0.0024 278 GLU 41 N -0.0187 -0.0090 0.0015 279 GLU 41 CA -0.0188 -0.0089 0.0007 280 GLU 41 C -0.0182 -0.0083 -0.0007 281 GLU 41 O -0.0173 -0.0080 -0.0008 282 GLU 41 CB -0.0181 -0.0088 0.0014 283 GLU 41 CG -0.0188 -0.0093 0.0026 284 GLU 41 CD -0.0181 -0.0093 0.0031 285 GLU 41 OE1 -0.0182 -0.0091 0.0023 286 GLU 41 OE2 -0.0176 -0.0094 0.0043 287 ARG 42 N -0.0186 -0.0082 -0.0018 288 ARG 42 CA -0.0182 -0.0077 -0.0032 289 ARG 42 C -0.0172 -0.0073 -0.0035 290 ARG 42 O -0.0174 -0.0075 -0.0031 291 ARG 42 CB -0.0195 -0.0079 -0.0042 292 ARG 42 CG -0.0206 -0.0084 -0.0037 293 ARG 42 CD -0.0220 -0.0087 -0.0043 294 ARG 42 NE -0.0222 -0.0083 -0.0058 295 ARG 42 CZ -0.0226 -0.0083 -0.0064 296 ARG 42 NH1 -0.0231 -0.0086 -0.0058 297 ARG 42 NH2 -0.0227 -0.0080 -0.0078 298 ALA 43 N -0.0161 -0.0068 -0.0042 299 ALA 43 CA -0.0151 -0.0064 -0.0045 300 ALA 43 C -0.0146 -0.0059 -0.0059 301 ALA 43 O -0.0147 -0.0058 -0.0064 302 ALA 43 CB -0.0140 -0.0063 -0.0033 303 THR 44 N -0.0135 -0.0053 -0.0058 304 THR 44 CA -0.0128 -0.0048 -0.0070 305 THR 44 C -0.0112 -0.0044 -0.0067 306 THR 44 O -0.0107 -0.0044 -0.0061 307 THR 44 CB -0.0131 -0.0048 -0.0081 308 THR 44 CG2 -0.0124 -0.0044 -0.0095 309 THR 44 OG1 -0.0146 -0.0052 -0.0084 310 ARG 45 N -0.0105 -0.0042 -0.0070 311 ARG 45 CA -0.0091 -0.0038 -0.0066 312 ARG 45 C -0.0083 -0.0034 -0.0079 313 ARG 45 O -0.0085 -0.0033 -0.0091 314 ARG 45 CB -0.0087 -0.0038 -0.0062 315 ARG 45 CG -0.0072 -0.0034 -0.0059 316 ARG 45 CD -0.0069 -0.0034 -0.0054 317 ARG 45 NE -0.0075 -0.0034 -0.0064 318 ARG 45 CZ -0.0074 -0.0034 -0.0062 319 ARG 45 NH1 -0.0068 -0.0034 -0.0050 320 ARG 45 NH2 -0.0079 -0.0034 -0.0072 321 HIS 46 N -0.0073 -0.0031 -0.0077 322 HIS 46 CA -0.0063 -0.0027 -0.0087 323 HIS 46 C -0.0050 -0.0023 -0.0082 324 HIS 46 O -0.0044 -0.0023 -0.0071 325 HIS 46 CB -0.0063 -0.0026 -0.0089 326 HIS 46 CG -0.0076 -0.0030 -0.0090 327 HIS 46 CD2 -0.0084 -0.0031 -0.0101 328 HIS 46 ND1 -0.0083 -0.0034 -0.0078 329 HIS 46 CE1 -0.0095 -0.0037 -0.0082 330 HIS 46 NE2 -0.0096 -0.0035 -0.0096 331 ARG 47 N -0.0039 -0.0020 -0.0079 332 ARG 47 CA -0.0032 -0.0019 -0.0078 333 ARG 47 C -0.0024 -0.0019 -0.0086 334 ARG 47 O -0.0026 -0.0022 -0.0094 335 ARG 47 CB -0.0037 -0.0020 -0.0079 336 ARG 47 CG -0.0042 -0.0019 -0.0071 337 ARG 47 CD -0.0047 -0.0020 -0.0072 338 ARG 47 NE -0.0054 -0.0023 -0.0080 339 ARG 47 CZ -0.0059 -0.0025 -0.0082 340 ARG 47 NH1 -0.0058 -0.0023 -0.0078 341 ARG 47 NH2 -0.0065 -0.0027 -0.0089 342 TYR 48 N -0.0016 -0.0017 -0.0084 343 TYR 48 CA -0.0007 -0.0017 -0.0089 344 TYR 48 C -0.0002 -0.0017 -0.0093 345 TYR 48 O -0.0001 -0.0016 -0.0088 346 TYR 48 CB -0.0001 -0.0015 -0.0084 347 TYR 48 CG 0.0009 -0.0014 -0.0088 348 TYR 48 CD1 0.0009 -0.0016 -0.0096 349 TYR 48 CD2 0.0017 -0.0012 -0.0085 350 TYR 48 CE1 0.0018 -0.0015 -0.0100 351 TYR 48 CE2 0.0026 -0.0011 -0.0089 352 TYR 48 CZ 0.0026 -0.0013 -0.0097 353 TYR 48 OH 0.0035 -0.0013 -0.0101 354 ASN 49 N 0.0002 -0.0018 -0.0101 355 ASN 49 CA 0.0009 -0.0018 -0.0106 356 ASN 49 C 0.0019 -0.0017 -0.0107 357 ASN 49 O 0.0020 -0.0018 -0.0112 358 ASN 49 CB 0.0005 -0.0021 -0.0115 359 ASN 49 CG 0.0011 -0.0021 -0.0119 360 ASN 49 ND2 0.0006 -0.0023 -0.0123 361 ASN 49 OD1 0.0020 -0.0019 -0.0118 362 ALA 50 N 0.0020 -0.0015 -0.0091 363 ALA 50 CA 0.0033 -0.0012 -0.0092 364 ALA 50 C 0.0042 -0.0013 -0.0103 365 ALA 50 O 0.0052 -0.0012 -0.0106 366 ALA 50 CB 0.0039 -0.0007 -0.0079 367 VAL 51 N 0.0038 -0.0016 -0.0108 368 VAL 51 CA 0.0045 -0.0017 -0.0119 369 VAL 51 C 0.0043 -0.0021 -0.0131 370 VAL 51 O 0.0052 -0.0022 -0.0138 371 VAL 51 CB 0.0043 -0.0019 -0.0122 372 VAL 51 CG1 0.0050 -0.0020 -0.0133 373 VAL 51 CG2 0.0045 -0.0015 -0.0110 374 THR 52 N 0.0031 -0.0025 -0.0132 375 THR 52 CA 0.0026 -0.0029 -0.0142 376 THR 52 C 0.0026 -0.0028 -0.0139 377 THR 52 O 0.0025 -0.0030 -0.0147 378 THR 52 CB 0.0013 -0.0033 -0.0146 379 THR 52 CG2 0.0013 -0.0033 -0.0148 380 THR 52 OG1 0.0004 -0.0032 -0.0136 381 GLY 53 N 0.0026 -0.0024 -0.0137 382 GLY 53 CA 0.0025 -0.0023 -0.0133 383 GLY 53 C 0.0015 -0.0026 -0.0135 384 GLY 53 O 0.0014 -0.0026 -0.0137 385 GLU 54 N 0.0007 -0.0027 -0.0134 386 GLU 54 CA -0.0003 -0.0030 -0.0137 387 GLU 54 C -0.0011 -0.0029 -0.0128 388 GLU 54 O -0.0010 -0.0028 -0.0122 389 GLU 54 CB -0.0006 -0.0033 -0.0146 390 GLU 54 CG -0.0001 -0.0034 -0.0156 391 GLU 54 CD -0.0002 -0.0037 -0.0164 392 GLU 54 OE1 -0.0009 -0.0037 -0.0163 393 GLU 54 OE2 0.0003 -0.0037 -0.0172 394 TRP 55 N -0.0018 -0.0031 -0.0128 395 TRP 55 CA -0.0026 -0.0031 -0.0120 396 TRP 55 C -0.0036 -0.0034 -0.0124 397 TRP 55 O -0.0039 -0.0036 -0.0132 398 TRP 55 CB -0.0027 -0.0030 -0.0116 399 TRP 55 CG -0.0019 -0.0026 -0.0109 400 TRP 55 CD1 -0.0010 -0.0025 -0.0112 401 TRP 55 CD2 -0.0019 -0.0023 -0.0098 402 TRP 55 CE2 -0.0010 -0.0021 -0.0095 403 TRP 55 CE3 -0.0026 -0.0023 -0.0091 404 TRP 55 NE1 -0.0004 -0.0022 -0.0103 405 TRP 55 CZ2 -0.0007 -0.0018 -0.0085 406 TRP 55 CZ3 -0.0024 -0.0020 -0.0081 407 TRP 55 CH2 -0.0014 -0.0017 -0.0078 408 LEU 56 N -0.0047 -0.0020 -0.0130 409 LEU 56 CA -0.0058 -0.0022 -0.0133 410 LEU 56 C -0.0067 -0.0025 -0.0122 411 LEU 56 O -0.0063 -0.0026 -0.0111 412 LEU 56 CB -0.0054 -0.0021 -0.0134 413 LEU 56 CG -0.0065 -0.0024 -0.0133 414 LEU 56 CD1 -0.0072 -0.0024 -0.0145 415 LEU 56 CD2 -0.0060 -0.0023 -0.0127 416 ASP 57 N -0.0079 -0.0027 -0.0125 417 ASP 57 CA -0.0088 -0.0030 -0.0116 418 ASP 57 C -0.0098 -0.0032 -0.0117 419 ASP 57 O -0.0101 -0.0031 -0.0128 420 ASP 57 CB -0.0095 -0.0031 -0.0117 421 ASP 57 CG -0.0103 -0.0032 -0.0128 422 ASP 57 OD1 -0.0098 -0.0030 -0.0139 423 ASP 57 OD2 -0.0115 -0.0034 -0.0127 424 ASP 58 N -0.0104 -0.0034 -0.0106 425 ASP 58 CA -0.0114 -0.0036 -0.0106 426 ASP 58 C -0.0122 -0.0039 -0.0095 427 ASP 58 O -0.0120 -0.0039 -0.0088 428 ASP 58 CB -0.0109 -0.0035 -0.0106 429 ASP 58 CG -0.0100 -0.0035 -0.0094 430 ASP 58 OD1 -0.0096 -0.0034 -0.0089 431 ASP 58 OD2 -0.0098 -0.0035 -0.0090 432 GLU 59 N -0.0136 -0.0043 -0.0098 433 GLU 59 CA -0.0144 -0.0048 -0.0088 434 GLU 59 C -0.0141 -0.0050 -0.0078 435 GLU 59 O -0.0139 -0.0049 -0.0080 436 GLU 59 CB -0.0158 -0.0051 -0.0094 437 GLU 59 CG -0.0162 -0.0049 -0.0106 438 GLU 59 CD -0.0164 -0.0050 -0.0104 439 GLU 59 OE1 -0.0175 -0.0055 -0.0102 440 GLU 59 OE2 -0.0155 -0.0047 -0.0106 441 VAL 60 N -0.0140 -0.0053 -0.0066 442 VAL 60 CA -0.0136 -0.0055 -0.0054 443 VAL 60 C -0.0145 -0.0060 -0.0044 444 VAL 60 O -0.0153 -0.0063 -0.0045 445 VAL 60 CB -0.0123 -0.0052 -0.0048 446 VAL 60 CG1 -0.0113 -0.0046 -0.0058 447 VAL 60 CG2 -0.0123 -0.0053 -0.0043 448 LEU 61 N -0.0145 -0.0063 -0.0035 449 LEU 61 CA -0.0153 -0.0068 -0.0025 450 LEU 61 C -0.0144 -0.0069 -0.0012 451 LEU 61 O -0.0135 -0.0066 -0.0010 452 LEU 61 CB -0.0160 -0.0071 -0.0025 453 LEU 61 CG -0.0170 -0.0071 -0.0037 454 LEU 61 CD1 -0.0176 -0.0072 -0.0037 455 LEU 61 CD2 -0.0180 -0.0074 -0.0037 456 ILE 62 N -0.0148 -0.0074 -0.0005 457 ILE 62 CA -0.0140 -0.0075 0.0008 458 ILE 62 C -0.0148 -0.0081 0.0020 459 ILE 62 O -0.0160 -0.0085 0.0019 460 ILE 62 CB -0.0133 -0.0072 0.0007 461 ILE 62 CG1 -0.0143 -0.0075 0.0007 462 ILE 62 CG2 -0.0125 -0.0066 -0.0006 463 ILE 62 CD1 -0.0137 -0.0075 0.0013 464 LYS 63 N -0.0141 -0.0082 0.0032 465 LYS 63 CA -0.0146 -0.0087 0.0046 466 LYS 63 C -0.0136 -0.0086 0.0054 467 LYS 63 O -0.0125 -0.0083 0.0059 468 LYS 63 CB -0.0148 -0.0089 0.0052 469 LYS 63 CG -0.0160 -0.0092 0.0045 470 LYS 63 CD -0.0161 -0.0094 0.0052 471 LYS 63 CE -0.0173 -0.0097 0.0045 472 LYS 63 NZ -0.0186 -0.0103 0.0050 473 MET 64 N -0.0139 -0.0088 0.0057 474 MET 64 CA -0.0129 -0.0086 0.0064 475 MET 64 C -0.0133 -0.0091 0.0078 476 MET 64 O -0.0145 -0.0096 0.0080 477 MET 64 CB -0.0128 -0.0083 0.0056 478 MET 64 CG -0.0119 -0.0082 0.0063 479 MET 64 SD -0.0118 -0.0079 0.0053 480 MET 64 CE -0.0113 -0.0073 0.0037 481 ALA 65 N -0.0126 -0.0091 0.0089 482 ALA 65 CA -0.0129 -0.0096 0.0105 483 ALA 65 C -0.0135 -0.0098 0.0105 484 ALA 65 O -0.0131 -0.0094 0.0095 485 ALA 65 CB -0.0114 -0.0094 0.0116 486 SER 66 N -0.0145 -0.0104 0.0116 487 SER 66 CA -0.0152 -0.0106 0.0117 488 SER 66 C -0.0141 -0.0105 0.0125 489 SER 66 O -0.0144 -0.0105 0.0123 490 SER 66 CB -0.0167 -0.0113 0.0126 491 SER 66 OG -0.0165 -0.0116 0.0140 492 GLN 67 N -0.0130 -0.0104 0.0135 493 GLN 67 CA -0.0119 -0.0102 0.0144 494 GLN 67 C -0.0102 -0.0096 0.0141 495 GLN 67 O -0.0098 -0.0094 0.0139 496 GLN 67 CB -0.0121 -0.0107 0.0162 497 GLN 67 CG -0.0137 -0.0114 0.0166 498 GLN 67 CD -0.0140 -0.0113 0.0159 499 GLN 67 NE2 -0.0155 -0.0116 0.0154 500 GLN 67 OE1 -0.0129 -0.0109 0.0159 501 PRO 68 N -0.0094 -0.0089 0.0142 502 PRO 68 CA -0.0078 -0.0084 0.0138 503 PRO 68 C -0.0070 -0.0083 0.0152 504 PRO 68 O -0.0073 -0.0087 0.0166 505 PRO 68 CB -0.0069 -0.0081 0.0137 506 PRO 68 CG -0.0083 -0.0084 0.0133 507 PRO 68 CD -0.0096 -0.0089 0.0143 508 PHE 69 N -0.0058 -0.0080 0.0146 509 PHE 69 CA -0.0048 -0.0079 0.0158 510 PHE 69 C -0.0032 -0.0075 0.0162 511 PHE 69 O -0.0024 -0.0074 0.0174 512 PHE 69 CB -0.0045 -0.0077 0.0152 513 PHE 69 CG -0.0036 -0.0072 0.0136 514 PHE 69 CD1 -0.0044 -0.0072 0.0121 515 PHE 69 CD2 -0.0020 -0.0068 0.0137 516 PHE 69 CE1 -0.0036 -0.0067 0.0107 517 PHE 69 CE2 -0.0012 -0.0063 0.0122 518 PHE 69 CZ -0.0020 -0.0063 0.0107 519 GLY 70 N -0.0027 -0.0072 0.0151 520 GLY 70 CA -0.0013 -0.0068 0.0154 521 GLY 70 C -0.0014 -0.0067 0.0144 522 GLY 70 O -0.0023 -0.0067 0.0131 523 ARG 71 N -0.0008 -0.0058 0.0145 524 ARG 71 CA -0.0008 -0.0056 0.0136 525 ARG 71 C 0.0009 -0.0052 0.0137 526 ARG 71 O 0.0017 -0.0052 0.0149 527 ARG 71 CB -0.0019 -0.0061 0.0142 528 ARG 71 CG -0.0012 -0.0062 0.0156 529 ARG 71 CD -0.0017 -0.0063 0.0156 530 ARG 71 NE -0.0007 -0.0058 0.0146 531 ARG 71 CZ -0.0007 -0.0058 0.0145 532 ARG 71 NH1 -0.0017 -0.0063 0.0153 533 ARG 71 NH2 0.0001 -0.0053 0.0135 534 GLY 72 N 0.0014 -0.0047 0.0123 535 GLY 72 CA 0.0029 -0.0043 0.0123 536 GLY 72 C 0.0027 -0.0044 0.0123 537 GLY 72 O 0.0016 -0.0048 0.0129 538 ALA 73 N 0.0038 -0.0039 0.0116 539 ALA 73 CA 0.0037 -0.0039 0.0116 540 ALA 73 C 0.0025 -0.0040 0.0103 541 ALA 73 O 0.0018 -0.0042 0.0105 542 ALA 73 CB 0.0053 -0.0034 0.0113 543 MET 74 N 0.0025 -0.0038 0.0091 544 MET 74 CA 0.0015 -0.0037 0.0077 545 MET 74 C -0.0000 -0.0040 0.0074 546 MET 74 O -0.0013 -0.0042 0.0067 547 MET 74 CB 0.0025 -0.0031 0.0062 548 MET 74 CG 0.0038 -0.0027 0.0063 549 MET 74 SD 0.0032 -0.0029 0.0063 550 MET 74 CE 0.0022 -0.0027 0.0043 551 ARG 75 N 0.0001 -0.0041 0.0078 552 ARG 75 CA -0.0012 -0.0043 0.0073 553 ARG 75 C -0.0016 -0.0048 0.0087 554 ARG 75 O -0.0006 -0.0048 0.0099 555 ARG 75 CB -0.0007 -0.0038 0.0059 556 ARG 75 CG -0.0006 -0.0034 0.0043 557 ARG 75 CD -0.0001 -0.0029 0.0029 558 ARG 75 NE 0.0014 -0.0026 0.0034 559 ARG 75 CZ 0.0021 -0.0022 0.0024 560 ARG 75 NH1 0.0013 -0.0021 0.0010 561 ARG 75 NH2 0.0034 -0.0020 0.0030 562 GLU 76 N -0.0031 -0.0051 0.0086 563 GLU 76 CA -0.0036 -0.0056 0.0097 564 GLU 76 C -0.0039 -0.0054 0.0088 565 GLU 76 O -0.0044 -0.0052 0.0073 566 GLU 76 CB -0.0052 -0.0062 0.0105 567 GLU 76 CG -0.0065 -0.0062 0.0092 568 GLU 76 CD -0.0080 -0.0068 0.0101 569 GLU 76 OE1 -0.0079 -0.0072 0.0116 570 GLU 76 OE2 -0.0092 -0.0069 0.0092 571 CYS 77 N -0.0039 -0.0064 0.0098 572 CYS 77 CA -0.0040 -0.0063 0.0092 573 CYS 77 C -0.0052 -0.0068 0.0097 574 CYS 77 O -0.0055 -0.0071 0.0110 575 CYS 77 CB -0.0026 -0.0060 0.0095 576 CYS 77 SG -0.0010 -0.0054 0.0092 577 PHE 78 N -0.0060 -0.0067 0.0087 578 PHE 78 CA -0.0072 -0.0072 0.0090 579 PHE 78 C -0.0069 -0.0070 0.0085 580 PHE 78 O -0.0064 -0.0066 0.0073 581 PHE 78 CB -0.0086 -0.0074 0.0082 582 PHE 78 CG -0.0090 -0.0075 0.0085 583 PHE 78 CD1 -0.0084 -0.0072 0.0078 584 PHE 78 CD2 -0.0100 -0.0081 0.0096 585 PHE 78 CE1 -0.0087 -0.0074 0.0081 586 PHE 78 CE2 -0.0103 -0.0082 0.0099 587 PHE 78 CZ -0.0097 -0.0079 0.0091 588 ARG 79 N -0.0073 -0.0073 0.0094 589 ARG 79 CA -0.0072 -0.0072 0.0090 590 ARG 79 C -0.0085 -0.0073 0.0079 591 ARG 79 O -0.0097 -0.0076 0.0080 592 ARG 79 CB -0.0073 -0.0075 0.0103 593 ARG 79 CG -0.0061 -0.0074 0.0115 594 ARG 79 CD -0.0061 -0.0077 0.0127 595 ARG 79 NE -0.0050 -0.0076 0.0138 596 ARG 79 CZ -0.0052 -0.0079 0.0151 597 ARG 79 NH1 -0.0065 -0.0084 0.0154 598 ARG 79 NH2 -0.0041 -0.0078 0.0161 599 THR 80 N -0.0081 -0.0073 0.0067 600 THR 80 CA -0.0090 -0.0073 0.0056 601 THR 80 C -0.0087 -0.0071 0.0052 602 THR 80 O -0.0076 -0.0068 0.0054 603 THR 80 CB -0.0090 -0.0069 0.0044 604 THR 80 CG2 -0.0101 -0.0070 0.0033 605 THR 80 OG1 -0.0091 -0.0071 0.0048 606 LYS 81 N -0.0098 -0.0073 0.0048 607 LYS 81 CA -0.0097 -0.0071 0.0041 608 LYS 81 C -0.0103 -0.0068 0.0027 609 LYS 81 O -0.0113 -0.0071 0.0025 610 LYS 81 CB -0.0103 -0.0075 0.0048 611 LYS 81 CG -0.0095 -0.0076 0.0060 612 LYS 81 CD -0.0100 -0.0079 0.0065 613 LYS 81 CE -0.0093 -0.0081 0.0077 614 LYS 81 NZ -0.0080 -0.0075 0.0075 615 LYS 82 N -0.0097 -0.0063 0.0018 616 LYS 82 CA -0.0102 -0.0061 0.0004 617 LYS 82 C -0.0101 -0.0058 -0.0003 618 LYS 82 O -0.0091 -0.0056 -0.0000 619 LYS 82 CB -0.0094 -0.0056 -0.0003 620 LYS 82 CG -0.0100 -0.0054 -0.0017 621 LYS 82 CD -0.0092 -0.0049 -0.0024 622 LYS 82 CE -0.0078 -0.0044 -0.0025 623 LYS 82 NZ -0.0079 -0.0042 -0.0033 624 LEU 83 N -0.0112 -0.0062 -0.0010 625 LEU 83 CA -0.0111 -0.0059 -0.0016 626 LEU 83 C -0.0103 -0.0051 -0.0027 627 LEU 83 O -0.0105 -0.0049 -0.0035 628 LEU 83 CB -0.0124 -0.0063 -0.0021 629 LEU 83 CG -0.0132 -0.0071 -0.0011 630 LEU 83 CD1 -0.0145 -0.0074 -0.0017 631 LEU 83 CD2 -0.0125 -0.0071 -0.0003 632 SER 84 N -0.0095 -0.0047 -0.0029 633 SER 84 CA -0.0087 -0.0040 -0.0039 634 SER 84 C -0.0095 -0.0038 -0.0051 635 SER 84 O -0.0103 -0.0041 -0.0052 636 SER 84 CB -0.0076 -0.0036 -0.0035 637 SER 84 OG -0.0069 -0.0029 -0.0045 638 ASN 85 N -0.0092 -0.0032 -0.0062 639 ASN 85 CA -0.0097 -0.0029 -0.0075 640 ASN 85 C -0.0088 -0.0023 -0.0081 641 ASN 85 O -0.0091 -0.0019 -0.0092 642 ASN 85 CB -0.0101 -0.0027 -0.0083 643 ASN 85 CG -0.0112 -0.0034 -0.0079 644 ASN 85 ND2 -0.0113 -0.0033 -0.0083 645 ASN 85 OD1 -0.0118 -0.0040 -0.0072 646 PHE 86 N -0.0082 -0.0011 -0.0066 647 PHE 86 CA -0.0071 -0.0002 -0.0068 648 PHE 86 C -0.0070 -0.0006 -0.0062 649 PHE 86 O -0.0067 0.0000 -0.0068 650 PHE 86 CB -0.0057 0.0002 -0.0062 651 PHE 86 CG -0.0045 0.0012 -0.0063 652 PHE 86 CD1 -0.0044 0.0022 -0.0076 653 PHE 86 CD2 -0.0033 0.0011 -0.0053 654 PHE 86 CE1 -0.0033 0.0031 -0.0078 655 PHE 86 CE2 -0.0022 0.0020 -0.0054 656 PHE 86 CZ -0.0022 0.0030 -0.0067 657 LEU 87 N -0.0072 -0.0016 -0.0051 658 LEU 87 CA -0.0073 -0.0021 -0.0045 659 LEU 87 C -0.0088 -0.0025 -0.0053 660 LEU 87 O -0.0097 -0.0027 -0.0059 661 LEU 87 CB -0.0071 -0.0031 -0.0031 662 LEU 87 CG -0.0057 -0.0029 -0.0021 663 LEU 87 CD1 -0.0057 -0.0040 -0.0007 664 LEU 87 CD2 -0.0046 -0.0021 -0.0022 665 HIS 88 N -0.0089 -0.0026 -0.0052 666 HIS 88 CA -0.0101 -0.0028 -0.0060 667 HIS 88 C -0.0112 -0.0041 -0.0054 668 HIS 88 O -0.0124 -0.0044 -0.0060 669 HIS 88 CB -0.0098 -0.0023 -0.0064 670 HIS 88 CG -0.0091 -0.0011 -0.0075 671 HIS 88 CD2 -0.0087 -0.0003 -0.0081 672 HIS 88 ND1 -0.0088 -0.0004 -0.0080 673 HIS 88 CE1 -0.0082 0.0006 -0.0089 674 HIS 88 NE2 -0.0082 0.0007 -0.0090 675 ALA 89 N -0.0114 -0.0056 -0.0043 676 ALA 89 CA -0.0124 -0.0062 -0.0036 677 ALA 89 C -0.0119 -0.0064 -0.0023 678 ALA 89 O -0.0120 -0.0067 -0.0016 679 ALA 89 CB -0.0131 -0.0066 -0.0038 680 GLN 90 N -0.0114 -0.0062 -0.0021 681 GLN 90 CA -0.0110 -0.0064 -0.0009 682 GLN 90 C -0.0119 -0.0070 -0.0002 683 GLN 90 O -0.0126 -0.0072 -0.0007 684 GLN 90 CB -0.0100 -0.0060 -0.0008 685 GLN 90 CG -0.0094 -0.0060 0.0004 686 GLN 90 CD -0.0086 -0.0056 0.0004 687 GLN 90 NE2 -0.0076 -0.0053 0.0010 688 GLN 90 OE1 -0.0088 -0.0056 -0.0001 689 GLN 91 N -0.0118 -0.0073 0.0009 690 GLN 91 CA -0.0126 -0.0079 0.0017 691 GLN 91 C -0.0120 -0.0079 0.0025 692 GLN 91 O -0.0110 -0.0075 0.0027 693 GLN 91 CB -0.0130 -0.0083 0.0024 694 GLN 91 CG -0.0133 -0.0083 0.0017 695 GLN 91 CD -0.0142 -0.0084 0.0008 696 GLN 91 NE2 -0.0141 -0.0081 -0.0003 697 GLN 91 OE1 -0.0150 -0.0089 0.0010 698 TRP 92 N -0.0136 -0.0082 0.0026 699 TRP 92 CA -0.0131 -0.0084 0.0035 700 TRP 92 C -0.0122 -0.0085 0.0047 701 TRP 92 O -0.0115 -0.0085 0.0054 702 TRP 92 CB -0.0143 -0.0090 0.0040 703 TRP 92 CG -0.0150 -0.0089 0.0029 704 TRP 92 CD1 -0.0162 -0.0091 0.0022 705 TRP 92 CD2 -0.0146 -0.0085 0.0024 706 TRP 92 CE2 -0.0156 -0.0085 0.0014 707 TRP 92 CE3 -0.0135 -0.0082 0.0028 708 TRP 92 NE1 -0.0166 -0.0088 0.0013 709 TRP 92 CZ2 -0.0155 -0.0082 0.0008 710 TRP 92 CZ3 -0.0133 -0.0079 0.0021 711 TRP 92 CH2 -0.0143 -0.0079 0.0011 712 LYS 93 N -0.0122 -0.0086 0.0050 713 LYS 93 CA -0.0113 -0.0087 0.0061 714 LYS 93 C -0.0099 -0.0081 0.0059 715 LYS 93 O -0.0090 -0.0081 0.0068 716 LYS 93 CB -0.0116 -0.0090 0.0065 717 LYS 93 CG -0.0124 -0.0088 0.0053 718 LYS 93 CD -0.0127 -0.0091 0.0058 719 LYS 93 CE -0.0136 -0.0090 0.0047 720 LYS 93 NZ -0.0149 -0.0094 0.0043 721 GLY 94 N -0.0096 -0.0075 0.0046 722 GLY 94 CA -0.0083 -0.0068 0.0043 723 GLY 94 C -0.0080 -0.0064 0.0036 724 GLY 94 O -0.0069 -0.0058 0.0031 725 ALA 95 N -0.0083 -0.0069 0.0033 726 ALA 95 CA -0.0081 -0.0065 0.0026 727 ALA 95 C -0.0070 -0.0062 0.0032 728 ALA 95 O -0.0068 -0.0065 0.0044 729 ALA 95 CB -0.0091 -0.0070 0.0024 730 SER 96 N -0.0063 -0.0057 0.0025 731 SER 96 CA -0.0052 -0.0053 0.0030 732 SER 96 C -0.0055 -0.0056 0.0036 733 SER 96 O -0.0065 -0.0060 0.0033 734 SER 96 CB -0.0044 -0.0046 0.0020 735 SER 96 OG -0.0041 -0.0043 0.0016 736 ASN 97 N -0.0046 -0.0055 0.0043 737 ASN 97 CA -0.0047 -0.0057 0.0049 738 ASN 97 C -0.0042 -0.0052 0.0041 739 ASN 97 O -0.0034 -0.0047 0.0036 740 ASN 97 CB -0.0041 -0.0058 0.0062 741 ASN 97 CG -0.0046 -0.0064 0.0070 742 ASN 97 ND2 -0.0038 -0.0063 0.0077 743 ASN 97 OD1 -0.0056 -0.0069 0.0070 744 TYR 98 N -0.0047 -0.0051 0.0044 745 TYR 98 CA -0.0043 -0.0048 0.0037 746 TYR 98 C -0.0043 -0.0051 0.0046 747 TYR 98 O -0.0051 -0.0055 0.0055 748 TYR 98 CB -0.0051 -0.0048 0.0025 749 TYR 98 CG -0.0052 -0.0046 0.0015 750 TYR 98 CD1 -0.0060 -0.0048 0.0016 751 TYR 98 CD2 -0.0044 -0.0041 0.0006 752 TYR 98 CE1 -0.0060 -0.0046 0.0007 753 TYR 98 CE2 -0.0044 -0.0039 -0.0003 754 TYR 98 CZ -0.0052 -0.0041 -0.0003 755 TYR 98 OH -0.0052 -0.0039 -0.0012 756 VAL 99 N -0.0035 -0.0048 0.0045 757 VAL 99 CA -0.0035 -0.0049 0.0051 758 VAL 99 C -0.0040 -0.0048 0.0042 759 VAL 99 O -0.0035 -0.0045 0.0031 760 VAL 99 CB -0.0022 -0.0047 0.0057 761 VAL 99 CG1 -0.0022 -0.0049 0.0064 762 VAL 99 CG2 -0.0016 -0.0047 0.0065 763 ALA 100 N -0.0050 -0.0052 0.0045 764 ALA 100 CA -0.0055 -0.0052 0.0037 765 ALA 100 C -0.0053 -0.0053 0.0044 766 ALA 100 O -0.0057 -0.0056 0.0054 767 ALA 100 CB -0.0069 -0.0055 0.0034 768 LYS 101 N -0.0044 -0.0044 0.0033 769 LYS 101 CA -0.0038 -0.0044 0.0040 770 LYS 101 C -0.0046 -0.0045 0.0034 771 LYS 101 O -0.0049 -0.0043 0.0022 772 LYS 101 CB -0.0022 -0.0040 0.0039 773 LYS 101 CG -0.0014 -0.0040 0.0046 774 LYS 101 CD -0.0001 -0.0036 0.0037 775 LYS 101 CE 0.0009 -0.0035 0.0046 776 LYS 101 NZ 0.0024 -0.0031 0.0040 777 ARG 102 N -0.0049 -0.0047 0.0044 778 ARG 102 CA -0.0056 -0.0047 0.0040 779 ARG 102 C -0.0048 -0.0047 0.0048 780 ARG 102 O -0.0044 -0.0048 0.0061 781 ARG 102 CB -0.0071 -0.0051 0.0045 782 ARG 102 CG -0.0079 -0.0053 0.0043 783 ARG 102 CD -0.0081 -0.0051 0.0028 784 ARG 102 NE -0.0092 -0.0053 0.0026 785 ARG 102 CZ -0.0096 -0.0052 0.0013 786 ARG 102 NH1 -0.0090 -0.0049 0.0001 787 ARG 102 NH2 -0.0106 -0.0054 0.0012 788 TYR 103 N -0.0046 -0.0045 0.0040 789 TYR 103 CA -0.0039 -0.0045 0.0047 790 TYR 103 C -0.0048 -0.0048 0.0058 791 TYR 103 O -0.0061 -0.0051 0.0055 792 TYR 103 CB -0.0035 -0.0043 0.0035 793 TYR 103 CG -0.0021 -0.0039 0.0028 794 TYR 103 CD1 -0.0009 -0.0037 0.0035 795 TYR 103 CD2 -0.0020 -0.0037 0.0015 796 TYR 103 CE1 0.0004 -0.0033 0.0028 797 TYR 103 CE2 -0.0007 -0.0033 0.0009 798 TYR 103 CZ 0.0005 -0.0031 0.0015 799 TYR 103 OH 0.0018 -0.0028 0.0009 800 ILE 104 N -0.0043 -0.0052 0.0070 801 ILE 104 CA -0.0051 -0.0055 0.0081 802 ILE 104 C -0.0055 -0.0055 0.0078 803 ILE 104 O -0.0067 -0.0058 0.0079 804 ILE 104 CB -0.0043 -0.0055 0.0095 805 ILE 104 CG1 -0.0039 -0.0055 0.0098 806 ILE 104 CG2 -0.0051 -0.0059 0.0107 807 ILE 104 CD1 -0.0028 -0.0055 0.0110 808 GLU 105 N -0.0045 -0.0053 0.0074 809 GLU 105 CA -0.0049 -0.0052 0.0069 810 GLU 105 C -0.0053 -0.0051 0.0053 811 GLU 105 O -0.0046 -0.0048 0.0045 812 GLU 105 CB -0.0036 -0.0051 0.0071 813 GLU 105 CG -0.0031 -0.0052 0.0086 814 GLU 105 CD -0.0043 -0.0055 0.0096 815 GLU 105 OE1 -0.0051 -0.0056 0.0091 816 GLU 105 OE2 -0.0044 -0.0057 0.0108 817 PRO 106 N -0.0064 -0.0052 0.0049 818 PRO 106 CA -0.0068 -0.0051 0.0034 819 PRO 106 C -0.0057 -0.0047 0.0024 820 PRO 106 O -0.0051 -0.0047 0.0027 821 PRO 106 CB -0.0082 -0.0053 0.0033 822 PRO 106 CG -0.0081 -0.0055 0.0045 823 PRO 106 CD -0.0073 -0.0055 0.0057 824 VAL 107 N -0.0051 -0.0044 0.0014 825 VAL 107 CA -0.0041 -0.0040 0.0004 826 VAL 107 C -0.0048 -0.0040 -0.0011 827 VAL 107 O -0.0059 -0.0043 -0.0013 828 VAL 107 CB -0.0029 -0.0036 0.0005 829 VAL 107 CG1 -0.0022 -0.0036 0.0020 830 VAL 107 CG2 -0.0033 -0.0037 0.0003 831 ASP 108 N -0.0040 -0.0036 -0.0022 832 ASP 108 CA -0.0045 -0.0036 -0.0036 833 ASP 108 C -0.0046 -0.0036 -0.0040 834 ASP 108 O -0.0040 -0.0034 -0.0033 835 ASP 108 CB -0.0035 -0.0031 -0.0046 836 ASP 108 CG -0.0042 -0.0032 -0.0060 837 ASP 108 OD1 -0.0049 -0.0033 -0.0066 838 ASP 108 OD2 -0.0041 -0.0030 -0.0065 839 ARG 109 N -0.0055 -0.0037 -0.0050 840 ARG 109 CA -0.0058 -0.0037 -0.0054 841 ARG 109 C -0.0045 -0.0033 -0.0060 842 ARG 109 O -0.0044 -0.0032 -0.0059 843 ARG 109 CB -0.0070 -0.0040 -0.0064 844 ARG 109 CG -0.0083 -0.0045 -0.0057 845 ARG 109 CD -0.0095 -0.0047 -0.0068 846 ARG 109 NE -0.0098 -0.0048 -0.0071 847 ARG 109 CZ -0.0093 -0.0045 -0.0081 848 ARG 109 NH1 -0.0086 -0.0041 -0.0091 849 ARG 109 NH2 -0.0096 -0.0046 -0.0083 850 ASP 110 N -0.0032 -0.0028 -0.0064 851 ASP 110 CA -0.0021 -0.0023 -0.0070 852 ASP 110 C -0.0011 -0.0021 -0.0060 853 ASP 110 O -0.0002 -0.0017 -0.0063 854 ASP 110 CB -0.0015 -0.0020 -0.0080 855 ASP 110 CG -0.0006 -0.0016 -0.0089 856 ASP 110 OD1 -0.0010 -0.0017 -0.0097 857 ASP 110 OD2 0.0005 -0.0012 -0.0088 858 VAL 111 N -0.0011 -0.0022 -0.0048 859 VAL 111 CA -0.0002 -0.0020 -0.0037 860 VAL 111 C -0.0003 -0.0021 -0.0034 861 VAL 111 O 0.0007 -0.0017 -0.0032 862 VAL 111 CB -0.0004 -0.0022 -0.0025 863 VAL 111 CG1 0.0006 -0.0020 -0.0014 864 VAL 111 CG2 -0.0004 -0.0022 -0.0028 865 TYR 112 N -0.0014 -0.0025 -0.0034 866 TYR 112 CA -0.0016 -0.0026 -0.0032 867 TYR 112 C -0.0010 -0.0022 -0.0043 868 TYR 112 O -0.0003 -0.0020 -0.0040 869 TYR 112 CB -0.0030 -0.0031 -0.0030 870 TYR 112 CG -0.0035 -0.0034 -0.0018 871 TYR 112 CD1 -0.0040 -0.0036 -0.0018 872 TYR 112 CD2 -0.0036 -0.0035 -0.0006 873 TYR 112 CE1 -0.0045 -0.0039 -0.0006 874 TYR 112 CE2 -0.0041 -0.0039 0.0005 875 TYR 112 CZ -0.0046 -0.0040 0.0005 876 TYR 112 OH -0.0051 -0.0043 0.0016 877 PHE 113 N -0.0010 -0.0016 -0.0048 878 PHE 113 CA -0.0004 -0.0015 -0.0060 879 PHE 113 C 0.0011 -0.0011 -0.0060 880 PHE 113 O 0.0017 -0.0010 -0.0064 881 PHE 113 CB -0.0009 -0.0018 -0.0074 882 PHE 113 CG -0.0025 -0.0023 -0.0076 883 PHE 113 CD1 -0.0033 -0.0024 -0.0069 884 PHE 113 CD2 -0.0031 -0.0025 -0.0084 885 PHE 113 CE1 -0.0048 -0.0028 -0.0070 886 PHE 113 CE2 -0.0045 -0.0029 -0.0086 887 PHE 113 CZ -0.0054 -0.0031 -0.0079 888 GLU 114 N 0.0019 -0.0009 -0.0055 889 GLU 114 CA 0.0034 -0.0004 -0.0054 890 GLU 114 C 0.0038 -0.0002 -0.0043 891 GLU 114 O 0.0049 0.0000 -0.0045 892 GLU 114 CB 0.0040 -0.0002 -0.0051 893 GLU 114 CG 0.0056 0.0002 -0.0052 894 GLU 114 CD 0.0061 0.0002 -0.0068 895 GLU 114 OE1 0.0054 -0.0001 -0.0078 896 GLU 114 OE2 0.0072 0.0004 -0.0070 897 ASP 115 N 0.0030 -0.0003 -0.0031 898 ASP 115 CA 0.0033 -0.0001 -0.0020 899 ASP 115 C 0.0030 -0.0003 -0.0026 900 ASP 115 O 0.0038 -0.0000 -0.0023 901 ASP 115 CB 0.0024 -0.0002 -0.0006 902 ASP 115 CG 0.0028 -0.0000 0.0001 903 ASP 115 OD1 0.0040 0.0003 -0.0001 904 ASP 115 OD2 0.0019 -0.0002 0.0010 905 VAL 116 N 0.0020 -0.0007 -0.0030 906 VAL 116 CA 0.0018 -0.0009 -0.0034 907 VAL 116 C 0.0029 -0.0005 -0.0043 908 VAL 116 O 0.0033 -0.0003 -0.0042 909 VAL 116 CB 0.0005 -0.0015 -0.0042 910 VAL 116 CG1 0.0004 -0.0016 -0.0048 911 VAL 116 CG2 -0.0006 -0.0018 -0.0032 912 ARG 117 N 0.0033 -0.0004 -0.0053 913 ARG 117 CA 0.0044 -0.0000 -0.0061 914 ARG 117 C 0.0055 0.0006 -0.0053 915 ARG 117 O 0.0062 0.0008 -0.0056 916 ARG 117 CB 0.0047 -0.0000 -0.0072 917 ARG 117 CG 0.0037 -0.0005 -0.0082 918 ARG 117 CD 0.0040 -0.0005 -0.0093 919 ARG 117 NE 0.0038 -0.0005 -0.0089 920 ARG 117 CZ 0.0029 -0.0010 -0.0093 921 ARG 117 NH1 0.0020 -0.0015 -0.0100 922 ARG 117 NH2 0.0028 -0.0010 -0.0088 923 LEU 118 N 0.0057 0.0008 -0.0043 924 LEU 118 CA 0.0068 0.0013 -0.0034 925 LEU 118 C 0.0067 0.0013 -0.0027 926 LEU 118 O 0.0076 0.0017 -0.0028 927 LEU 118 CB 0.0068 0.0014 -0.0023 928 LEU 118 CG 0.0079 0.0020 -0.0014 929 LEU 118 CD1 0.0077 0.0020 -0.0007 930 LEU 118 CD2 0.0080 0.0021 -0.0003 931 GLN 119 N 0.0055 0.0007 -0.0015 932 GLN 119 CA 0.0052 0.0007 -0.0014 933 GLN 119 C 0.0051 0.0004 -0.0019 934 GLN 119 O 0.0052 0.0005 -0.0019 935 GLN 119 CB 0.0046 0.0008 -0.0012 936 GLN 119 CG 0.0043 0.0009 -0.0010 937 GLN 119 CD 0.0041 0.0011 -0.0005 938 GLN 119 NE2 0.0037 0.0012 -0.0004 939 GLN 119 OE1 0.0043 0.0013 -0.0002 940 MET 120 N 0.0050 0.0002 -0.0023 941 MET 120 CA 0.0049 -0.0000 -0.0028 942 MET 120 C 0.0055 -0.0001 -0.0030 943 MET 120 O 0.0055 -0.0002 -0.0032 944 MET 120 CB 0.0047 -0.0003 -0.0031 945 MET 120 CG 0.0041 -0.0002 -0.0030 946 MET 120 SD 0.0037 -0.0001 -0.0027 947 MET 120 CE 0.0034 -0.0004 -0.0032 948 GLU 121 N 0.0059 -0.0000 -0.0029 949 GLU 121 CA 0.0065 -0.0001 -0.0030 950 GLU 121 C 0.0066 0.0001 -0.0027 951 GLU 121 O 0.0068 0.0000 -0.0029 952 GLU 121 CB 0.0069 -0.0000 -0.0030 953 GLU 121 CG 0.0075 -0.0000 -0.0031 954 GLU 121 CD 0.0077 -0.0003 -0.0036 955 GLU 121 OE1 0.0073 -0.0005 -0.0039 956 GLU 121 OE2 0.0081 -0.0004 -0.0038 957 ALA 122 N 0.0063 0.0016 -0.0010 958 ALA 122 CA 0.0061 0.0018 -0.0008 959 ALA 122 C 0.0057 0.0017 -0.0008 960 ALA 122 O 0.0056 0.0017 -0.0007 961 ALA 122 CB 0.0061 0.0023 -0.0005 962 LYS 123 N 0.0054 0.0015 -0.0008 963 LYS 123 CA 0.0050 0.0013 -0.0009 964 LYS 123 C 0.0050 0.0009 -0.0010 965 LYS 123 O 0.0048 0.0009 -0.0010 966 LYS 123 CB 0.0047 0.0011 -0.0009 967 LYS 123 CG 0.0042 0.0009 -0.0009 968 LYS 123 CD 0.0040 0.0007 -0.0010 969 LYS 123 CE 0.0035 0.0006 -0.0009 970 LYS 123 NZ 0.0032 0.0009 -0.0007 971 LEU 124 N 0.0054 0.0007 -0.0012 972 LEU 124 CA 0.0055 0.0004 -0.0014 973 LEU 124 C 0.0056 0.0006 -0.0013 974 LEU 124 O 0.0055 0.0004 -0.0014 975 LEU 124 CB 0.0058 0.0001 -0.0016 976 LEU 124 CG 0.0057 -0.0002 -0.0018 977 LEU 124 CD1 0.0061 -0.0004 -0.0020 978 LEU 124 CD2 0.0053 -0.0005 -0.0018 979 TRP 125 N 0.0053 0.0012 0.0010 980 TRP 125 CA 0.0047 0.0012 0.0008 981 TRP 125 C 0.0041 0.0014 0.0005 982 TRP 125 O 0.0035 0.0012 0.0005 983 TRP 125 CB 0.0051 0.0016 0.0006 984 TRP 125 CG 0.0055 0.0013 0.0010 985 TRP 125 CD1 0.0062 0.0013 0.0011 986 TRP 125 CD2 0.0052 0.0008 0.0013 987 TRP 125 CE2 0.0058 0.0006 0.0016 988 TRP 125 CE3 0.0045 0.0005 0.0013 989 TRP 125 NE1 0.0064 0.0010 0.0015 990 TRP 125 CZ2 0.0057 0.0001 0.0019 991 TRP 125 CZ3 0.0044 0.0000 0.0017 992 TRP 125 CH2 0.0050 -0.0001 0.0020 993 GLY 126 N 0.0042 0.0018 0.0002 994 GLY 126 CA 0.0035 0.0020 -0.0001 995 GLY 126 C 0.0031 0.0015 0.0001 996 GLY 126 O 0.0024 0.0014 0.0000 997 GLU 127 N 0.0034 0.0011 0.0005 998 GLU 127 CA 0.0031 0.0006 0.0008 999 GLU 127 C 0.0026 0.0002 0.0010 1000 GLU 127 O 0.0020 -0.0001 0.0011 1001 GLU 127 CB 0.0036 0.0003 0.0012 1002 GLU 127 CG 0.0040 0.0007 0.0010 1003 GLU 127 CD 0.0045 0.0004 0.0014 1004 GLU 127 OE1 0.0045 -0.0002 0.0018 1005 GLU 127 OE2 0.0049 0.0007 0.0013 1006 GLU 128 N 0.0027 0.0002 0.0024 1007 GLU 128 CA 0.0021 -0.0000 0.0027 1008 GLU 128 C 0.0013 0.0002 0.0022 1009 GLU 128 O 0.0007 -0.0000 0.0024 1010 GLU 128 CB 0.0023 -0.0000 0.0028 1011 GLU 128 CG 0.0017 -0.0003 0.0031 1012 GLU 128 CD 0.0015 -0.0007 0.0037 1013 GLU 128 OE1 0.0019 -0.0009 0.0041 1014 GLU 128 OE2 0.0008 -0.0009 0.0039 1015 TYR 129 N 0.0014 0.0006 0.0016 1016 TYR 129 CA 0.0008 0.0008 0.0011 1017 TYR 129 C 0.0004 0.0007 0.0011 1018 TYR 129 O -0.0003 0.0006 0.0011 1019 TYR 129 CB 0.0010 0.0012 0.0004 1020 TYR 129 CG 0.0004 0.0015 -0.0002 1021 TYR 129 CD1 -0.0001 0.0015 -0.0003 1022 TYR 129 CD2 0.0004 0.0017 -0.0005 1023 TYR 129 CE1 -0.0007 0.0017 -0.0009 1024 TYR 129 CE2 -0.0001 0.0019 -0.0010 1025 TYR 129 CZ -0.0007 0.0019 -0.0012 1026 TYR 129 OH -0.0012 0.0022 -0.0017 1027 ASN 130 N 0.0009 0.0007 0.0012 1028 ASN 130 CA 0.0006 0.0006 0.0013 1029 ASN 130 C 0.0001 0.0002 0.0019 1030 ASN 130 O -0.0005 0.0001 0.0019 1031 ASN 130 CB 0.0012 0.0007 0.0013 1032 ASN 130 CG 0.0016 0.0012 0.0006 1033 ASN 130 ND2 0.0023 0.0012 0.0007 1034 ASN 130 OD1 0.0013 0.0014 0.0001 1035 ARG 131 N -0.0003 -0.0005 0.0029 1036 ARG 131 CA -0.0007 -0.0010 0.0035 1037 ARG 131 C -0.0015 -0.0012 0.0034 1038 ARG 131 O -0.0020 -0.0016 0.0038 1039 ARG 131 CB -0.0002 -0.0013 0.0042 1040 ARG 131 CG 0.0004 -0.0014 0.0045 1041 ARG 131 CD 0.0008 -0.0018 0.0052 1042 ARG 131 NE 0.0013 -0.0016 0.0052 1043 ARG 131 CZ 0.0021 -0.0014 0.0051 1044 ARG 131 NH1 0.0024 -0.0013 0.0051 1045 ARG 131 NH2 0.0025 -0.0012 0.0051 1046 HIS 132 N -0.0017 -0.0009 0.0029 1047 HIS 132 CA -0.0025 -0.0011 0.0028 1048 HIS 132 C -0.0031 -0.0009 0.0023 1049 HIS 132 O -0.0037 -0.0008 0.0020 1050 HIS 132 CB -0.0025 -0.0009 0.0025 1051 HIS 132 CG -0.0022 -0.0012 0.0031 1052 HIS 132 CD2 -0.0025 -0.0014 0.0034 1053 HIS 132 ND1 -0.0014 -0.0011 0.0034 1054 HIS 132 CE1 -0.0013 -0.0014 0.0038 1055 HIS 132 NE2 -0.0019 -0.0016 0.0038 1056 LYS 133 N -0.0028 -0.0007 0.0022 1057 LYS 133 CA -0.0033 -0.0005 0.0017 1058 LYS 133 C -0.0036 -0.0001 0.0010 1059 LYS 133 O -0.0043 -0.0002 0.0008 1060 LYS 133 CB -0.0040 -0.0009 0.0020 1061 LYS 133 CG -0.0038 -0.0014 0.0028 1062 LYS 133 CD -0.0044 -0.0017 0.0030 1063 LYS 133 CE -0.0043 -0.0022 0.0038 1064 LYS 133 NZ -0.0035 -0.0022 0.0041 1065 PRO 134 N -0.0029 0.0011 0.0011 1066 PRO 134 CA -0.0032 0.0014 0.0002 1067 PRO 134 C -0.0032 0.0015 -0.0002 1068 PRO 134 O -0.0029 0.0014 0.0002 1069 PRO 134 CB -0.0024 0.0015 -0.0002 1070 PRO 134 CG -0.0016 0.0014 0.0003 1071 PRO 134 CD -0.0019 0.0011 0.0012 1072 PRO 135 N -0.0037 0.0018 -0.0009 1073 PRO 135 CA -0.0037 0.0019 -0.0014 1074 PRO 135 C -0.0028 0.0020 -0.0016 1075 PRO 135 O -0.0026 0.0020 -0.0016 1076 PRO 135 CB -0.0043 0.0022 -0.0022 1077 PRO 135 CG -0.0043 0.0022 -0.0023 1078 PRO 135 CD -0.0042 0.0019 -0.0014 1079 LYS 136 N -0.0021 0.0020 -0.0019 1080 LYS 136 CA -0.0012 0.0021 -0.0021 1081 LYS 136 C -0.0006 0.0019 -0.0017 1082 LYS 136 O -0.0006 0.0020 -0.0018 1083 LYS 136 CB -0.0010 0.0024 -0.0031 1084 LYS 136 CG -0.0015 0.0025 -0.0036 1085 LYS 136 CD -0.0013 0.0028 -0.0046 1086 LYS 136 CE -0.0018 0.0030 -0.0051 1087 LYS 136 NZ -0.0016 0.0033 -0.0060 1088 GLN 137 N 0.0023 0.0022 -0.0003 1089 GLN 137 CA 0.0024 0.0022 -0.0002 1090 GLN 137 C 0.0026 0.0021 -0.0004 1091 GLN 137 O 0.0027 0.0020 -0.0006 1092 GLN 137 CB 0.0026 0.0023 0.0001 1093 GLN 137 CG 0.0024 0.0024 0.0003 1094 GLN 137 CD 0.0026 0.0024 0.0006 1095 GLN 137 NE2 0.0026 0.0025 0.0007 1096 GLN 137 OE1 0.0028 0.0024 0.0006 1097 VAL 138 N 0.0025 0.0021 -0.0004 1098 VAL 138 CA 0.0027 0.0021 -0.0006 1099 VAL 138 C 0.0029 0.0021 -0.0004 1100 VAL 138 O 0.0029 0.0022 -0.0001 1101 VAL 138 CB 0.0024 0.0021 -0.0007 1102 VAL 138 CG1 0.0022 0.0020 -0.0009 1103 VAL 138 CG2 0.0023 0.0021 -0.0005 1104 ASP 139 N 0.0030 0.0020 -0.0005 1105 ASP 139 CA 0.0032 0.0020 -0.0004 1106 ASP 139 C 0.0033 0.0020 -0.0006 1107 ASP 139 O 0.0034 0.0019 -0.0009 1108 ASP 139 CB 0.0035 0.0021 -0.0003 1109 ASP 139 CG 0.0037 0.0021 -0.0001 1110 ASP 139 OD1 0.0036 0.0021 -0.0000 1111 ASP 139 OD2 0.0039 0.0021 0.0000 1112 ILE 140 N 0.0049 0.0017 -0.0007 1113 ILE 140 CA 0.0044 0.0014 -0.0006 1114 ILE 140 C 0.0038 0.0011 -0.0008 1115 ILE 140 O 0.0036 0.0012 -0.0013 1116 ILE 140 CB 0.0044 0.0016 -0.0011 1117 ILE 140 CG1 0.0050 0.0018 -0.0008 1118 ILE 140 CG2 0.0038 0.0012 -0.0011 1119 ILE 140 CD1 0.0056 0.0022 -0.0010 1120 MET 141 N 0.0034 0.0007 -0.0003 1121 MET 141 CA 0.0028 0.0004 -0.0004 1122 MET 141 C 0.0023 0.0004 -0.0010 1123 MET 141 O 0.0023 0.0004 -0.0012 1124 MET 141 CB 0.0025 -0.0000 0.0003 1125 MET 141 CG 0.0029 -0.0000 0.0009 1126 MET 141 SD 0.0027 -0.0001 0.0011 1127 MET 141 CE 0.0019 -0.0006 0.0011 1128 GLN 142 N 0.0020 0.0003 -0.0014 1129 GLN 142 CA 0.0015 0.0002 -0.0020 1130 GLN 142 C 0.0010 -0.0002 -0.0017 1131 GLN 142 O 0.0008 -0.0004 -0.0012 1132 GLN 142 CB 0.0013 0.0002 -0.0024 1133 GLN 142 CG 0.0006 0.0000 -0.0028 1134 GLN 142 CD 0.0004 0.0001 -0.0033 1135 GLN 142 NE2 0.0002 -0.0001 -0.0031 1136 GLN 142 OE1 0.0005 0.0004 -0.0039 1137 MET 143 N 0.0015 -0.0007 -0.0023 1138 MET 143 CA 0.0005 -0.0011 -0.0018 1139 MET 143 C -0.0003 -0.0013 -0.0031 1140 MET 143 O 0.0002 -0.0010 -0.0041 1141 MET 143 CB 0.0011 -0.0010 -0.0011 1142 MET 143 CG 0.0002 -0.0014 -0.0006 1143 MET 143 SD 0.0009 -0.0012 0.0002 1144 MET 143 CE 0.0016 -0.0008 -0.0012 1145 CYS 144 N -0.0015 -0.0018 -0.0029 1146 CYS 144 CA -0.0024 -0.0020 -0.0040 1147 CYS 144 C -0.0033 -0.0024 -0.0035 1148 CYS 144 O -0.0031 -0.0025 -0.0024 1149 CYS 144 CB -0.0032 -0.0023 -0.0045 1150 CYS 144 SG -0.0043 -0.0028 -0.0033 1151 ILE 145 N -0.0042 -0.0027 -0.0043 1152 ILE 145 CA -0.0051 -0.0030 -0.0040 1153 ILE 145 C -0.0065 -0.0035 -0.0041 1154 ILE 145 O -0.0068 -0.0036 -0.0050 1155 ILE 145 CB -0.0050 -0.0029 -0.0050 1156 ILE 145 CG1 -0.0038 -0.0025 -0.0047 1157 ILE 145 CG2 -0.0061 -0.0033 -0.0048 1158 ILE 145 CD1 -0.0035 -0.0022 -0.0057 1159 ILE 146 N -0.0076 -0.0042 -0.0035 1160 ILE 146 CA -0.0091 -0.0047 -0.0036 1161 ILE 146 C -0.0100 -0.0050 -0.0035 1162 ILE 146 O -0.0098 -0.0051 -0.0026 1163 ILE 146 CB -0.0094 -0.0050 -0.0024 1164 ILE 146 CG1 -0.0090 -0.0052 -0.0009 1165 ILE 146 CG2 -0.0087 -0.0047 -0.0027 1166 ILE 146 CD1 -0.0096 -0.0056 0.0003 1167 GLU 147 N -0.0111 -0.0051 -0.0045 1168 GLU 147 CA -0.0121 -0.0054 -0.0046 1169 GLU 147 C -0.0135 -0.0060 -0.0041 1170 GLU 147 O -0.0141 -0.0060 -0.0048 1171 GLU 147 CB -0.0122 -0.0051 -0.0061 1172 GLU 147 CG -0.0131 -0.0054 -0.0062 1173 GLU 147 CD -0.0130 -0.0051 -0.0077 1174 GLU 147 OE1 -0.0125 -0.0047 -0.0087 1175 GLU 147 OE2 -0.0135 -0.0052 -0.0078 1176 LEU 148 N -0.0140 -0.0064 -0.0030 1177 LEU 148 CA -0.0153 -0.0069 -0.0024 1178 LEU 148 C -0.0164 -0.0072 -0.0031 1179 LEU 148 O -0.0168 -0.0074 -0.0024 1180 LEU 148 CB -0.0153 -0.0073 -0.0008 1181 LEU 148 CG -0.0145 -0.0072 0.0001 1182 LEU 148 CD1 -0.0151 -0.0073 -0.0003 1183 LEU 148 CD2 -0.0129 -0.0066 -0.0000 1184 LYS 149 N -0.0173 -0.0073 -0.0045 1185 LYS 149 CA -0.0183 -0.0074 -0.0053 1186 LYS 149 C -0.0197 -0.0080 -0.0046 1187 LYS 149 O -0.0206 -0.0082 -0.0051 1188 LYS 149 CB -0.0185 -0.0072 -0.0068 1189 LYS 149 CG -0.0171 -0.0066 -0.0076 1190 LYS 149 CD -0.0174 -0.0063 -0.0093 1191 LYS 149 CE -0.0160 -0.0057 -0.0100 1192 LYS 149 NZ -0.0162 -0.0055 -0.0115 1193 ASP 150 N -0.0200 -0.0084 -0.0036 1194 ASP 150 CA -0.0214 -0.0089 -0.0029 1195 ASP 150 C -0.0213 -0.0092 -0.0015 1196 ASP 150 O -0.0224 -0.0097 -0.0009 1197 ASP 150 CB -0.0220 -0.0091 -0.0026 1198 ASP 150 CG -0.0226 -0.0090 -0.0040 1199 ASP 150 OD1 -0.0233 -0.0091 -0.0049 1200 ASP 150 OD2 -0.0222 -0.0089 -0.0043 1201 ARG 151 N -0.0200 -0.0089 -0.0009 1202 ARG 151 CA -0.0199 -0.0091 0.0004 1203 ARG 151 C -0.0200 -0.0091 -0.0000 1204 ARG 151 O -0.0197 -0.0087 -0.0012 1205 ARG 151 CB -0.0184 -0.0089 0.0012 1206 ARG 151 CG -0.0183 -0.0090 0.0020 1207 ARG 151 CD -0.0170 -0.0088 0.0031 1208 ARG 151 NE -0.0166 -0.0088 0.0036 1209 ARG 151 CZ -0.0156 -0.0087 0.0046 1210 ARG 151 NH1 -0.0148 -0.0086 0.0053 1211 ARG 151 NH2 -0.0152 -0.0087 0.0050 1212 PRO 152 N -0.0206 -0.0096 0.0011 1213 PRO 152 CA -0.0207 -0.0095 0.0007 1214 PRO 152 C -0.0191 -0.0089 0.0003 1215 PRO 152 O -0.0180 -0.0086 0.0012 1216 PRO 152 CB -0.0212 -0.0100 0.0021 1217 PRO 152 CG -0.0221 -0.0105 0.0029 1218 PRO 152 CD -0.0212 -0.0101 0.0027 1219 GLY 153 N -0.0191 -0.0085 -0.0012 1220 GLY 153 CA -0.0177 -0.0079 -0.0017 1221 GLY 153 C -0.0168 -0.0074 -0.0026 1222 GLY 153 O -0.0157 -0.0068 -0.0033 1223 LYS 154 N -0.0173 -0.0075 -0.0027 1224 LYS 154 CA -0.0164 -0.0071 -0.0035 1225 LYS 154 C -0.0148 -0.0066 -0.0029 1226 LYS 154 O -0.0138 -0.0060 -0.0037 1227 LYS 154 CB -0.0166 -0.0067 -0.0053 1228 LYS 154 CG -0.0182 -0.0072 -0.0059 1229 LYS 154 CD -0.0183 -0.0069 -0.0077 1230 LYS 154 CE -0.0199 -0.0073 -0.0084 1231 LYS 154 NZ -0.0211 -0.0080 -0.0076 1232 PRO 155 N -0.0141 -0.0065 -0.0015 1233 PRO 155 CA -0.0127 -0.0062 -0.0009 1234 PRO 155 C -0.0117 -0.0058 -0.0015 1235 PRO 155 O -0.0122 -0.0059 -0.0019 1236 PRO 155 CB -0.0129 -0.0066 0.0007 1237 PRO 155 CG -0.0141 -0.0070 0.0007 1238 PRO 155 CD -0.0151 -0.0070 -0.0005 1239 LEU 156 N -0.0104 -0.0054 -0.0015 1240 LEU 156 CA -0.0093 -0.0050 -0.0019 1241 LEU 156 C -0.0085 -0.0050 -0.0006 1242 LEU 156 O -0.0083 -0.0051 0.0004 1243 LEU 156 CB -0.0084 -0.0046 -0.0029 1244 LEU 156 CG -0.0089 -0.0044 -0.0044 1245 LEU 156 CD1 -0.0078 -0.0040 -0.0051 1246 LEU 156 CD2 -0.0093 -0.0044 -0.0052 1247 PHE 157 N -0.0081 -0.0049 -0.0007 1248 PHE 157 CA -0.0072 -0.0048 0.0004 1249 PHE 157 C -0.0061 -0.0043 -0.0003 1250 PHE 157 O -0.0063 -0.0042 -0.0014 1251 PHE 157 CB -0.0080 -0.0052 0.0012 1252 PHE 157 CG -0.0090 -0.0057 0.0022 1253 PHE 157 CD1 -0.0103 -0.0060 0.0017 1254 PHE 157 CD2 -0.0087 -0.0059 0.0037 1255 PHE 157 CE1 -0.0112 -0.0064 0.0027 1256 PHE 157 CE2 -0.0096 -0.0063 0.0046 1257 PHE 157 CZ -0.0108 -0.0066 0.0041 1258 HIS 158 N -0.0043 -0.0035 0.0001 1259 HIS 158 CA -0.0034 -0.0033 -0.0003 1260 HIS 158 C -0.0037 -0.0034 0.0002 1261 HIS 158 O -0.0041 -0.0036 0.0012 1262 HIS 158 CB -0.0021 -0.0031 0.0002 1263 HIS 158 CG -0.0016 -0.0029 -0.0005 1264 HIS 158 CD2 -0.0015 -0.0027 -0.0017 1265 HIS 158 ND1 -0.0010 -0.0028 0.0001 1266 HIS 158 CE1 -0.0006 -0.0026 -0.0008 1267 HIS 158 NE2 -0.0009 -0.0025 -0.0019 1268 LEU 159 N -0.0035 -0.0033 -0.0006 1269 LEU 159 CA -0.0037 -0.0034 -0.0003 1270 LEU 159 C -0.0026 -0.0031 -0.0005 1271 LEU 159 O -0.0020 -0.0028 -0.0014 1272 LEU 159 CB -0.0048 -0.0035 -0.0011 1273 LEU 159 CG -0.0054 -0.0037 -0.0006 1274 LEU 159 CD1 -0.0060 -0.0040 0.0007 1275 LEU 159 CD2 -0.0062 -0.0038 -0.0015 1276 GLU 160 N -0.0023 -0.0031 0.0004 1277 GLU 160 CA -0.0013 -0.0029 0.0003 1278 GLU 160 C -0.0016 -0.0030 0.0010 1279 GLU 160 O -0.0025 -0.0033 0.0018 1280 GLU 160 CB -0.0001 -0.0027 0.0007 1281 GLU 160 CG -0.0000 -0.0028 0.0021 1282 GLU 160 CD 0.0011 -0.0026 0.0023 1283 GLU 160 OE1 0.0013 -0.0025 0.0017 1284 GLU 160 OE2 0.0019 -0.0025 0.0032 1285 HIS 161 N -0.0009 -0.0027 0.0005 1286 HIS 161 CA -0.0006 -0.0029 0.0012 1287 HIS 161 C -0.0001 -0.0033 0.0022 1288 HIS 161 O 0.0004 -0.0031 0.0023 1289 HIS 161 CB 0.0001 -0.0024 0.0008 1290 HIS 161 CG -0.0004 -0.0022 0.0002 1291 HIS 161 CD2 -0.0008 -0.0018 -0.0008 1292 HIS 161 ND1 -0.0005 -0.0025 0.0005 1293 HIS 161 CE1 -0.0010 -0.0023 -0.0002 1294 HIS 161 NE2 -0.0012 -0.0018 -0.0010 1295 TYR 162 N -0.0002 -0.0039 0.0029 1296 TYR 162 CA 0.0002 -0.0043 0.0040 1297 TYR 162 C 0.0013 -0.0039 0.0043 1298 TYR 162 O 0.0016 -0.0038 0.0042 1299 TYR 162 CB -0.0005 -0.0050 0.0046 1300 TYR 162 CG 0.0000 -0.0055 0.0057 1301 TYR 162 CD1 0.0002 -0.0057 0.0062 1302 TYR 162 CD2 0.0003 -0.0057 0.0063 1303 TYR 162 CE1 0.0007 -0.0061 0.0072 1304 TYR 162 CE2 0.0008 -0.0061 0.0073 1305 TYR 162 CZ 0.0009 -0.0063 0.0077 1306 TYR 162 OH 0.0014 -0.0067 0.0087 1307 ILE 163 N 0.0020 -0.0038 0.0046 1308 ILE 163 CA 0.0031 -0.0035 0.0049 1309 ILE 163 C 0.0034 -0.0040 0.0061 1310 ILE 163 O 0.0032 -0.0045 0.0066 1311 ILE 163 CB 0.0037 -0.0030 0.0046 1312 ILE 163 CG1 0.0031 -0.0027 0.0036 1313 ILE 163 CG2 0.0047 -0.0024 0.0044 1314 ILE 163 CD1 0.0036 -0.0022 0.0034 1315 GLU 164 N 0.0046 -0.0050 0.0056 1316 GLU 164 CA 0.0041 -0.0043 0.0057 1317 GLU 164 C 0.0032 -0.0029 0.0057 1318 GLU 164 O 0.0026 -0.0026 0.0063 1319 GLU 164 CB 0.0038 -0.0051 0.0070 1320 GLU 164 CG 0.0047 -0.0063 0.0069 1321 GLU 164 CD 0.0043 -0.0070 0.0082 1322 GLU 164 OE1 0.0036 -0.0064 0.0087 1323 GLU 164 OE2 0.0048 -0.0083 0.0087 1324 GLY 165 N 0.0031 -0.0020 0.0050 1325 GLY 165 CA 0.0022 -0.0006 0.0050 1326 GLY 165 C 0.0024 0.0004 0.0036 1327 GLY 165 O 0.0033 -0.0000 0.0026 1328 LYS 166 N 0.0016 0.0016 0.0036 1329 LYS 166 CA 0.0017 0.0027 0.0023 1330 LYS 166 C 0.0021 0.0027 0.0016 1331 LYS 166 O 0.0016 0.0030 0.0021 1332 LYS 166 CB 0.0007 0.0041 0.0026 1333 LYS 166 CG 0.0004 0.0044 0.0026 1334 LYS 166 CD -0.0007 0.0056 0.0031 1335 LYS 166 CE -0.0009 0.0068 0.0024 1336 LYS 166 NZ -0.0003 0.0072 0.0009 1337 TYR 167 N 0.0029 0.0044 -0.0021 1338 TYR 167 CA 0.0034 0.0043 -0.0026 1339 TYR 167 C 0.0032 0.0053 -0.0031 1340 TYR 167 O 0.0033 0.0059 -0.0036 1341 TYR 167 CB 0.0042 0.0038 -0.0032 1342 TYR 167 CG 0.0048 0.0035 -0.0035 1343 TYR 167 CD1 0.0050 0.0041 -0.0042 1344 TYR 167 CD2 0.0050 0.0025 -0.0032 1345 TYR 167 CE1 0.0055 0.0038 -0.0045 1346 TYR 167 CE2 0.0055 0.0022 -0.0035 1347 TYR 167 CZ 0.0057 0.0028 -0.0042 1348 TYR 167 OH 0.0062 0.0025 -0.0045 1349 ILE 168 N 0.0029 0.0055 -0.0029 1350 ILE 168 CA 0.0027 0.0064 -0.0033 1351 ILE 168 C 0.0031 0.0064 -0.0037 1352 ILE 168 O 0.0033 0.0057 -0.0034 1353 ILE 168 CB 0.0018 0.0069 -0.0026 1354 ILE 168 CG1 0.0013 0.0068 -0.0021 1355 ILE 168 CG2 0.0015 0.0079 -0.0030 1356 ILE 168 CD1 0.0014 0.0074 -0.0025 1357 LYS 169 N 0.0034 0.0070 -0.0045 1358 LYS 169 CA 0.0037 0.0071 -0.0049 1359 LYS 169 C 0.0031 0.0079 -0.0048 1360 LYS 169 O 0.0029 0.0087 -0.0051 1361 LYS 169 CB 0.0044 0.0074 -0.0058 1362 LYS 169 CG 0.0051 0.0066 -0.0061 1363 LYS 169 CD 0.0057 0.0070 -0.0069 1364 LYS 169 CE 0.0065 0.0063 -0.0073 1365 LYS 169 NZ 0.0066 0.0055 -0.0069 1366 TYR 170 N 0.0033 0.0081 -0.0052 1367 TYR 170 CA 0.0023 0.0084 -0.0051 1368 TYR 170 C 0.0025 0.0087 -0.0055 1369 TYR 170 O 0.0018 0.0094 -0.0059 1370 TYR 170 CB 0.0017 0.0077 -0.0041 1371 TYR 170 CG 0.0015 0.0074 -0.0037 1372 TYR 170 CD1 0.0006 0.0078 -0.0038 1373 TYR 170 CD2 0.0022 0.0067 -0.0032 1374 TYR 170 CE1 0.0004 0.0075 -0.0034 1375 TYR 170 CE2 0.0020 0.0064 -0.0028 1376 TYR 170 CZ 0.0011 0.0068 -0.0029 1377 TYR 170 OH 0.0009 0.0065 -0.0025 1378 ASN 171 N 0.0034 0.0083 -0.0053 1379 ASN 171 CA 0.0037 0.0085 -0.0058 1380 ASN 171 C 0.0050 0.0082 -0.0060 1381 ASN 171 O 0.0055 0.0077 -0.0056 1382 ASN 171 CB 0.0031 0.0082 -0.0052 1383 ASN 171 CG 0.0034 0.0073 -0.0043 1384 ASN 171 ND2 0.0025 0.0070 -0.0037 1385 ASN 171 OD1 0.0043 0.0068 -0.0042 1386 SER 172 N 0.0054 0.0086 -0.0065 1387 SER 172 CA 0.0066 0.0083 -0.0067 1388 SER 172 C 0.0069 0.0078 -0.0063 1389 SER 172 O 0.0061 0.0076 -0.0058 1390 SER 172 CB 0.0071 0.0091 -0.0077 1391 SER 172 OG 0.0068 0.0095 -0.0081 1392 ASN 173 N 0.0083 0.0093 -0.0067 1393 ASN 173 CA 0.0091 0.0084 -0.0060 1394 ASN 173 C 0.0094 0.0091 -0.0064 1395 ASN 173 O 0.0103 0.0086 -0.0060 1396 ASN 173 CB 0.0107 0.0079 -0.0055 1397 ASN 173 CG 0.0121 0.0090 -0.0061 1398 ASN 173 ND2 0.0136 0.0086 -0.0057 1399 ASN 173 OD1 0.0118 0.0102 -0.0069 1400 SER 174 N 0.0085 0.0102 -0.0073 1401 SER 174 CA 0.0089 0.0110 -0.0077 1402 SER 174 C 0.0073 0.0116 -0.0083 1403 SER 174 O 0.0073 0.0128 -0.0091 1404 SER 174 CB 0.0103 0.0121 -0.0084 1405 SER 174 OG 0.0118 0.0115 -0.0078 1406 GLY 175 N 0.0059 0.0109 -0.0080 1407 GLY 175 CA 0.0043 0.0112 -0.0084 1408 GLY 175 C 0.0033 0.0122 -0.0091 1409 GLY 175 O 0.0019 0.0125 -0.0095 1410 PHE 176 N 0.0048 0.0110 -0.0091 1411 PHE 176 CA 0.0041 0.0115 -0.0093 1412 PHE 176 C 0.0031 0.0109 -0.0086 1413 PHE 176 O 0.0032 0.0101 -0.0080 1414 PHE 176 CB 0.0049 0.0115 -0.0095 1415 PHE 176 CG 0.0042 0.0117 -0.0095 1416 PHE 176 CD1 0.0036 0.0126 -0.0100 1417 PHE 176 CD2 0.0042 0.0110 -0.0089 1418 PHE 176 CE1 0.0030 0.0127 -0.0099 1419 PHE 176 CE2 0.0036 0.0111 -0.0089 1420 PHE 176 CZ 0.0030 0.0120 -0.0094 1421 VAL 177 N 0.0021 0.0115 -0.0088 1422 VAL 177 CA 0.0011 0.0111 -0.0083 1423 VAL 177 C 0.0005 0.0117 -0.0086 1424 VAL 177 O 0.0003 0.0126 -0.0092 1425 VAL 177 CB 0.0003 0.0111 -0.0080 1426 VAL 177 CG1 -0.0008 0.0108 -0.0075 1427 VAL 177 CG2 0.0008 0.0104 -0.0077 1428 ARG 178 N 0.0002 0.0113 -0.0082 1429 ARG 178 CA -0.0004 0.0118 -0.0084 1430 ARG 178 C -0.0017 0.0120 -0.0082 1431 ARG 178 O -0.0023 0.0114 -0.0076 1432 ARG 178 CB -0.0002 0.0112 -0.0080 1433 ARG 178 CG -0.0008 0.0117 -0.0082 1434 ARG 178 CD -0.0008 0.0110 -0.0077 1435 ARG 178 NE -0.0015 0.0114 -0.0079 1436 ARG 178 CZ -0.0012 0.0119 -0.0083 1437 ARG 178 NH1 -0.0001 0.0120 -0.0086 1438 ARG 178 NH2 -0.0019 0.0123 -0.0083 1439 ASP 179 N -0.0019 0.0118 -0.0110 1440 ASP 179 CA -0.0030 0.0121 -0.0110 1441 ASP 179 C -0.0035 0.0124 -0.0110 1442 ASP 179 O -0.0044 0.0124 -0.0108 1443 ASP 179 CB -0.0031 0.0128 -0.0114 1444 ASP 180 N -0.0030 0.0126 -0.0113 1445 ASP 180 CA -0.0035 0.0128 -0.0114 1446 ASP 180 C -0.0039 0.0121 -0.0107 1447 ASP 180 O -0.0034 0.0116 -0.0104 1448 ASP 180 CB -0.0028 0.0131 -0.0118 1449 ASP 180 CG -0.0025 0.0139 -0.0125 1450 ASP 180 OD1 -0.0023 0.0140 -0.0126 1451 ASP 180 OD2 -0.0025 0.0144 -0.0129 1452 ASN 181 N -0.0049 0.0122 -0.0105 1453 ASN 181 CA -0.0054 0.0116 -0.0099 1454 ASN 181 C -0.0050 0.0108 -0.0094 1455 ASN 181 O -0.0046 0.0102 -0.0091 1456 ASN 181 CB -0.0052 0.0114 -0.0099 1457 ASN 181 CG -0.0052 0.0122 -0.0104 1458 ASN 181 ND2 -0.0060 0.0124 -0.0104 1459 ASN 181 OD1 -0.0045 0.0126 -0.0109 1460 ILE 182 N -0.0046 0.0100 -0.0102 1461 ILE 182 CA -0.0042 0.0093 -0.0095 1462 ILE 182 C -0.0045 0.0084 -0.0084 1463 ILE 182 O -0.0055 0.0084 -0.0080 1464 ILE 182 CB -0.0048 0.0096 -0.0096 1465 ILE 182 CG1 -0.0041 0.0090 -0.0092 1466 ILE 182 CG2 -0.0063 0.0095 -0.0092 1467 ILE 182 CD1 -0.0039 0.0096 -0.0098 1468 ARG 183 N -0.0035 0.0077 -0.0078 1469 ARG 183 CA -0.0037 0.0068 -0.0066 1470 ARG 183 C -0.0037 0.0063 -0.0061 1471 ARG 183 O -0.0031 0.0065 -0.0065 1472 ARG 183 CB -0.0026 0.0063 -0.0064 1473 ARG 183 CG -0.0024 0.0067 -0.0069 1474 ARG 183 CD -0.0017 0.0060 -0.0063 1475 ARG 183 NE -0.0021 0.0052 -0.0052 1476 ARG 183 CZ -0.0013 0.0044 -0.0045 1477 ARG 183 NH1 0.0000 0.0043 -0.0047 1478 ARG 183 NH2 -0.0018 0.0036 -0.0035 1479 LEU 184 N -0.0044 0.0056 -0.0051 1480 LEU 184 CA -0.0046 0.0052 -0.0046 1481 LEU 184 C -0.0036 0.0043 -0.0038 1482 LEU 184 O -0.0032 0.0040 -0.0036 1483 LEU 184 CB -0.0060 0.0050 -0.0040 1484 LEU 184 CG -0.0071 0.0058 -0.0047 1485 LEU 184 CD1 -0.0085 0.0056 -0.0041 1486 LEU 184 CD2 -0.0069 0.0067 -0.0057 1487 THR 185 N -0.0025 0.0046 -0.0030 1488 THR 185 CA -0.0019 0.0040 -0.0024 1489 THR 185 C -0.0009 0.0040 -0.0026 1490 THR 185 O -0.0007 0.0035 -0.0021 1491 THR 185 CB -0.0017 0.0037 -0.0021 1492 THR 185 CG2 -0.0010 0.0031 -0.0015 1493 THR 185 OG1 -0.0026 0.0037 -0.0019 1494 PRO 186 N -0.0004 0.0044 -0.0032 1495 PRO 186 CA 0.0006 0.0044 -0.0034 1496 PRO 186 C 0.0004 0.0044 -0.0034 1497 PRO 186 O 0.0009 0.0040 -0.0030 1498 PRO 186 CB 0.0010 0.0050 -0.0042 1499 PRO 186 CG 0.0006 0.0051 -0.0042 1500 PRO 186 CD -0.0005 0.0049 -0.0039 1501 GLN 187 N -0.0003 0.0049 -0.0038 1502 GLN 187 CA -0.0004 0.0050 -0.0039 1503 GLN 187 C -0.0008 0.0044 -0.0031 1504 GLN 187 O -0.0005 0.0042 -0.0029 1505 GLN 187 CB -0.0011 0.0056 -0.0045 1506 GLN 187 CG -0.0010 0.0061 -0.0052 1507 GLN 187 CD 0.0000 0.0063 -0.0057 1508 GLN 187 NE2 0.0004 0.0066 -0.0061 1509 GLN 187 OE1 0.0005 0.0062 -0.0057 1510 ALA 188 N -0.0015 0.0039 -0.0037 1511 ALA 188 CA -0.0019 0.0032 -0.0029 1512 ALA 188 C -0.0011 0.0028 -0.0022 1513 ALA 188 O -0.0010 0.0023 -0.0016 1514 ALA 188 CB -0.0028 0.0030 -0.0029 1515 PHE 189 N -0.0004 0.0030 -0.0023 1516 PHE 189 CA 0.0005 0.0026 -0.0017 1517 PHE 189 C 0.0012 0.0027 -0.0016 1518 PHE 189 O 0.0015 0.0022 -0.0009 1519 PHE 189 CB 0.0011 0.0029 -0.0019 1520 PHE 189 CG 0.0021 0.0027 -0.0014 1521 PHE 189 CD1 0.0022 0.0020 -0.0006 1522 PHE 189 CD2 0.0030 0.0032 -0.0018 1523 PHE 189 CE1 0.0031 0.0018 -0.0001 1524 PHE 189 CE2 0.0039 0.0030 -0.0013 1525 PHE 189 CZ 0.0040 0.0023 -0.0005 1526 SER 190 N 0.0014 0.0033 -0.0022 1527 SER 190 CA 0.0021 0.0033 -0.0021 1528 SER 190 C 0.0016 0.0029 -0.0017 1529 SER 190 O 0.0020 0.0025 -0.0012 1530 SER 190 CB 0.0023 0.0040 -0.0030 1531 SER 190 OG 0.0028 0.0045 -0.0034 1532 HIS 191 N 0.0003 0.0029 -0.0029 1533 HIS 191 CA -0.0004 0.0023 -0.0024 1534 HIS 191 C -0.0005 0.0015 -0.0013 1535 HIS 191 O -0.0004 0.0010 -0.0006 1536 HIS 191 CB -0.0016 0.0023 -0.0030 1537 HIS 191 CG -0.0023 0.0019 -0.0028 1538 HIS 191 CD2 -0.0020 0.0015 -0.0020 1539 HIS 191 ND1 -0.0034 0.0019 -0.0033 1540 HIS 191 CE1 -0.0038 0.0015 -0.0029 1541 HIS 191 NE2 -0.0030 0.0013 -0.0021 1542 PHE 192 N -0.0005 0.0014 -0.0012 1543 PHE 192 CA -0.0005 0.0007 -0.0002 1544 PHE 192 C 0.0006 0.0006 0.0006 1545 PHE 192 O 0.0006 -0.0000 0.0015 1546 PHE 192 CB -0.0007 0.0007 -0.0003 1547 PHE 192 CG -0.0006 0.0001 0.0007 1548 PHE 192 CD1 -0.0015 -0.0005 0.0012 1549 PHE 192 CD2 0.0005 0.0002 0.0012 1550 PHE 192 CE1 -0.0014 -0.0011 0.0022 1551 PHE 192 CE2 0.0007 -0.0004 0.0021 1552 PHE 192 CZ -0.0003 -0.0011 0.0026 1553 THR 193 N 0.0016 0.0012 0.0002 1554 THR 193 CA 0.0027 0.0011 0.0008 1555 THR 193 C 0.0028 0.0009 0.0011 1556 THR 193 O 0.0032 0.0005 0.0020 1557 THR 193 CB 0.0037 0.0018 0.0003 1558 THR 193 CG2 0.0038 0.0019 0.0001 1559 THR 193 OG1 0.0036 0.0024 -0.0006 1560 PHE 194 N 0.0025 0.0016 0.0003 1561 PHE 194 CA 0.0025 0.0012 0.0008 1562 PHE 194 C 0.0018 0.0001 0.0017 1563 PHE 194 O 0.0023 -0.0004 0.0027 1564 PHE 194 CB 0.0020 0.0016 -0.0002 1565 PHE 194 CG 0.0020 0.0013 0.0003 1566 PHE 194 CD1 0.0031 0.0017 0.0006 1567 PHE 194 CD2 0.0009 0.0005 0.0004 1568 PHE 194 CE1 0.0031 0.0013 0.0011 1569 PHE 194 CE2 0.0009 0.0002 0.0008 1570 PHE 194 CZ 0.0020 0.0006 0.0012 1571 GLU 195 N 0.0006 -0.0004 0.0014 1572 GLU 195 CA -0.0002 -0.0015 0.0022 1573 GLU 195 C 0.0003 -0.0021 0.0032 1574 GLU 195 O 0.0003 -0.0028 0.0042 1575 GLU 195 CB -0.0016 -0.0018 0.0015 1576 GLU 195 CG -0.0022 -0.0015 0.0006 1577 GLU 195 CD -0.0036 -0.0023 0.0006 1578 GLU 195 OE1 -0.0041 -0.0031 0.0012 1579 GLU 195 OE2 -0.0042 -0.0022 0.0000 1580 ARG 196 N 0.0006 -0.0017 0.0030 1581 ARG 196 CA 0.0009 -0.0023 0.0040 1582 ARG 196 C 0.0022 -0.0023 0.0049 1583 ARG 196 O 0.0023 -0.0030 0.0060 1584 ARG 196 CB 0.0010 -0.0018 0.0035 1585 ARG 196 CG 0.0011 -0.0024 0.0043 1586 ARG 196 CD -0.0002 -0.0034 0.0046 1587 ARG 196 NE -0.0003 -0.0038 0.0050 1588 ARG 196 CZ 0.0001 -0.0045 0.0062 1589 ARG 196 NH1 0.0006 -0.0048 0.0070 1590 ARG 196 NH2 -0.0001 -0.0048 0.0065 1591 SER 197 N 0.0031 -0.0021 0.0044 1592 SER 197 CA 0.0045 -0.0020 0.0054 1593 SER 197 C 0.0045 -0.0028 0.0062 1594 SER 197 O 0.0056 -0.0027 0.0071 1595 SER 197 CB 0.0055 -0.0007 0.0048 1596 SER 197 OG 0.0053 -0.0002 0.0041 1597 GLY 198 N 0.0033 -0.0034 0.0060 1598 GLY 198 CA 0.0032 -0.0041 0.0067 1599 GLY 198 C 0.0040 -0.0033 0.0064 1600 GLY 198 O 0.0047 -0.0036 0.0072 1601 HIS 199 N 0.0039 -0.0022 0.0052 1602 HIS 199 CA 0.0045 -0.0013 0.0047 1603 HIS 199 C 0.0061 -0.0007 0.0053 1604 HIS 199 O 0.0069 -0.0000 0.0052 1605 HIS 199 CB 0.0041 -0.0018 0.0050 1606 HIS 199 CG 0.0026 -0.0024 0.0044 1607 HIS 199 CD2 0.0018 -0.0031 0.0046 1608 HIS 199 ND1 0.0016 -0.0024 0.0036 1609 HIS 199 CE1 0.0003 -0.0030 0.0033 1610 HIS 199 NE2 0.0004 -0.0034 0.0039 1611 GLN 200 N 0.0065 -0.0017 0.0046 1612 GLN 200 CA 0.0079 -0.0013 0.0050 1613 GLN 200 C 0.0085 -0.0003 0.0042 1614 GLN 200 O 0.0097 0.0002 0.0043 1615 GLN 200 CB 0.0083 -0.0020 0.0061 1616 GLN 200 CG 0.0080 -0.0030 0.0071 1617 GLN 200 CD 0.0084 -0.0037 0.0081 1618 GLN 200 NE2 0.0081 -0.0046 0.0089 1619 GLN 200 OE1 0.0089 -0.0034 0.0080 1620 LEU 201 N 0.0078 0.0000 0.0034 1621 LEU 201 CA 0.0083 0.0010 0.0025 1622 LEU 201 C 0.0072 0.0013 0.0015 1623 LEU 201 O 0.0061 0.0007 0.0016 1624 LEU 201 CB 0.0091 0.0010 0.0029 1625 LEU 201 CG 0.0084 0.0005 0.0031 1626 LEU 201 CD1 0.0081 0.0012 0.0021 1627 LEU 201 CD2 0.0092 0.0000 0.0042 1628 ILE 202 N 0.0075 0.0022 0.0006 1629 ILE 202 CA 0.0066 0.0027 -0.0004 1630 ILE 202 C 0.0073 0.0035 -0.0010 1631 ILE 202 O 0.0084 0.0041 -0.0010 1632 ILE 202 CB 0.0060 0.0030 -0.0011 1633 ILE 202 CG1 0.0050 0.0034 -0.0022 1634 ILE 202 CG2 0.0070 0.0037 -0.0014 1635 ILE 202 CD1 0.0043 0.0037 -0.0029 1636 VAL 203 N 0.0061 0.0033 -0.0014 1637 VAL 203 CA 0.0062 0.0033 -0.0014 1638 VAL 203 C 0.0058 0.0041 -0.0018 1639 VAL 203 O 0.0050 0.0043 -0.0016 1640 VAL 203 CB 0.0059 0.0027 -0.0009 1641 VAL 203 CG1 0.0061 0.0027 -0.0010 1642 VAL 203 CG2 0.0062 0.0019 -0.0005 1643 VAL 204 N 0.0063 0.0045 -0.0023 1644 VAL 204 CA 0.0059 0.0053 -0.0026 1645 VAL 204 C 0.0064 0.0053 -0.0028 1646 VAL 204 O 0.0067 0.0048 -0.0026 1647 VAL 204 CB 0.0061 0.0058 -0.0031 1648 VAL 204 CG1 0.0070 0.0059 -0.0035 1649 VAL 204 CG2 0.0054 0.0066 -0.0033 1650 ASP 205 N 0.0063 0.0060 -0.0033 1651 ASP 205 CA 0.0065 0.0062 -0.0035 1652 ASP 205 C 0.0060 0.0058 -0.0030 1653 ASP 205 O 0.0064 0.0055 -0.0029 1654 ASP 205 CB 0.0075 0.0059 -0.0036 1655 ASP 205 CG 0.0079 0.0065 -0.0042 1656 ASP 205 OD1 0.0075 0.0070 -0.0044 1657 ASP 205 OD2 0.0087 0.0065 -0.0045 1658 ILE 206 N 0.0048 0.0052 -0.0034 1659 ILE 206 CA 0.0043 0.0049 -0.0029 1660 ILE 206 C 0.0042 0.0051 -0.0029 1661 ILE 206 O 0.0040 0.0057 -0.0030 1662 ILE 206 CB 0.0038 0.0051 -0.0025 1663 ILE 206 CG1 0.0039 0.0050 -0.0026 1664 ILE 206 CG2 0.0033 0.0047 -0.0019 1665 ILE 206 CD1 0.0042 0.0042 -0.0024 1666 GLN 207 N 0.0043 0.0046 -0.0027 1667 GLN 207 CA 0.0042 0.0047 -0.0027 1668 GLN 207 C 0.0041 0.0040 -0.0022 1669 GLN 207 O 0.0043 0.0034 -0.0021 1670 GLN 207 CB 0.0048 0.0048 -0.0032 1671 GLN 207 CG 0.0054 0.0043 -0.0035 1672 GLN 207 CD 0.0059 0.0045 -0.0041 1673 GLN 207 NE2 0.0064 0.0044 -0.0044 1674 GLN 207 OE1 0.0059 0.0048 -0.0042 1675 GLY 208 N 0.0038 0.0041 -0.0020 1676 GLY 208 CA 0.0037 0.0036 -0.0016 1677 GLY 208 C 0.0031 0.0038 -0.0012 1678 GLY 208 O 0.0029 0.0044 -0.0014 1679 VAL 209 N 0.0028 0.0024 -0.0005 1680 VAL 209 CA 0.0023 0.0025 0.0001 1681 VAL 209 C 0.0022 0.0026 0.0003 1682 VAL 209 O 0.0021 0.0022 0.0002 1683 VAL 209 CB 0.0021 0.0020 0.0003 1684 VAL 209 CG1 0.0016 0.0021 0.0008 1685 VAL 209 CG2 0.0022 0.0019 0.0001 1686 GLY 210 N 0.0021 0.0032 0.0005 1687 GLY 210 CA 0.0020 0.0033 0.0007 1688 GLY 210 C 0.0023 0.0033 0.0002 1689 GLY 210 O 0.0027 0.0036 -0.0001 1690 ASP 211 N 0.0023 0.0028 0.0002 1691 ASP 211 CA 0.0026 0.0027 -0.0002 1692 ASP 211 C 0.0027 0.0020 -0.0005 1693 ASP 211 O 0.0029 0.0018 -0.0007 1694 ASP 211 CB 0.0024 0.0027 0.0000 1695 ASP 211 CG 0.0024 0.0034 0.0002 1696 ASP 211 OD1 0.0027 0.0038 -0.0001 1697 ASP 211 OD2 0.0022 0.0035 0.0005 1698 LEU 212 N 0.0031 0.0020 0.0006 1699 LEU 212 CA 0.0034 0.0017 0.0006 1700 LEU 212 C 0.0036 0.0018 0.0002 1701 LEU 212 O 0.0037 0.0019 -0.0000 1702 LEU 212 CB 0.0035 0.0015 0.0007 1703 LEU 212 CG 0.0035 0.0012 0.0011 1704 LEU 212 CD1 0.0032 0.0013 0.0014 1705 LEU 212 CD2 0.0036 0.0009 0.0012 1706 TYR 213 N 0.0037 0.0018 0.0000 1707 TYR 213 CA 0.0039 0.0019 -0.0003 1708 TYR 213 C 0.0042 0.0016 -0.0005 1709 TYR 213 O 0.0043 0.0014 -0.0003 1710 TYR 213 CB 0.0038 0.0021 -0.0004 1711 TYR 213 CG 0.0035 0.0024 -0.0003 1712 TYR 213 CD1 0.0033 0.0026 -0.0002 1713 TYR 213 CD2 0.0033 0.0025 -0.0001 1714 TYR 213 CE1 0.0030 0.0029 -0.0001 1715 TYR 213 CE2 0.0030 0.0028 -0.0000 1716 TYR 213 CZ 0.0029 0.0030 0.0000 1717 TYR 213 OH 0.0026 0.0032 0.0001 1718 THR 214 N 0.0044 0.0017 -0.0008 1719 THR 214 CA 0.0047 0.0015 -0.0010 1720 THR 214 C 0.0048 0.0017 -0.0014 1721 THR 214 O 0.0046 0.0020 -0.0015 1722 THR 214 CB 0.0048 0.0013 -0.0010 1723 THR 214 CG2 0.0048 0.0015 -0.0012 1724 THR 214 OG1 0.0051 0.0010 -0.0011 1725 ASP 215 N 0.0052 0.0025 0.0001 1726 ASP 215 CA 0.0060 0.0030 -0.0002 1727 ASP 215 C 0.0064 0.0035 -0.0003 1728 ASP 215 O 0.0066 0.0043 -0.0002 1729 ASP 215 CB 0.0059 0.0036 0.0001 1730 ASP 215 CG 0.0067 0.0040 -0.0003 1731 ASP 215 OD1 0.0072 0.0035 -0.0008 1732 ASP 215 OD2 0.0068 0.0048 -0.0001 1733 PRO 216 N 0.0066 0.0031 -0.0006 1734 PRO 216 CA 0.0070 0.0035 -0.0007 1735 PRO 216 C 0.0079 0.0035 -0.0013 1736 PRO 216 O 0.0081 0.0031 -0.0016 1737 PRO 216 CB 0.0068 0.0029 -0.0008 1738 PRO 216 CG 0.0066 0.0020 -0.0010 1739 PRO 216 CD 0.0063 0.0021 -0.0007 1740 GLN 217 N 0.0084 0.0040 -0.0014 1741 GLN 217 CA 0.0092 0.0041 -0.0020 1742 GLN 217 C 0.0095 0.0039 -0.0022 1743 GLN 217 O 0.0092 0.0042 -0.0019 1744 GLN 217 CB 0.0096 0.0050 -0.0020 1745 GLN 217 CG 0.0105 0.0051 -0.0025 1746 GLN 217 CD 0.0107 0.0043 -0.0029 1747 GLN 217 NE2 0.0104 0.0042 -0.0027 1748 GLN 217 OE1 0.0112 0.0039 -0.0034 1749 ILE 218 N 0.0102 0.0045 -0.0019 1750 ILE 218 CA 0.0101 0.0035 -0.0015 1751 ILE 218 C 0.0110 0.0037 -0.0014 1752 ILE 218 O 0.0121 0.0040 -0.0013 1753 ILE 218 CB 0.0104 0.0024 -0.0010 1754 ILE 218 CG1 0.0094 0.0022 -0.0011 1755 ILE 218 CG2 0.0104 0.0014 -0.0006 1756 ILE 218 CD1 0.0095 0.0011 -0.0007 1757 HIS 219 N 0.0106 0.0036 -0.0014 1758 HIS 219 CA 0.0114 0.0036 -0.0013 1759 HIS 219 C 0.0115 0.0023 -0.0007 1760 HIS 219 O 0.0106 0.0017 -0.0007 1761 HIS 219 CB 0.0109 0.0042 -0.0016 1762 HIS 219 CG 0.0108 0.0055 -0.0022 1763 HIS 219 CD2 0.0099 0.0061 -0.0026 1764 HIS 219 ND1 0.0118 0.0062 -0.0023 1765 HIS 219 CE1 0.0114 0.0073 -0.0028 1766 HIS 219 NE2 0.0103 0.0072 -0.0030 1767 THR 220 N 0.0126 0.0020 -0.0003 1768 THR 220 CA 0.0128 0.0008 0.0002 1769 THR 220 C 0.0134 0.0007 0.0003 1770 THR 220 O 0.0138 0.0016 0.0001 1771 THR 220 CB 0.0136 0.0003 0.0006 1772 THR 220 CG2 0.0131 0.0004 0.0004 1773 THR 220 OG1 0.0148 0.0008 0.0006 1774 GLU 221 N 0.0120 0.0002 0.0038 1775 GLU 221 CA 0.0119 0.0005 0.0035 1776 GLU 221 C 0.0137 0.0006 0.0028 1777 GLU 221 O 0.0138 0.0015 0.0018 1778 GLU 221 CB 0.0112 -0.0004 0.0047 1779 GLU 221 CG 0.0115 -0.0004 0.0046 1780 GLU 221 CD 0.0114 -0.0016 0.0060 1781 GLU 221 OE1 0.0106 -0.0023 0.0070 1782 GLU 221 OE2 0.0120 -0.0019 0.0061 1783 THR 222 N 0.0150 -0.0003 0.0034 1784 THR 222 CA 0.0167 -0.0004 0.0029 1785 THR 222 C 0.0176 0.0005 0.0017 1786 THR 222 O 0.0186 0.0010 0.0008 1787 THR 222 CB 0.0178 -0.0016 0.0040 1788 THR 222 CG2 0.0172 -0.0025 0.0051 1789 THR 222 OG1 0.0178 -0.0021 0.0045 1790 GLY 223 N 0.0172 0.0007 0.0016 1791 GLY 223 CA 0.0180 0.0015 0.0005 1792 GLY 223 C 0.0199 0.0010 0.0004 1793 GLY 223 O 0.0208 0.0017 -0.0006 1794 THR 224 N 0.0184 0.0003 0.0005 1795 THR 224 CA 0.0189 0.0006 0.0008 1796 THR 224 C 0.0179 0.0010 0.0004 1797 THR 224 O 0.0181 0.0017 0.0006 1798 THR 224 CB 0.0197 -0.0006 0.0010 1799 THR 224 CG2 0.0207 -0.0010 0.0015 1800 THR 224 OG1 0.0189 -0.0018 0.0004 1801 ASP 225 N 0.0167 0.0006 -0.0002 1802 ASP 225 CA 0.0157 0.0008 -0.0006 1803 ASP 225 C 0.0147 0.0019 -0.0010 1804 ASP 225 O 0.0148 0.0023 -0.0008 1805 ASP 225 CB 0.0152 -0.0005 -0.0011 1806 ASP 225 CG 0.0149 -0.0014 -0.0014 1807 ASP 225 OD1 0.0157 -0.0013 -0.0010 1808 ASP 225 OD2 0.0140 -0.0021 -0.0020 1809 PHE 226 N 0.0138 0.0022 -0.0013 1810 PHE 226 CA 0.0127 0.0031 -0.0017 1811 PHE 226 C 0.0130 0.0046 -0.0013 1812 PHE 226 O 0.0124 0.0052 -0.0015 1813 PHE 226 CB 0.0120 0.0025 -0.0021 1814 PHE 226 CG 0.0115 0.0012 -0.0026 1815 PHE 226 CD1 0.0111 0.0009 -0.0029 1816 PHE 226 CD2 0.0113 0.0002 -0.0029 1817 PHE 226 CE1 0.0106 -0.0003 -0.0033 1818 PHE 226 CE2 0.0108 -0.0010 -0.0033 1819 PHE 226 CZ 0.0105 -0.0012 -0.0035 1820 GLY 227 N 0.0141 0.0048 -0.0020 1821 GLY 227 CA 0.0142 0.0051 -0.0019 1822 GLY 227 C 0.0143 0.0055 -0.0020 1823 GLY 227 O 0.0145 0.0055 -0.0020 1824 ASP 228 N 0.0143 0.0058 -0.0019 1825 ASP 228 CA 0.0145 0.0062 -0.0019 1826 ASP 228 C 0.0143 0.0065 -0.0018 1827 ASP 228 O 0.0144 0.0068 -0.0018 1828 ASP 228 CB 0.0146 0.0064 -0.0020 1829 ASP 228 CG 0.0150 0.0062 -0.0021 1830 ASP 228 OD1 0.0152 0.0060 -0.0022 1831 ASP 228 OD2 0.0150 0.0063 -0.0021 1832 GLY 229 N 0.0139 0.0064 -0.0017 1833 GLY 229 CA 0.0137 0.0066 -0.0016 1834 GLY 229 C 0.0137 0.0065 -0.0016 1835 GLY 229 O 0.0136 0.0067 -0.0015 1836 ASN 230 N 0.0151 0.0061 -0.0021 1837 ASN 230 CA 0.0149 0.0053 -0.0018 1838 ASN 230 C 0.0156 0.0060 -0.0020 1839 ASN 230 O 0.0168 0.0058 -0.0019 1840 ASN 230 CB 0.0155 0.0040 -0.0013 1841 ASN 230 CG 0.0151 0.0031 -0.0010 1842 ASN 230 ND2 0.0153 0.0019 -0.0006 1843 ASN 230 OD1 0.0146 0.0034 -0.0011 1844 LEU 231 N 0.0148 0.0066 -0.0022 1845 LEU 231 CA 0.0152 0.0072 -0.0024 1846 LEU 231 C 0.0152 0.0063 -0.0021 1847 LEU 231 O 0.0154 0.0068 -0.0023 1848 LEU 231 CB 0.0144 0.0084 -0.0029 1849 LEU 231 CG 0.0145 0.0094 -0.0032 1850 LEU 231 CD1 0.0136 0.0105 -0.0036 1851 LEU 231 CD2 0.0159 0.0098 -0.0033 1852 GLY 232 N 0.0149 0.0052 -0.0017 1853 GLY 232 CA 0.0149 0.0042 -0.0014 1854 GLY 232 C 0.0138 0.0045 -0.0015 1855 GLY 232 O 0.0127 0.0050 -0.0017 1856 VAL 233 N 0.0149 0.0039 0.0013 1857 VAL 233 CA 0.0129 0.0038 0.0010 1858 VAL 233 C 0.0124 0.0055 -0.0005 1859 VAL 233 O 0.0106 0.0057 -0.0012 1860 VAL 233 CB 0.0130 0.0028 0.0018 1861 VAL 233 CG1 0.0132 0.0011 0.0032 1862 VAL 233 CG2 0.0148 0.0035 0.0016 1863 ARG 234 N 0.0139 0.0067 -0.0011 1864 ARG 234 CA 0.0135 0.0083 -0.0026 1865 ARG 234 C 0.0123 0.0089 -0.0033 1866 ARG 234 O 0.0108 0.0095 -0.0042 1867 ARG 234 CB 0.0155 0.0095 -0.0030 1868 ARG 234 CG 0.0166 0.0092 -0.0025 1869 ARG 234 CD 0.0186 0.0104 -0.0030 1870 ARG 234 NE 0.0201 0.0101 -0.0024 1871 ARG 234 CZ 0.0207 0.0111 -0.0031 1872 ARG 234 NH1 0.0199 0.0125 -0.0043 1873 ARG 234 NH2 0.0221 0.0107 -0.0024 1874 GLY 235 N 0.0130 0.0085 -0.0029 1875 GLY 235 CA 0.0118 0.0089 -0.0035 1876 GLY 235 C 0.0097 0.0080 -0.0033 1877 GLY 235 O 0.0083 0.0088 -0.0043 1878 MET 236 N 0.0096 0.0067 -0.0028 1879 MET 236 CA 0.0079 0.0060 -0.0026 1880 MET 236 C 0.0068 0.0066 -0.0035 1881 MET 236 O 0.0055 0.0068 -0.0041 1882 MET 236 CB 0.0079 0.0047 -0.0013 1883 MET 236 CG 0.0090 0.0040 -0.0003 1884 MET 236 SD 0.0089 0.0025 0.0012 1885 MET 236 CE 0.0103 0.0020 0.0021 1886 ALA 237 N 0.0074 0.0070 -0.0037 1887 ALA 237 CA 0.0065 0.0077 -0.0046 1888 ALA 237 C 0.0061 0.0088 -0.0059 1889 ALA 237 O 0.0047 0.0090 -0.0065 1890 ALA 237 CB 0.0075 0.0080 -0.0046 1891 LEU 238 N 0.0074 0.0095 -0.0062 1892 LEU 238 CA 0.0071 0.0107 -0.0074 1893 LEU 238 C 0.0057 0.0104 -0.0075 1894 LEU 238 O 0.0048 0.0111 -0.0085 1895 LEU 238 CB 0.0087 0.0113 -0.0075 1896 LEU 238 CG 0.0101 0.0119 -0.0077 1897 LEU 238 CD1 0.0117 0.0125 -0.0079 1898 LEU 238 CD2 0.0094 0.0129 -0.0089 1899 PHE 239 N 0.0059 0.0084 -0.0077 1900 PHE 239 CA 0.0044 0.0080 -0.0074 1901 PHE 239 C 0.0024 0.0081 -0.0075 1902 PHE 239 O 0.0011 0.0087 -0.0084 1903 PHE 239 CB 0.0047 0.0067 -0.0058 1904 PHE 239 CG 0.0032 0.0063 -0.0054 1905 PHE 239 CD1 0.0032 0.0067 -0.0059 1906 PHE 239 CD2 0.0016 0.0054 -0.0044 1907 PHE 239 CE1 0.0018 0.0063 -0.0055 1908 PHE 239 CE2 0.0002 0.0050 -0.0040 1909 PHE 239 CZ 0.0003 0.0055 -0.0046 1910 PHE 240 N 0.0021 0.0074 -0.0068 1911 PHE 240 CA 0.0001 0.0072 -0.0067 1912 PHE 240 C -0.0007 0.0084 -0.0081 1913 PHE 240 O -0.0024 0.0085 -0.0083 1914 PHE 240 CB 0.0000 0.0061 -0.0053 1915 PHE 240 CG -0.0001 0.0048 -0.0038 1916 PHE 240 CD1 -0.0017 0.0045 -0.0035 1917 PHE 240 CD2 0.0015 0.0040 -0.0027 1918 PHE 240 CE1 -0.0018 0.0033 -0.0021 1919 PHE 240 CE2 0.0014 0.0028 -0.0014 1920 PHE 240 CZ -0.0002 0.0025 -0.0010 1921 TYR 241 N 0.0007 0.0094 -0.0092 1922 TYR 241 CA -0.0000 0.0106 -0.0107 1923 TYR 241 C -0.0011 0.0113 -0.0115 1924 TYR 241 O -0.0023 0.0121 -0.0126 1925 TYR 241 CB 0.0017 0.0114 -0.0115 1926 TYR 241 CG 0.0012 0.0128 -0.0131 1927 TYR 241 CD1 0.0004 0.0129 -0.0134 1928 TYR 241 CD2 0.0016 0.0138 -0.0144 1929 TYR 241 CE1 -0.0001 0.0141 -0.0149 1930 TYR 241 CE2 0.0011 0.0150 -0.0158 1931 TYR 241 CZ 0.0002 0.0152 -0.0161 1932 TYR 241 OH -0.0002 0.0164 -0.0175 1933 SER 242 N 0.0007 0.0098 -0.0094 1934 SER 242 CA -0.0001 0.0104 -0.0102 1935 SER 242 C -0.0013 0.0096 -0.0097 1936 SER 242 O -0.0022 0.0101 -0.0103 1937 SER 242 CB 0.0012 0.0110 -0.0107 1938 SER 242 OG 0.0025 0.0116 -0.0110 1939 HIS 243 N -0.0013 0.0085 -0.0085 1940 HIS 243 CA -0.0022 0.0078 -0.0079 1941 HIS 243 C -0.0040 0.0076 -0.0081 1942 HIS 243 O -0.0043 0.0072 -0.0077 1943 HIS 243 CB -0.0016 0.0066 -0.0066 1944 HIS 243 CG -0.0026 0.0058 -0.0060 1945 HIS 243 CD2 -0.0034 0.0048 -0.0051 1946 HIS 243 ND1 -0.0028 0.0059 -0.0062 1947 HIS 243 CE1 -0.0037 0.0051 -0.0054 1948 HIS 243 NE2 -0.0041 0.0043 -0.0048 1949 ALA 244 N -0.0050 0.0079 -0.0086 1950 ALA 244 CA -0.0068 0.0076 -0.0086 1951 ALA 244 C -0.0073 0.0067 -0.0077 1952 ALA 244 O -0.0073 0.0068 -0.0079 1953 ALA 244 CB -0.0076 0.0087 -0.0098 1954 CYS 245 N -0.0071 0.0047 -0.0064 1955 CYS 245 CA -0.0073 0.0042 -0.0056 1956 CYS 245 C -0.0081 0.0043 -0.0058 1957 CYS 245 O -0.0089 0.0046 -0.0062 1958 CYS 245 CB -0.0078 0.0037 -0.0049 1959 CYS 245 SG -0.0068 0.0033 -0.0042 1960 ASN 246 N -0.0078 0.0041 -0.0054 1961 ASN 246 CA -0.0085 0.0041 -0.0055 1962 ASN 246 C -0.0091 0.0036 -0.0046 1963 ASN 246 O -0.0091 0.0032 -0.0040 1964 ASN 246 CB -0.0078 0.0043 -0.0058 1965 ASN 246 CG -0.0068 0.0039 -0.0052 1966 ASN 246 ND2 -0.0059 0.0041 -0.0056 1967 ASN 246 OD1 -0.0070 0.0034 -0.0044 1968 ARG 247 N -0.0096 0.0035 -0.0046 1969 ARG 247 CA -0.0103 0.0030 -0.0038 1970 ARG 247 C -0.0096 0.0025 -0.0029 1971 ARG 247 O -0.0100 0.0020 -0.0022 1972 ARG 247 CB -0.0111 0.0032 -0.0040 1973 ARG 247 CG -0.0105 0.0035 -0.0045 1974 ARG 247 CD -0.0114 0.0036 -0.0046 1975 ARG 247 NE -0.0109 0.0040 -0.0052 1976 ARG 247 CZ -0.0112 0.0045 -0.0061 1977 ARG 247 NH1 -0.0119 0.0048 -0.0065 1978 ARG 247 NH2 -0.0108 0.0048 -0.0065 1979 ILE 248 N -0.0080 0.0019 -0.0037 1980 ILE 248 CA -0.0073 0.0015 -0.0029 1981 ILE 248 C -0.0070 0.0011 -0.0022 1982 ILE 248 O -0.0070 0.0006 -0.0014 1983 ILE 248 CB -0.0062 0.0018 -0.0031 1984 ILE 248 CG1 -0.0065 0.0022 -0.0039 1985 ILE 248 CG2 -0.0056 0.0014 -0.0022 1986 ILE 248 CD1 -0.0055 0.0026 -0.0041 1987 CYS 249 N -0.0068 0.0014 -0.0027 1988 CYS 249 CA -0.0067 0.0011 -0.0022 1989 CYS 249 C -0.0077 0.0006 -0.0016 1990 CYS 249 O -0.0076 0.0001 -0.0008 1991 CYS 249 CB -0.0065 0.0016 -0.0029 1992 CYS 249 SG -0.0053 0.0023 -0.0035 1993 GLU 250 N -0.0087 0.0007 -0.0021 1994 GLU 250 CA -0.0097 0.0003 -0.0016 1995 GLU 250 C -0.0099 -0.0003 -0.0009 1996 GLU 250 O -0.0104 -0.0008 -0.0001 1997 GLU 250 CB -0.0107 0.0005 -0.0024 1998 GLU 250 CG -0.0106 0.0010 -0.0031 1999 GLU 250 CD -0.0112 0.0015 -0.0041 2000 GLU 250 OE1 -0.0118 0.0014 -0.0042 2001 GLU 250 OE2 -0.0112 0.0019 -0.0048 2002 SER 251 N -0.0094 -0.0003 -0.0018 2003 SER 251 CA -0.0096 -0.0008 -0.0011 2004 SER 251 C -0.0088 -0.0012 -0.0000 2005 SER 251 O -0.0091 -0.0018 0.0007 2006 SER 251 CB -0.0094 -0.0004 -0.0016 2007 SER 251 OG -0.0082 -0.0000 -0.0017 2008 MET 252 N -0.0079 -0.0010 0.0001 2009 MET 252 CA -0.0071 -0.0014 0.0011 2010 MET 252 C -0.0072 -0.0017 0.0015 2011 MET 252 O -0.0065 -0.0020 0.0023 2012 MET 252 CB -0.0058 -0.0009 0.0009 2013 MET 252 CG -0.0055 -0.0007 0.0006 2014 MET 252 SD -0.0040 -0.0002 0.0005 2015 MET 252 CE -0.0040 -0.0000 0.0003 2016 GLY 253 N -0.0081 -0.0017 0.0011 2017 GLY 253 CA -0.0083 -0.0021 0.0016 2018 GLY 253 C -0.0075 -0.0017 0.0014 2019 GLY 253 O -0.0074 -0.0021 0.0020 2020 LEU 254 N -0.0082 -0.0019 0.0003 2021 LEU 254 CA -0.0074 -0.0015 0.0001 2022 LEU 254 C -0.0084 -0.0016 -0.0006 2023 LEU 254 O -0.0092 -0.0014 -0.0018 2024 LEU 254 CB -0.0062 -0.0008 -0.0008 2025 LEU 254 CG -0.0053 -0.0007 -0.0003 2026 LEU 254 CD1 -0.0041 0.0001 -0.0013 2027 LEU 254 CD2 -0.0046 -0.0011 0.0012 2028 ALA 255 N -0.0085 -0.0019 0.0000 2029 ALA 255 CA -0.0094 -0.0020 -0.0006 2030 ALA 255 C -0.0088 -0.0013 -0.0018 2031 ALA 255 O -0.0075 -0.0009 -0.0017 2032 ALA 255 CB -0.0096 -0.0025 0.0006 2033 PRO 256 N -0.0096 -0.0011 -0.0029 2034 PRO 256 CA -0.0091 -0.0004 -0.0041 2035 PRO 256 C -0.0085 -0.0004 -0.0037 2036 PRO 256 O -0.0090 -0.0009 -0.0028 2037 PRO 256 CB -0.0104 -0.0004 -0.0052 2038 PRO 256 CG -0.0114 -0.0010 -0.0048 2039 PRO 256 CD -0.0112 -0.0015 -0.0032 2040 PHE 257 N -0.0087 0.0002 -0.0046 2041 PHE 257 CA -0.0073 0.0005 -0.0041 2042 PHE 257 C -0.0083 0.0007 -0.0050 2043 PHE 257 O -0.0095 0.0015 -0.0066 2044 PHE 257 CB -0.0053 0.0020 -0.0047 2045 PHE 257 CG -0.0035 0.0022 -0.0039 2046 PHE 257 CD1 -0.0022 0.0015 -0.0022 2047 PHE 257 CD2 -0.0033 0.0032 -0.0049 2048 PHE 257 CE1 -0.0006 0.0017 -0.0015 2049 PHE 257 CE2 -0.0017 0.0035 -0.0042 2050 PHE 257 CZ -0.0003 0.0027 -0.0025 2051 ASP 258 N -0.0079 0.0001 -0.0040 2052 ASP 258 CA -0.0090 0.0001 -0.0047 2053 ASP 258 C -0.0080 0.0017 -0.0060 2054 ASP 258 O -0.0063 0.0021 -0.0054 2055 ASP 258 CB -0.0089 -0.0012 -0.0031 2056 ASP 258 CG -0.0104 -0.0029 -0.0021 2057 ASP 258 OD1 -0.0123 -0.0032 -0.0029 2058 ASP 258 OD2 -0.0096 -0.0039 -0.0005 2059 LEU 259 N -0.0090 0.0027 -0.0077 2060 LEU 259 CA -0.0083 0.0043 -0.0091 2061 LEU 259 C -0.0096 0.0042 -0.0099 2062 LEU 259 O -0.0114 0.0032 -0.0098 2063 LEU 259 CB -0.0085 0.0055 -0.0106 2064 LEU 259 CG -0.0069 0.0060 -0.0103 2065 LEU 259 CD1 -0.0072 0.0073 -0.0119 2066 LEU 259 CD2 -0.0047 0.0066 -0.0097 2067 SER 260 N -0.0101 0.0058 -0.0110 2068 SER 260 CA -0.0117 0.0065 -0.0123 2069 SER 260 C -0.0136 0.0074 -0.0138 2070 SER 260 O -0.0133 0.0077 -0.0143 2071 SER 260 CB -0.0098 0.0076 -0.0135 2072 SER 260 OG -0.0091 0.0090 -0.0154 2073 PRO 261 N -0.0156 0.0078 -0.0147 2074 PRO 261 CA -0.0176 0.0087 -0.0163 2075 PRO 261 C -0.0163 0.0102 -0.0181 2076 PRO 261 O -0.0171 0.0105 -0.0187 2077 PRO 261 CB -0.0193 0.0090 -0.0170 2078 PRO 261 CG -0.0192 0.0077 -0.0152 2079 PRO 261 CD -0.0165 0.0073 -0.0141 2080 ARG 262 N -0.0145 0.0111 -0.0191 2081 ARG 262 CA -0.0131 0.0125 -0.0208 2082 ARG 262 C -0.0118 0.0121 -0.0201 2083 ARG 262 O -0.0123 0.0127 -0.0210 2084 ARG 262 CB -0.0111 0.0133 -0.0217 2085 ARG 262 CG -0.0122 0.0140 -0.0228 2086 ARG 262 CD -0.0125 0.0157 -0.0252 2087 ARG 262 NE -0.0099 0.0166 -0.0261 2088 ARG 262 CZ -0.0084 0.0171 -0.0266 2089 ARG 262 NH1 -0.0092 0.0168 -0.0263 2090 ARG 262 NH2 -0.0061 0.0180 -0.0274 2091 GLU 263 N -0.0097 0.0113 -0.0172 2092 GLU 263 CA -0.0086 0.0110 -0.0165 2093 GLU 263 C -0.0103 0.0103 -0.0160 2094 GLU 263 O -0.0100 0.0106 -0.0163 2095 GLU 263 CB -0.0070 0.0101 -0.0150 2096 GLU 263 CG -0.0054 0.0107 -0.0153 2097 GLU 263 CD -0.0045 0.0096 -0.0137 2098 GLU 263 OE1 -0.0054 0.0084 -0.0123 2099 GLU 263 OE2 -0.0028 0.0099 -0.0137 2100 ARG 264 N -0.0119 0.0095 -0.0153 2101 ARG 264 CA -0.0135 0.0088 -0.0148 2102 ARG 264 C -0.0147 0.0097 -0.0163 2103 ARG 264 O -0.0151 0.0096 -0.0163 2104 ARG 264 CB -0.0151 0.0077 -0.0138 2105 ARG 264 CG -0.0167 0.0068 -0.0130 2106 ARG 264 CD -0.0155 0.0060 -0.0116 2107 ARG 264 NE -0.0144 0.0051 -0.0102 2108 ARG 264 CZ -0.0149 0.0037 -0.0086 2109 ARG 264 NH1 -0.0166 0.0031 -0.0082 2110 ARG 264 NH2 -0.0138 0.0030 -0.0074 2111 ASP 265 N -0.0152 0.0108 -0.0178 2112 ASP 265 CA -0.0162 0.0118 -0.0193 2113 ASP 265 C -0.0147 0.0127 -0.0201 2114 ASP 265 O -0.0153 0.0131 -0.0208 2115 ASP 265 CB -0.0171 0.0126 -0.0206 2116 ASP 265 CG -0.0189 0.0118 -0.0200 2117 ASP 265 OD1 -0.0202 0.0109 -0.0191 2118 ASP 265 OD2 -0.0190 0.0120 -0.0203 2119 ALA 266 N -0.0124 0.0123 -0.0202 2120 ALA 266 CA -0.0106 0.0124 -0.0210 2121 ALA 266 C -0.0098 0.0117 -0.0196 2122 ALA 266 O -0.0090 0.0118 -0.0201 2123 ALA 266 CB -0.0089 0.0124 -0.0216 2124 VAL 267 N -0.0101 0.0109 -0.0177 2125 VAL 267 CA -0.0095 0.0102 -0.0163 2126 VAL 267 C -0.0112 0.0101 -0.0157 2127 VAL 267 O -0.0108 0.0097 -0.0149 2128 VAL 267 CB -0.0087 0.0093 -0.0146 2129 VAL 267 CG1 -0.0068 0.0093 -0.0151 2130 VAL 267 CG2 -0.0104 0.0091 -0.0136 2131 ASN 268 N -0.0131 0.0105 -0.0160 2132 ASN 268 CA -0.0148 0.0105 -0.0156 2133 ASN 268 C -0.0151 0.0112 -0.0172 2134 ASN 268 O -0.0162 0.0112 -0.0168 2135 ASN 268 CB -0.0168 0.0106 -0.0153 2136 ASN 268 CG -0.0170 0.0098 -0.0134 2137 ASN 268 ND2 -0.0182 0.0099 -0.0133 2138 ASN 268 OD1 -0.0160 0.0091 -0.0121 2139 GLN 269 N -0.0141 0.0114 -0.0174 2140 GLN 269 CA -0.0139 0.0118 -0.0190 2141 GLN 269 C -0.0128 0.0114 -0.0183 2142 GLN 269 O -0.0132 0.0117 -0.0192 2143 GLN 269 CB -0.0128 0.0121 -0.0209 2144 GLN 269 CG -0.0105 0.0117 -0.0208 2145 GLN 269 CD -0.0094 0.0120 -0.0227 2146 GLN 269 NE2 -0.0074 0.0118 -0.0231 2147 GLN 269 OE1 -0.0104 0.0124 -0.0239 2148 ASN 270 N -0.0115 0.0109 -0.0168 2149 ASN 270 CA -0.0104 0.0105 -0.0161 2150 ASN 270 C -0.0114 0.0102 -0.0141 2151 ASN 270 O -0.0103 0.0097 -0.0130 2152 ASN 270 CB -0.0081 0.0101 -0.0159 2153 ASN 270 CG -0.0076 0.0097 -0.0147 2154 ASN 270 ND2 -0.0073 0.0099 -0.0157 2155 ASN 270 OD1 -0.0076 0.0092 -0.0128 2156 THR 271 N -0.0134 0.0104 -0.0136 2157 THR 271 CA -0.0143 0.0100 -0.0117 2158 THR 271 C -0.0147 0.0101 -0.0118 2159 THR 271 O -0.0147 0.0097 -0.0102 2160 THR 271 CB -0.0164 0.0102 -0.0112 2161 THR 271 CG2 -0.0159 0.0099 -0.0102 2162 THR 271 OG1 -0.0175 0.0109 -0.0130 2163 LYS 272 N -0.0138 0.0102 -0.0124 2164 LYS 272 CA -0.0143 0.0103 -0.0126 2165 LYS 272 C -0.0130 0.0101 -0.0124 2166 LYS 272 O -0.0133 0.0098 -0.0117 2167 LYS 272 CB -0.0149 0.0111 -0.0141 2168 LEU 273 N -0.0116 0.0102 -0.0128 2169 LEU 273 CA -0.0103 0.0099 -0.0125 2170 LEU 273 C -0.0100 0.0091 -0.0110 2171 LEU 273 O -0.0095 0.0088 -0.0103 2172 LEU 273 CB -0.0089 0.0101 -0.0134 2173 LEU 274 N -0.0102 0.0088 -0.0103 2174 LEU 274 CA -0.0101 0.0081 -0.0088 2175 LEU 274 C -0.0112 0.0078 -0.0080 2176 LEU 274 O -0.0109 0.0073 -0.0069 2177 LEU 274 CB -0.0104 0.0079 -0.0083 2178 LEU 274 CG -0.0089 0.0075 -0.0078 2179 LEU 274 CD1 -0.0077 0.0079 -0.0090 2180 LEU 274 CD2 -0.0094 0.0073 -0.0072 2181 GLN 275 N -0.0124 0.0085 -0.0094 2182 GLN 275 CA -0.0134 0.0084 -0.0088 2183 GLN 275 C -0.0131 0.0084 -0.0089 2184 GLN 275 O -0.0136 0.0081 -0.0082 2185 GLN 275 CB -0.0147 0.0088 -0.0091 2186 GLN 275 CG -0.0156 0.0084 -0.0082 2187 GLN 275 CD -0.0159 0.0080 -0.0073 2188 GLN 275 NE2 -0.0158 0.0074 -0.0062 2189 GLN 275 OE1 -0.0161 0.0082 -0.0076 2190 SER 276 N -0.0124 0.0088 -0.0098 2191 SER 276 CA -0.0121 0.0089 -0.0101 2192 SER 276 C -0.0109 0.0084 -0.0096 2193 SER 276 O -0.0104 0.0085 -0.0098 2194 SER 276 CB -0.0120 0.0096 -0.0113 2195 SER 276 OG -0.0120 0.0097 -0.0116 2196 ALA 277 N -0.0103 0.0080 -0.0089 2197 ALA 277 CA -0.0092 0.0075 -0.0083 2198 ALA 277 C -0.0094 0.0071 -0.0075 2199 ALA 277 O -0.0105 0.0070 -0.0070 2200 ALA 277 CB -0.0086 0.0071 -0.0077 2201 LYS 278 N -0.0086 0.0071 -0.0077 2202 LYS 278 CA -0.0087 0.0070 -0.0076 2203 LYS 278 C -0.0086 0.0066 -0.0068 2204 LYS 278 O -0.0089 0.0064 -0.0066 2205 LYS 278 CB -0.0080 0.0074 -0.0079 2206 LYS 278 CG -0.0079 0.0079 -0.0087 2207 ILE 280 N -0.0088 0.0045 -0.0056 2208 ILE 280 CA -0.0098 0.0039 -0.0053 2209 ILE 280 C -0.0096 0.0032 -0.0043 2210 ILE 280 O -0.0090 0.0030 -0.0039 2211 ILE 280 CB -0.0107 0.0040 -0.0057 2212 ILE 280 CG1 -0.0108 0.0036 -0.0052 2213 ILE 280 CG2 -0.0107 0.0048 -0.0066 2214 ILE 280 CD1 -0.0117 0.0037 -0.0056 2215 LEU 281 N -0.0102 0.0027 -0.0039 2216 LEU 281 CA -0.0101 0.0019 -0.0029 2217 LEU 281 C -0.0108 0.0015 -0.0026 2218 LEU 281 O -0.0117 0.0016 -0.0031 2219 LEU 281 CB -0.0103 0.0016 -0.0026 2220 LEU 281 CG -0.0095 0.0019 -0.0028 2221 LEU 281 CD1 -0.0099 0.0017 -0.0026 2222 LEU 281 CD2 -0.0084 0.0018 -0.0022 2223 ARG 282 N -0.0105 0.0009 -0.0018 2224 ARG 282 CA -0.0111 0.0004 -0.0014 2225 ARG 282 C -0.0117 -0.0003 -0.0008 2226 ARG 282 O -0.0126 -0.0006 -0.0007 2227 ARG 282 CB -0.0103 0.0002 -0.0010 2228 GLY 283 N -0.0105 -0.0007 -0.0008 2229 GLY 283 CA -0.0110 -0.0014 -0.0001 2230 GLY 283 C -0.0103 -0.0018 0.0008 2231 GLY 283 O -0.0105 -0.0024 0.0014 2232 THR 284 N -0.0096 -0.0017 0.0009 2233 THR 284 CA -0.0088 -0.0021 0.0017 2234 THR 284 C -0.0080 -0.0020 0.0018 2235 THR 284 O -0.0073 -0.0022 0.0025 2236 THR 284 CB -0.0084 -0.0020 0.0017 2237 THR 284 CG2 -0.0092 -0.0020 0.0014 2238 THR 284 OG1 -0.0076 -0.0013 0.0012 2239 GLU 285 N -0.0080 -0.0015 0.0013 2240 GLU 285 CA -0.0072 -0.0014 0.0014 2241 GLU 285 C -0.0073 -0.0020 0.0021 2242 GLU 285 O -0.0081 -0.0022 0.0021 2243 GLU 285 CB -0.0072 -0.0007 0.0005 2244 GLU 285 CG -0.0069 -0.0001 -0.0002 2245 GLU 285 CD -0.0077 0.0000 -0.0007 2246 GLU 285 OE1 -0.0087 -0.0003 -0.0007 2247 GLU 285 OE2 -0.0075 0.0004 -0.0011 2248 GLU 286 N -0.0066 -0.0027 0.0023 2249 GLU 286 CA -0.0068 -0.0032 0.0031 2250 GLU 286 C -0.0067 -0.0030 0.0029 2251 GLU 286 O -0.0063 -0.0026 0.0022 2252 GLU 286 CB -0.0061 -0.0034 0.0041 2253 GLU 286 CG -0.0062 -0.0036 0.0044 2254 GLU 286 CD -0.0055 -0.0039 0.0053 2255 GLU 286 OE1 -0.0048 -0.0038 0.0056 2256 GLU 286 OE2 -0.0058 -0.0042 0.0058 2257 LYS 287 N -0.0070 -0.0034 0.0036 2258 LYS 287 CA -0.0070 -0.0033 0.0035 2259 LYS 287 C -0.0059 -0.0033 0.0039 2260 LYS 287 O -0.0054 -0.0035 0.0046 2261 LYS 287 CB -0.0079 -0.0038 0.0039 2262 CYS 288 N -0.0055 -0.0030 0.0035 2263 CYS 288 CA -0.0045 -0.0029 0.0039 2264 CYS 288 C -0.0045 -0.0034 0.0050 2265 CYS 288 O -0.0046 -0.0036 0.0052 2266 CYS 288 CB -0.0044 -0.0025 0.0033 2267 CYS 288 SG -0.0030 -0.0023 0.0035 2268 HIS 426 N 0.0050 -0.0045 0.0101 2269 HIS 426 CA 0.0040 -0.0050 0.0097 2270 HIS 426 C 0.0026 -0.0058 0.0096 2271 HIS 426 O 0.0015 -0.0060 0.0090 2272 HIS 426 CB 0.0043 -0.0056 0.0107 2273 LEU 427 N 0.0027 -0.0062 0.0101 2274 LEU 427 CA 0.0015 -0.0069 0.0100 2275 LEU 427 C 0.0010 -0.0062 0.0089 2276 LEU 427 O 0.0017 -0.0057 0.0088 2277 LEU 427 CB 0.0018 -0.0078 0.0112 2278 LEU 427 CG 0.0005 -0.0088 0.0114 2279 LEU 427 CD1 -0.0002 -0.0095 0.0116 2280 LEU 427 CD2 0.0010 -0.0095 0.0126 2281 PRO 428 N -0.0001 -0.0062 0.0079 2282 PRO 428 CA -0.0005 -0.0055 0.0068 2283 PRO 428 C -0.0010 -0.0059 0.0069 2284 PRO 428 O -0.0015 -0.0069 0.0076 2285 PRO 428 CB -0.0017 -0.0055 0.0059 2286 PRO 428 CG -0.0022 -0.0066 0.0067 2287 PRO 428 CD -0.0011 -0.0068 0.0079 2288 ARG 429 N -0.0016 -0.0064 0.0064 2289 ARG 429 CA -0.0021 -0.0067 0.0064 2290 ARG 429 C -0.0031 -0.0059 0.0048 2291 ARG 429 O -0.0029 -0.0048 0.0038 2292 ARG 429 CB -0.0006 -0.0062 0.0070 2293 ARG 429 CG 0.0003 -0.0071 0.0087 2294 ARG 429 CD 0.0017 -0.0066 0.0092 2295 ARG 429 NE 0.0028 -0.0072 0.0107 2296 ARG 429 CZ 0.0041 -0.0069 0.0114 2297 ARG 429 NH1 0.0045 -0.0059 0.0107 2298 ARG 429 NH2 0.0050 -0.0076 0.0128 2299 ALA 430 N -0.0043 -0.0066 0.0045 2300 ALA 430 CA -0.0054 -0.0059 0.0031 2301 ALA 430 C -0.0045 -0.0049 0.0026 2302 ALA 430 O -0.0034 -0.0049 0.0035 2303 ALA 430 CB -0.0070 -0.0071 0.0030 2304 SER 431 N -0.0051 -0.0039 0.0012 2305 SER 431 CA -0.0043 -0.0027 0.0005 2306 SER 431 C -0.0051 -0.0030 0.0002 2307 SER 431 O -0.0046 -0.0021 -0.0004 2308 SER 431 CB -0.0043 -0.0013 -0.0009 2309 SER 431 OG -0.0036 -0.0010 -0.0007 2310 ALA 432 N -0.0074 -0.0056 0.0003 2311 ALA 432 CA -0.0087 -0.0064 -0.0000 2312 ALA 432 C -0.0081 -0.0074 0.0020 2313 ALA 432 O -0.0073 -0.0082 0.0039 2314 ALA 432 CB -0.0110 -0.0079 -0.0007 2315 VAL 433 N -0.0083 -0.0074 0.0017 2316 VAL 433 CA -0.0077 -0.0083 0.0035 2317 VAL 433 C -0.0090 -0.0105 0.0048 2318 VAL 433 O -0.0083 -0.0114 0.0068 2319 VAL 433 CB -0.0077 -0.0077 0.0027 2320 VAL 433 CG1 -0.0071 -0.0086 0.0047 2321 VAL 433 CG2 -0.0062 -0.0055 0.0016 2322 ALA 434 N -0.0111 -0.0114 0.0037 2323 ALA 434 CA -0.0125 -0.0134 0.0049 2324 ALA 434 C -0.0119 -0.0141 0.0064 2325 ALA 434 O -0.0117 -0.0154 0.0083 2326 ALA 434 CB -0.0147 -0.0141 0.0032 2327 LEU 435 N -0.0115 -0.0138 0.0050 2328 LEU 435 CA -0.0109 -0.0145 0.0063 2329 LEU 435 C -0.0088 -0.0141 0.0079 2330 LEU 435 O -0.0083 -0.0152 0.0096 2331 LEU 435 CB -0.0111 -0.0136 0.0051 2332 LEU 435 CG -0.0133 -0.0139 0.0034 2333 LEU 435 CD1 -0.0134 -0.0129 0.0022 2334 LEU 435 CD2 -0.0149 -0.0159 0.0043 2335 GLU 436 N -0.0074 -0.0127 0.0075 2336 GLU 436 CA -0.0053 -0.0123 0.0089 2337 GLU 436 C -0.0052 -0.0136 0.0106 2338 GLU 436 O -0.0040 -0.0141 0.0123 2339 GLU 436 CB -0.0039 -0.0103 0.0079 2340 GLU 436 CG -0.0017 -0.0097 0.0094 2341 GLU 436 CD -0.0005 -0.0095 0.0102 2342 GLU 436 OE1 -0.0015 -0.0100 0.0099 2343 GLU 436 OE2 0.0014 -0.0089 0.0112 2344 VAL 437 N -0.0065 -0.0141 0.0100 2345 VAL 437 CA -0.0065 -0.0154 0.0115 2346 VAL 437 C -0.0075 -0.0173 0.0128 2347 VAL 437 O -0.0069 -0.0183 0.0146 2348 VAL 437 CB -0.0075 -0.0155 0.0107 2349 VAL 437 CG1 -0.0065 -0.0136 0.0095 2350 VAL 437 CG2 -0.0098 -0.0162 0.0094 2351 GLN 438 N -0.0092 -0.0188 0.0115 2352 GLN 438 CA -0.0101 -0.0206 0.0126 2353 GLN 438 C -0.0084 -0.0206 0.0142 2354 GLN 438 O -0.0083 -0.0221 0.0160 2355 GLN 438 CB -0.0120 -0.0209 0.0110 2356 GLN 438 CG -0.0140 -0.0216 0.0099 2357 GLN 438 CD -0.0157 -0.0214 0.0080 2358 GLN 438 NE2 -0.0162 -0.0201 0.0061 2359 GLN 438 OE1 -0.0165 -0.0223 0.0082 2360 ARG 439 N -0.0072 -0.0190 0.0136 2361 ARG 439 CA -0.0055 -0.0188 0.0150 2362 ARG 439 C -0.0038 -0.0190 0.0168 2363 ARG 439 O -0.0031 -0.0200 0.0187 2364 ARG 439 CB -0.0045 -0.0168 0.0138 2365 ARG 439 CG -0.0025 -0.0163 0.0152 2366 ARG 439 CD -0.0013 -0.0142 0.0140 2367 ARG 439 NE 0.0000 -0.0128 0.0137 2368 ARG 439 CZ 0.0020 -0.0124 0.0152 2369 ARG 439 NH1 0.0028 -0.0133 0.0170 2370 ARG 439 NH2 0.0030 -0.0111 0.0148 2371 LEU 440 N -0.0031 -0.0179 0.0164 2372 LEU 440 CA -0.0015 -0.0179 0.0180 2373 LEU 440 C -0.0022 -0.0200 0.0195 2374 LEU 440 O -0.0010 -0.0206 0.0214 2375 LEU 440 CB -0.0008 -0.0165 0.0170 2376 LEU 440 CG 0.0005 -0.0142 0.0158 2377 LEU 440 CD1 0.0004 -0.0130 0.0144 2378 LEU 440 CD2 0.0028 -0.0136 0.0173 2379 ASN 441 N -0.0043 -0.0216 0.0198 2380 ASN 441 CA -0.0052 -0.0240 0.0214 2381 ASN 441 C -0.0053 -0.0255 0.0228 2382 ASN 441 O -0.0048 -0.0270 0.0249 2383 ASN 441 CB -0.0077 -0.0250 0.0200 2384 ASN 441 CG -0.0076 -0.0239 0.0189 2385 ASN 441 ND2 -0.0096 -0.0237 0.0169 2386 ASN 441 OD1 -0.0058 -0.0232 0.0199 2387 ALA 442 N -0.0061 -0.0250 0.0216 2388 ALA 442 CA -0.0062 -0.0263 0.0228 2389 ALA 442 C -0.0037 -0.0259 0.0248 2390 ALA 442 O -0.0036 -0.0273 0.0264 2391 ALA 442 CB -0.0072 -0.0255 0.0210 2392 LEU 443 N -0.0017 -0.0241 0.0247 2393 LEU 443 CA 0.0007 -0.0238 0.0267 2394 LEU 443 C 0.0008 -0.0258 0.0290 2395 LEU 443 O 0.0019 -0.0267 0.0309 2396 LEU 443 CB 0.0026 -0.0215 0.0262 2397 ASP 444 N -0.0003 -0.0268 0.0296 2398 ASP 444 CA -0.0012 -0.0286 0.0318 2399 ASP 444 C 0.0004 -0.0282 0.0338 2400 ASP 444 O -0.0004 -0.0294 0.0352 2401 LEU 445 N 0.0027 -0.0264 0.0340 2402 LEU 445 CA 0.0044 -0.0258 0.0360 2403 LEU 445 C 0.0045 -0.0252 0.0348 2404 LEU 445 O 0.0061 -0.0235 0.0339 2405 LEU 445 CB 0.0068 -0.0242 0.0367 2406 LEU 445 CG 0.0074 -0.0248 0.0390 2407 LEU 445 CD1 0.0090 -0.0246 0.0416 2408 LEU 445 CD2 0.0052 -0.0269 0.0397 2409 GLU 446 N 0.0027 -0.0268 0.0349 2410 GLU 446 CA 0.0025 -0.0265 0.0339 2411 GLU 446 C 0.0045 -0.0257 0.0357 2412 GLU 446 O 0.0059 -0.0240 0.0347 2413 GLU 446 CB 0.0001 -0.0284 0.0339 2414 LYS 448 N 0.0050 -0.0197 0.0239 2415 LYS 448 CA 0.0070 -0.0186 0.0251 2416 LYS 448 C 0.0076 -0.0164 0.0236 2417 LYS 448 O 0.0064 -0.0159 0.0216 2418 LYS 448 CB 0.0086 -0.0184 0.0267 2419 ILE 449 N 0.0095 -0.0151 0.0245 2420 ILE 449 CA 0.0103 -0.0130 0.0232 2421 ILE 449 C 0.0115 -0.0112 0.0228 2422 ILE 449 O 0.0127 -0.0113 0.0242 2423 ILE 449 CB 0.0116 -0.0127 0.0244 2424 ILE 449 CG1 0.0134 -0.0129 0.0267 2425 ILE 449 CG2 0.0103 -0.0144 0.0246 2426 ILE 449 CD1 0.0151 -0.0118 0.0276 2427 GLY 450 N 0.0113 -0.0096 0.0208 2428 GLY 450 CA 0.0124 -0.0077 0.0201 2429 GLY 450 C 0.0120 -0.0081 0.0201 2430 GLY 450 O 0.0133 -0.0071 0.0207 2431 LYS 451 N 0.0098 -0.0097 0.0188 2432 LYS 451 CA 0.0092 -0.0104 0.0188 2433 LYS 451 C 0.0077 -0.0097 0.0164 2434 LYS 451 O 0.0068 -0.0104 0.0161 2435 LYS 451 CB 0.0081 -0.0129 0.0203 2436 LYS 451 CG 0.0090 -0.0138 0.0225 2437 LYS 451 CD 0.0104 -0.0144 0.0247 2438 LYS 451 CE 0.0128 -0.0124 0.0252 2439 LYS 451 NZ 0.0141 -0.0131 0.0274 2440 SER 452 N 0.0075 -0.0083 0.0146 2441 SER 452 CA 0.0061 -0.0076 0.0122 2442 SER 452 C 0.0073 -0.0051 0.0108 2443 SER 452 O 0.0080 -0.0043 0.0107 2444 SER 452 CB 0.0040 -0.0088 0.0111 2445 SER 452 OG 0.0028 -0.0078 0.0087 2446 ILE 453 N 0.0075 -0.0040 0.0098 2447 ILE 453 CA 0.0085 -0.0016 0.0083 2448 ILE 453 C 0.0070 -0.0011 0.0060 2449 ILE 453 O 0.0078 0.0006 0.0050 2450 ILE 453 CB 0.0091 -0.0006 0.0079 2451 ILE 453 CG1 0.0104 -0.0013 0.0102 2452 ILE 453 CG2 0.0104 0.0019 0.0065 2453 ILE 453 CD1 0.0106 -0.0010 0.0099 2454 LEU 454 N 0.0054 -0.0029 0.0070 2455 LEU 454 CA 0.0039 -0.0023 0.0051 2456 LEU 454 C 0.0042 -0.0018 0.0048 2457 LEU 454 O 0.0040 -0.0005 0.0033 2458 LEU 454 CB 0.0016 -0.0036 0.0051 2459 LEU 454 CG -0.0002 -0.0031 0.0031 2460 LEU 454 CD1 0.0001 -0.0018 0.0018 2461 LEU 454 CD2 -0.0023 -0.0047 0.0034 2462 GLY 455 N 0.0046 -0.0029 0.0064 2463 GLY 455 CA 0.0051 -0.0024 0.0062 2464 GLY 455 C 0.0071 -0.0008 0.0057 2465 GLY 455 O 0.0072 0.0002 0.0046 2466 LYS 456 N 0.0087 -0.0004 0.0065 2467 LYS 456 CA 0.0106 0.0012 0.0061 2468 LYS 456 C 0.0102 0.0027 0.0040 2469 LYS 456 O 0.0111 0.0041 0.0031 2470 LYS 456 CB 0.0123 0.0011 0.0074 2471 LYS 456 CG 0.0127 -0.0005 0.0095 2472 LYS 456 CD 0.0145 -0.0004 0.0108 2473 LYS 456 CE 0.0152 -0.0018 0.0128 2474 LYS 456 NZ 0.0154 -0.0017 0.0130 2475 VAL 457 N 0.0087 0.0020 0.0035 2476 VAL 457 CA 0.0079 0.0036 0.0014 2477 VAL 457 C 0.0069 0.0041 0.0003 2478 VAL 457 O 0.0073 0.0058 -0.0011 2479 VAL 457 CB 0.0062 0.0030 0.0008 2480 VAL 457 CG1 0.0053 0.0045 -0.0013 2481 VAL 457 CG2 0.0073 0.0026 0.0019 2482 HIS 458 N 0.0056 0.0025 0.0008 2483 HIS 458 CA 0.0047 0.0029 -0.0002 2484 HIS 458 C 0.0065 0.0040 0.0000 2485 HIS 458 O 0.0063 0.0053 -0.0013 2486 HIS 458 CB 0.0030 0.0009 0.0004 2487 HIS 458 CG 0.0008 0.0001 -0.0004 2488 HIS 458 CD2 -0.0001 -0.0014 0.0004 2489 HIS 458 ND1 -0.0008 0.0009 -0.0022 2490 HIS 458 CE1 -0.0025 -0.0000 -0.0026 2491 HIS 458 NE2 -0.0022 -0.0015 -0.0010 2492 LEU 459 N 0.0082 0.0035 0.0018 2493 LEU 459 CA 0.0100 0.0045 0.0021 2494 LEU 459 C 0.0113 0.0067 0.0009 2495 LEU 459 O 0.0120 0.0080 0.0002 2496 LEU 459 CB 0.0116 0.0034 0.0042 2497 LEU 459 CG 0.0132 0.0038 0.0050 2498 LEU 459 CD1 0.0120 0.0034 0.0045 2499 LEU 459 CD2 0.0146 0.0025 0.0072 2500 ALA 460 N 0.0118 0.0061 0.0000 2501 ALA 460 CA 0.0129 0.0079 -0.0012 2502 ALA 460 C 0.0114 0.0091 -0.0033 2503 ALA 460 O 0.0123 0.0108 -0.0044 2504 ALA 460 CB 0.0132 0.0078 -0.0009 2505 MET 461 N 0.0091 0.0083 -0.0037 2506 MET 461 CA 0.0076 0.0094 -0.0056 2507 MET 461 C 0.0079 0.0100 -0.0060 2508 MET 461 O 0.0079 0.0116 -0.0076 2509 MET 461 CB 0.0050 0.0082 -0.0058 2510 MET 461 CG 0.0045 0.0076 -0.0056 2511 MET 461 SD 0.0016 0.0077 -0.0071 2512 MET 461 CE 0.0017 0.0099 -0.0093 2513 VAL 462 N 0.0081 0.0088 -0.0047 2514 VAL 462 CA 0.0085 0.0093 -0.0050 2515 VAL 462 C 0.0107 0.0110 -0.0054 2516 VAL 462 O 0.0107 0.0123 -0.0068 2517 VAL 462 CB 0.0087 0.0076 -0.0032 2518 VAL 462 CG1 0.0093 0.0082 -0.0035 2519 VAL 462 CG2 0.0065 0.0060 -0.0028 2520 ARG 463 N 0.0127 0.0108 -0.0043 2521 ARG 463 CA 0.0151 0.0124 -0.0047 2522 ARG 463 C 0.0151 0.0143 -0.0067 2523 ARG 463 O 0.0162 0.0159 -0.0077 2524 ARG 463 CB 0.0172 0.0118 -0.0029 2525 ARG 463 CG 0.0177 0.0103 -0.0010 2526 ARG 463 CD 0.0202 0.0101 0.0005 2527 ARG 463 NE 0.0204 0.0083 0.0025 2528 ARG 463 CZ 0.0199 0.0067 0.0040 2529 ARG 463 NH1 0.0191 0.0065 0.0037 2530 ARG 463 NH2 0.0202 0.0051 0.0058 2531 TYR 464 N 0.0138 0.0141 -0.0072 2532 TYR 464 CA 0.0135 0.0158 -0.0092 2533 TYR 464 C 0.0121 0.0168 -0.0109 2534 TYR 464 O 0.0128 0.0186 -0.0125 2535 TYR 464 CB 0.0123 0.0153 -0.0093 2536 TYR 464 CG 0.0141 0.0155 -0.0085 2537 TYR 464 CD1 0.0164 0.0169 -0.0087 2538 TYR 464 CD2 0.0134 0.0143 -0.0076 2539 TYR 464 CE1 0.0181 0.0171 -0.0080 2540 TYR 464 CE2 0.0151 0.0145 -0.0069 2541 TYR 464 CZ 0.0174 0.0159 -0.0071 2542 TYR 464 OH 0.0191 0.0160 -0.0064 2543 HIS 465 N 0.0100 0.0156 -0.0108 2544 HIS 465 CA 0.0086 0.0163 -0.0123 2545 HIS 465 C 0.0103 0.0174 -0.0125 2546 HIS 465 O 0.0103 0.0190 -0.0142 2547 HIS 465 CB 0.0064 0.0147 -0.0118 2548 HIS 465 CG 0.0041 0.0143 -0.0127 2549 HIS 465 CD2 0.0026 0.0127 -0.0118 2550 HIS 465 ND1 0.0030 0.0157 -0.0148 2551 HIS 465 CE1 0.0010 0.0150 -0.0151 2552 HIS 465 NE2 0.0007 0.0132 -0.0133 2553 GLU 466 N 0.0127 0.0175 -0.0109 2554 GLU 466 CA 0.0145 0.0185 -0.0111 2555 GLU 466 C 0.0168 0.0205 -0.0122 2556 GLU 466 O 0.0176 0.0220 -0.0134 2557 GLU 466 CB 0.0157 0.0169 -0.0088 2558 GLU 466 CG 0.0169 0.0176 -0.0090 2559 GLU 466 CD 0.0184 0.0161 -0.0067 2560 GLU 466 OE1 0.0183 0.0145 -0.0049 2561 GLU 466 OE2 0.0197 0.0167 -0.0066 2562 GLY 467 N 0.0179 0.0205 -0.0117 2563 GLY 467 CA 0.0202 0.0223 -0.0126 2564 GLY 467 C 0.0193 0.0242 -0.0150 2565 GLY 467 O 0.0212 0.0258 -0.0159 2566 GLY 468 N 0.0166 0.0239 -0.0161 2567 GLY 468 CA 0.0156 0.0256 -0.0184 2568 GLY 468 C 0.0154 0.0257 -0.0186 2569 GLY 468 O 0.0157 0.0274 -0.0203 2570 ARG 469 N 0.0145 0.0224 -0.0170 2571 ARG 469 CA 0.0141 0.0221 -0.0169 2572 ARG 469 C 0.0111 0.0222 -0.0179 2573 ARG 469 O 0.0107 0.0227 -0.0185 2574 ARG 469 CB 0.0149 0.0200 -0.0146 2575 ARG 469 CG 0.0147 0.0195 -0.0141 2576 ARG 469 CD 0.0168 0.0211 -0.0150 2577 ARG 469 NE 0.0171 0.0204 -0.0143 2578 ARG 469 CZ 0.0152 0.0205 -0.0150 2579 ARG 469 NH1 0.0129 0.0213 -0.0164 2580 ARG 469 NH2 0.0157 0.0198 -0.0141 2581 PHE 470 N 0.0090 0.0218 -0.0181 2582 PHE 470 CA 0.0060 0.0217 -0.0189 2583 PHE 470 C 0.0048 0.0235 -0.0211 2584 PHE 470 O 0.0022 0.0235 -0.0218 2585 PHE 470 CB 0.0042 0.0195 -0.0174 2586 PHE 470 CG 0.0051 0.0176 -0.0153 2587 PHE 470 CD1 0.0061 0.0177 -0.0150 2588 PHE 470 CD2 0.0049 0.0157 -0.0135 2589 PHE 470 CE1 0.0069 0.0159 -0.0131 2590 PHE 470 CE2 0.0057 0.0140 -0.0115 2591 PHE 470 CZ 0.0067 0.0141 -0.0113 2592 CYS 471 N 0.0066 0.0251 -0.0221 2593 CYS 471 CA 0.0057 0.0270 -0.0241 2594 CYS 471 C 0.0075 0.0290 -0.0256 2595 CYS 471 O 0.0099 0.0290 -0.0249 2596 CYS 471 CB 0.0059 0.0271 -0.0242 2597 CYS 471 SG 0.0095 0.0277 -0.0237 2598 GLU 472 N 0.0054 0.0328 -0.0304 2599 GLU 472 CA 0.0072 0.0370 -0.0327 2600 GLU 472 C 0.0097 0.0396 -0.0334 2601 GLU 472 O 0.0101 0.0381 -0.0319 2602 GLU 472 CB 0.0035 0.0386 -0.0361 2603 LYS 473 N 0.0113 0.0436 -0.0357 2604 LYS 473 CA 0.0138 0.0464 -0.0366 2605 LYS 473 C 0.0106 0.0468 -0.0387 2606 LYS 473 O 0.0066 0.0465 -0.0407 2607 LYS 473 CB 0.0161 0.0506 -0.0386 2608 GLU 475 N 0.0064 0.0364 -0.0338 2609 GLU 475 CA 0.0040 0.0342 -0.0330 2610 GLU 475 C 0.0051 0.0323 -0.0305 2611 GLU 475 O 0.0073 0.0320 -0.0290 2612 GLU 475 CB 0.0026 0.0332 -0.0328 2613 GLU 475 CG 0.0002 0.0308 -0.0318 2614 GLU 475 CD -0.0023 0.0309 -0.0332 2615 GLU 475 OE1 -0.0034 0.0325 -0.0354 2616 GLU 475 OE2 -0.0031 0.0293 -0.0321 2617 GLU 476 N 0.0035 0.0311 -0.0302 2618 GLU 476 CA 0.0042 0.0292 -0.0280 2619 GLU 476 C 0.0034 0.0270 -0.0263 2620 GLU 476 O 0.0010 0.0263 -0.0269 2621 GLU 476 CB 0.0026 0.0285 -0.0282 2622 GLU 476 CG 0.0026 0.0307 -0.0303 2623 TRP 477 N 0.0054 0.0259 -0.0242 2624 TRP 477 CA 0.0048 0.0239 -0.0225 2625 TRP 477 C 0.0024 0.0218 -0.0217 2626 TRP 477 O 0.0020 0.0214 -0.0216 2627 TRP 477 CB 0.0077 0.0234 -0.0204 2628 TRP 477 CG 0.0090 0.0228 -0.0191 2629 TRP 477 CD1 0.0108 0.0244 -0.0197 2630 TRP 477 CD2 0.0089 0.0205 -0.0169 2631 TRP 477 CE2 0.0105 0.0208 -0.0163 2632 TRP 477 CE3 0.0074 0.0182 -0.0154 2633 TRP 477 NE1 0.0117 0.0232 -0.0180 2634 TRP 477 CZ2 0.0108 0.0189 -0.0143 2635 TRP 477 CZ3 0.0077 0.0163 -0.0134 2636 TRP 477 CH2 0.0094 0.0167 -0.0128 2637 ASP 478 N 0.0014 0.0191 -0.0210 2638 ASP 478 CA -0.0010 0.0174 -0.0205 2639 ASP 478 C -0.0003 0.0158 -0.0182 2640 ASP 478 O 0.0005 0.0147 -0.0165 2641 ASP 478 CB -0.0025 0.0167 -0.0205 2642 ASP 478 CG -0.0053 0.0154 -0.0205 2643 ASP 478 OD1 -0.0061 0.0148 -0.0203 2644 ASP 478 OD2 -0.0068 0.0149 -0.0208 2645 GLN 479 N -0.0008 0.0156 -0.0182 2646 GLN 479 CA -0.0002 0.0140 -0.0162 2647 GLN 479 C -0.0024 0.0119 -0.0151 2648 GLN 479 O -0.0018 0.0104 -0.0130 2649 GLN 479 CB 0.0002 0.0146 -0.0166 2650 GLN 479 CG 0.0023 0.0166 -0.0177 2651 GLN 479 CD 0.0029 0.0171 -0.0179 2652 GLN 479 NE2 0.0053 0.0183 -0.0180 2653 GLN 479 OE1 0.0012 0.0163 -0.0179 2654 GLU 480 N -0.0049 0.0119 -0.0164 2655 GLU 480 CA -0.0070 0.0100 -0.0154 2656 GLU 480 C -0.0068 0.0089 -0.0141 2657 GLU 480 O -0.0071 0.0071 -0.0122 2658 GLU 480 CB -0.0097 0.0103 -0.0172 2659 GLU 480 CG -0.0102 0.0111 -0.0185 2660 GLU 480 CD -0.0092 0.0134 -0.0205 2661 GLU 480 OE1 -0.0101 0.0143 -0.0220 2662 GLU 480 OE2 -0.0074 0.0143 -0.0205 2663 SER 481 N -0.0057 0.0094 -0.0150 2664 SER 481 CA -0.0054 0.0086 -0.0138 2665 SER 481 C -0.0029 0.0081 -0.0117 2666 SER 481 O -0.0029 0.0066 -0.0100 2667 SER 481 CB -0.0052 0.0101 -0.0154 2668 SER 481 OG -0.0074 0.0106 -0.0174 2669 ALA 482 N -0.0009 0.0093 -0.0118 2670 ALA 482 CA 0.0014 0.0088 -0.0098 2671 ALA 482 C 0.0007 0.0068 -0.0079 2672 ALA 482 O 0.0015 0.0055 -0.0060 2673 ALA 482 CB 0.0035 0.0105 -0.0104 2674 VAL 483 N -0.0009 0.0064 -0.0085 2675 VAL 483 CA -0.0018 0.0044 -0.0068 2676 VAL 483 C -0.0036 0.0027 -0.0060 2677 VAL 483 O -0.0036 0.0010 -0.0040 2678 VAL 483 CB -0.0032 0.0045 -0.0078 2679 VAL 483 CG1 -0.0043 0.0024 -0.0061 2680 VAL 483 CG2 -0.0012 0.0061 -0.0083 2681 PHE 484 N -0.0046 0.0033 -0.0070 2682 PHE 484 CA -0.0061 0.0019 -0.0064 2683 PHE 484 C -0.0045 0.0013 -0.0047 2684 PHE 484 O -0.0050 -0.0004 -0.0029 2685 PHE 484 CB -0.0076 0.0028 -0.0085 2686 PHE 484 CG -0.0090 0.0016 -0.0081 2687 PHE 484 CD1 -0.0113 0.0001 -0.0080 2688 PHE 484 CD2 -0.0080 0.0021 -0.0079 2689 PHE 484 CE1 -0.0126 -0.0009 -0.0077 2690 PHE 484 CE2 -0.0092 0.0010 -0.0076 2691 PHE 484 CZ -0.0116 -0.0005 -0.0075 2692 HIS 485 N -0.0026 0.0028 -0.0050 2693 HIS 485 CA -0.0010 0.0024 -0.0035 2694 HIS 485 C 0.0005 0.0015 -0.0014 2695 HIS 485 O 0.0012 0.0004 0.0004 2696 HIS 485 CB 0.0006 0.0042 -0.0045 2697 HIS 485 CG -0.0008 0.0048 -0.0062 2698 HIS 485 CD2 -0.0011 0.0065 -0.0084 2699 HIS 485 ND1 -0.0022 0.0037 -0.0058 2700 HIS 485 CE1 -0.0033 0.0046 -0.0076 2701 HIS 485 NE2 -0.0026 0.0063 -0.0092 2702 LEU 486 N 0.0011 0.0020 -0.0015 2703 LEU 486 CA 0.0024 0.0011 0.0004 2704 LEU 486 C 0.0007 -0.0011 0.0018 2705 LEU 486 O 0.0016 -0.0023 0.0038 2706 LEU 486 CB 0.0032 0.0021 -0.0002 2707 LEU 486 CG 0.0051 0.0017 0.0017 2708 LEU 486 CD1 0.0075 0.0023 0.0026 2709 LEU 486 CD2 0.0057 0.0026 0.0009 2710 GLU 487 N -0.0018 -0.0030 0.0006 2711 GLU 487 CA -0.0035 -0.0050 0.0017 2712 GLU 487 C -0.0035 -0.0057 0.0027 2713 GLU 487 O -0.0035 -0.0072 0.0047 2714 GLU 487 CB -0.0059 -0.0055 -0.0000 2715 GLU 487 CG -0.0061 -0.0050 -0.0009 2716 GLU 487 CD -0.0072 -0.0067 0.0004 2717 GLU 487 OE1 -0.0090 -0.0083 0.0008 2718 GLU 487 OE2 -0.0062 -0.0066 0.0012 2719 HIS 488 N -0.0034 -0.0047 0.0013 2720 HIS 488 CA -0.0034 -0.0053 0.0022 2721 HIS 488 C -0.0013 -0.0052 0.0042 2722 HIS 488 O -0.0014 -0.0065 0.0059 2723 HIS 488 CB -0.0037 -0.0041 0.0003 2724 HIS 488 CG -0.0061 -0.0048 -0.0012 2725 HIS 488 CD2 -0.0071 -0.0039 -0.0034 2726 HIS 488 ND1 -0.0079 -0.0067 -0.0004 2727 HIS 488 CE1 -0.0098 -0.0069 -0.0020 2728 HIS 488 NE2 -0.0094 -0.0053 -0.0038 2729 ALA 489 N 0.0007 -0.0037 0.0041 2730 ALA 489 CA 0.0029 -0.0036 0.0061 2731 ALA 489 C 0.0028 -0.0052 0.0082 2732 ALA 489 O 0.0036 -0.0059 0.0101 2733 ALA 489 CB 0.0049 -0.0016 0.0054 2734 ALA 490 N 0.0020 -0.0061 0.0082 2735 ALA 490 CA 0.0020 -0.0078 0.0102 2736 ALA 490 C 0.0005 -0.0098 0.0109 2737 ALA 490 O 0.0011 -0.0110 0.0130 2738 ALA 490 CB 0.0014 -0.0080 0.0097 2739 ASN 491 N -0.0014 -0.0103 0.0093 2740 ASN 491 CA -0.0028 -0.0122 0.0100 2741 ASN 491 C -0.0019 -0.0122 0.0109 2742 ASN 491 O -0.0027 -0.0138 0.0120 2743 ASN 491 CB -0.0050 -0.0125 0.0079 2744 ASN 491 CG -0.0060 -0.0126 0.0069 2745 ASN 491 ND2 -0.0074 -0.0121 0.0047 2746 ASN 491 OD1 -0.0055 -0.0132 0.0081 2747 LEU 492 N -0.0004 -0.0104 0.0105 2748 LEU 492 CA 0.0006 -0.0102 0.0114 2749 LEU 492 C 0.0027 -0.0100 0.0135 2750 LEU 492 O 0.0038 -0.0095 0.0143 2751 LEU 492 CB 0.0010 -0.0083 0.0096 2752 LEU 492 CG -0.0011 -0.0085 0.0075 2753 LEU 492 CD1 -0.0006 -0.0065 0.0057 2754 LEU 492 CD2 -0.0024 -0.0104 0.0082 2755 GLY 493 N 0.0037 -0.0118 0.0141 2756 GLY 493 CA 0.0056 -0.0119 0.0167 2757 GLY 493 C 0.0078 -0.0096 0.0169 2758 GLY 493 O 0.0095 -0.0093 0.0188 2759 GLU 494 N 0.0078 -0.0079 0.0151 2760 GLU 494 CA 0.0099 -0.0056 0.0153 2761 GLU 494 C 0.0106 -0.0061 0.0167 2762 GLU 494 O 0.0095 -0.0064 0.0157 2763 GLU 494 CB 0.0096 -0.0035 0.0128 2764 GLU 494 CG 0.0095 -0.0026 0.0116 2765 GLU 494 CD 0.0114 -0.0019 0.0133 2766 GLU 494 OE1 0.0133 -0.0002 0.0139 2767 GLU 494 OE2 0.0110 -0.0031 0.0141 2768 LEU 495 N 0.0124 -0.0061 0.0190 2769 LEU 495 CA 0.0130 -0.0067 0.0206 2770 LEU 495 C 0.0135 -0.0050 0.0194 2771 LEU 495 O 0.0130 -0.0058 0.0196 2772 LEU 495 CB 0.0151 -0.0067 0.0232 2773 LEU 495 CG 0.0157 -0.0079 0.0252 2774 LEU 495 CD1 0.0136 -0.0103 0.0252 2775 LEU 495 CD2 0.0175 -0.0081 0.0277 2776 GLU 496 N 0.0155 -0.0027 0.0188 2777 GLU 496 CA 0.0160 -0.0010 0.0170 2778 GLU 496 C 0.0135 -0.0016 0.0149 2779 GLU 496 O 0.0132 -0.0014 0.0142 2780 GLU 496 CB 0.0177 0.0013 0.0157 2781 GLU 496 CG 0.0179 0.0031 0.0135 2782 GLU 496 CD 0.0205 0.0054 0.0133 2783 GLU 496 OE1 0.0219 0.0057 0.0145 2784 GLU 496 OE2 0.0211 0.0069 0.0119 2785 ALA 497 N 0.0117 -0.0022 0.0138 2786 ALA 497 CA 0.0093 -0.0028 0.0118 2787 ALA 497 C 0.0078 -0.0049 0.0130 2788 ALA 497 O 0.0066 -0.0050 0.0117 2789 ALA 497 CB 0.0078 -0.0032 0.0106 2790 ILE 498 N 0.0080 -0.0065 0.0154 2791 ILE 498 CA 0.0066 -0.0086 0.0167 2792 ILE 498 C 0.0077 -0.0081 0.0171 2793 ILE 498 O 0.0062 -0.0089 0.0166 2794 ILE 498 CB 0.0067 -0.0104 0.0192 2795 ILE 498 CG1 0.0055 -0.0110 0.0187 2796 ILE 498 CG2 0.0054 -0.0125 0.0206 2797 ILE 498 CD1 0.0059 -0.0124 0.0211 2798 VAL 499 N 0.0107 -0.0073 0.0208 2799 VAL 499 CA 0.0120 -0.0066 0.0214 2800 VAL 499 C 0.0113 -0.0051 0.0185 2801 VAL 499 O 0.0106 -0.0055 0.0183 2802 VAL 499 CB 0.0151 -0.0050 0.0231 2803 VAL 499 CG1 0.0165 -0.0040 0.0234 2804 VAL 499 CG2 0.0158 -0.0066 0.0260 2805 GLY 500 N 0.0114 -0.0032 0.0162 2806 GLY 500 CA 0.0107 -0.0017 0.0134 2807 GLY 500 C 0.0078 -0.0034 0.0121 2808 GLY 500 O 0.0073 -0.0030 0.0111 2809 LEU 501 N 0.0058 -0.0052 0.0122 2810 LEU 501 CA 0.0030 -0.0069 0.0109 2811 LEU 501 C 0.0025 -0.0088 0.0129 2812 LEU 501 O 0.0008 -0.0095 0.0118 2813 LEU 501 CB 0.0010 -0.0083 0.0105 2814 LEU 501 CG 0.0006 -0.0067 0.0078 2815 LEU 501 CD1 -0.0015 -0.0083 0.0074 2816 LEU 501 CD2 -0.0003 -0.0054 0.0050 2817 GLY 502 N 0.0031 -0.0115 0.0177 2818 GLY 502 CA 0.0027 -0.0135 0.0201 2819 GLY 502 C 0.0039 -0.0118 0.0192 2820 GLY 502 O 0.0023 -0.0131 0.0192 2821 LEU 503 N 0.0069 -0.0087 0.0184 2822 LEU 503 CA 0.0082 -0.0068 0.0173 2823 LEU 503 C 0.0058 -0.0060 0.0133 2824 LEU 503 O 0.0052 -0.0060 0.0126 2825 LEU 503 CB 0.0120 -0.0038 0.0176 2826 LEU 503 CG 0.0146 -0.0043 0.0215 2827 LEU 503 CD1 0.0183 -0.0011 0.0215 2828 LEU 503 CD2 0.0147 -0.0062 0.0244 2829 MET 504 N 0.0044 -0.0053 0.0107 2830 MET 504 CA 0.0023 -0.0044 0.0068 2831 MET 504 C -0.0013 -0.0072 0.0064 2832 MET 504 O -0.0025 -0.0069 0.0045 2833 MET 504 CB 0.0018 -0.0030 0.0042 2834 MET 504 CG 0.0050 0.0005 0.0030 2835 MET 504 SD 0.0050 0.0018 0.0012 2836 MET 504 CE 0.0026 0.0033 -0.0038 2837 TYR 505 N -0.0038 -0.0099 0.0085 2838 TYR 505 CA -0.0077 -0.0129 0.0084 2839 TYR 505 C -0.0075 -0.0143 0.0108 2840 TYR 505 O -0.0105 -0.0162 0.0100 2841 TYR 505 CB -0.0097 -0.0157 0.0101 2842 TYR 505 CG -0.0113 -0.0150 0.0072 2843 TYR 505 CD1 -0.0139 -0.0144 0.0031 2844 TYR 505 CD2 -0.0101 -0.0148 0.0084 2845 TYR 505 CE1 -0.0153 -0.0138 0.0004 2846 TYR 505 CE2 -0.0115 -0.0142 0.0057 2847 TYR 505 CZ -0.0141 -0.0137 0.0017 2848 TYR 505 OH -0.0155 -0.0130 -0.0011 2849 SER 506 N -0.0041 -0.0135 0.0137 2850 SER 506 CA -0.0034 -0.0145 0.0159 2851 SER 506 C -0.0021 -0.0119 0.0135 2852 SER 506 O -0.0010 -0.0121 0.0153 2853 SER 506 CB -0.0005 -0.0150 0.0203 2854 SER 506 OG -0.0018 -0.0176 0.0227 2855 GLN 507 N -0.0021 -0.0093 0.0096 2856 GLN 507 CA -0.0008 -0.0066 0.0071 2857 GLN 507 C 0.0034 -0.0048 0.0094 2858 GLN 507 O 0.0045 -0.0037 0.0090 2859 GLN 507 CB -0.0036 -0.0080 0.0058 2860 GLN 507 CG -0.0079 -0.0106 0.0045 2861 GLN 507 CD -0.0093 -0.0094 0.0011 2862 GLN 507 NE2 -0.0079 -0.0063 -0.0022 2863 GLN 507 OE1 -0.0114 -0.0113 0.0012 2864 LEU 508 N 0.0058 -0.0051 0.0108 2865 LEU 508 CA 0.0096 -0.0037 0.0131 2866 LEU 508 C 0.0120 -0.0004 0.0112 2867 LEU 508 O 0.0107 0.0004 0.0088 2868 LEU 508 CB 0.0105 -0.0058 0.0170 2869 LEU 508 CG 0.0092 -0.0088 0.0197 2870 LEU 508 CD1 0.0102 -0.0107 0.0234 2871 LEU 508 CD2 0.0107 -0.0080 0.0203 2872 PRO 509 N 0.0154 0.0016 0.0123 2873 PRO 509 CA 0.0178 0.0047 0.0109 2874 PRO 509 C 0.0186 0.0042 0.0125 2875 PRO 509 O 0.0188 0.0020 0.0157 2876 PRO 509 CB 0.0212 0.0065 0.0122 2877 PRO 509 CG 0.0210 0.0039 0.0155 2878 PRO 509 CD 0.0171 0.0014 0.0146 2879 HIS 510 N 0.0191 0.0063 0.0102 2880 HIS 510 CA 0.0196 0.0060 0.0111 2881 HIS 510 C 0.0222 0.0093 0.0095 2882 HIS 510 O 0.0228 0.0116 0.0070 2883 HIS 510 CB 0.0159 0.0041 0.0096 2884 HIS 510 CG 0.0137 0.0051 0.0057 2885 HIS 510 CD2 0.0130 0.0070 0.0023 2886 HIS 510 ND1 0.0117 0.0040 0.0048 2887 HIS 510 CE1 0.0099 0.0053 0.0012 2888 HIS 510 NE2 0.0107 0.0071 -0.0004 2889 HIS 511 N 0.0221 0.0080 0.0094 2890 HIS 511 CA 0.0240 0.0106 0.0085 2891 HIS 511 C 0.0222 0.0114 0.0058 2892 HIS 511 O 0.0222 0.0136 0.0034 2893 HIS 511 CB 0.0262 0.0102 0.0111 2894 HIS 511 CG 0.0283 0.0128 0.0103 2895 HIS 511 CD2 0.0289 0.0131 0.0106 2896 HIS 511 ND1 0.0300 0.0154 0.0091 2897 HIS 511 CE1 0.0316 0.0173 0.0087 2898 HIS 511 NE2 0.0310 0.0159 0.0096 2899 ILE 512 N 0.0205 0.0096 0.0062 2900 ILE 512 CA 0.0187 0.0101 0.0037 2901 ILE 512 C 0.0161 0.0099 0.0014 2902 ILE 512 O 0.0146 0.0079 0.0022 2903 ILE 512 CB 0.0175 0.0081 0.0048 2904 ILE 512 CG1 0.0154 0.0086 0.0022 2905 ILE 512 CG2 0.0160 0.0050 0.0067 2906 ILE 512 CD1 0.0151 0.0075 0.0031 2907 LEU 513 N 0.0155 0.0120 -0.0014 2908 LEU 513 CA 0.0133 0.0123 -0.0038 2909 LEU 513 C 0.0139 0.0123 -0.0033 2910 LEU 513 O 0.0118 0.0107 -0.0036 2911 LEU 513 CB 0.0101 0.0099 -0.0044 2912 LEU 513 CG 0.0091 0.0098 -0.0053 2913 LEU 513 CD1 0.0058 0.0075 -0.0061 2914 LEU 513 CD2 0.0097 0.0127 -0.0078 2915 ALA 514 N 0.0174 0.0144 -0.0036 2916 ALA 514 CA 0.0179 0.0145 -0.0031 2917 ALA 514 C 0.0158 0.0151 -0.0060 2918 ALA 514 O 0.0145 0.0140 -0.0055 2919 ALA 514 CB 0.0217 0.0163 -0.0025 2920 ASP 515 N 0.0155 0.0170 -0.0090 2921 ASP 515 CA 0.0137 0.0179 -0.0119 2922 ASP 515 C 0.0099 0.0161 -0.0128 2923 ASP 515 O 0.0082 0.0168 -0.0153 2924 ASP 515 CB 0.0149 0.0206 -0.0148 2925 ASP 515 CG 0.0186 0.0225 -0.0141 2926 ASP 515 OD1 0.0200 0.0223 -0.0127 2927 ASP 515 OD2 0.0202 0.0241 -0.0151 2928 VAL 516 N 0.0086 0.0140 -0.0108 2929 VAL 516 CA 0.0050 0.0121 -0.0114 2930 VAL 516 C 0.0038 0.0100 -0.0094 2931 VAL 516 O 0.0051 0.0088 -0.0064 2932 VAL 516 CB 0.0041 0.0110 -0.0106 2933 VAL 516 CG1 0.0003 0.0093 -0.0115 2934 VAL 516 CG2 0.0055 0.0132 -0.0125 2935 SER 517 N 0.0015 0.0104 -0.0129 2936 SER 517 CA -0.0006 0.0071 -0.0105 2937 SER 517 C -0.0050 0.0044 -0.0121 2938 SER 517 O -0.0070 0.0050 -0.0162 2939 SER 517 CB -0.0004 0.0079 -0.0114 2940 SER 517 OG 0.0035 0.0100 -0.0094 2941 LEU 518 N -0.0063 0.0013 -0.0089 2942 LEU 518 CA -0.0104 -0.0014 -0.0101 2943 LEU 518 C -0.0134 -0.0038 -0.0103 2944 LEU 518 O -0.0123 -0.0042 -0.0082 2945 LEU 518 CB -0.0106 -0.0037 -0.0066 2946 LEU 518 CG -0.0080 -0.0016 -0.0063 2947 LEU 518 CD1 -0.0084 -0.0040 -0.0029 2948 LEU 518 CD2 -0.0089 0.0003 -0.0110 2949 LYS 519 N -0.0171 -0.0054 -0.0130 2950 LYS 519 CA -0.0202 -0.0079 -0.0134 2951 LYS 519 C -0.0208 -0.0111 -0.0089 2952 LYS 519 O -0.0203 -0.0122 -0.0061 2953 LYS 519 CB -0.0241 -0.0091 -0.0170 2954 LYS 519 CG -0.0237 -0.0060 -0.0217 2955 LYS 519 CD -0.0252 -0.0053 -0.0250 2956 LYS 519 CE -0.0239 -0.0018 -0.0292 2957 LYS 519 NZ -0.0257 -0.0017 -0.0319 2958 GLU 520 N -0.0223 -0.0117 -0.0099 2959 GLU 520 CA -0.0225 -0.0149 -0.0056 2960 GLU 520 C -0.0271 -0.0184 -0.0059 2961 GLU 520 O -0.0298 -0.0186 -0.0087 2962 GLU 520 CB -0.0206 -0.0142 -0.0043 2963 GLU 520 CG -0.0212 -0.0176 -0.0002 2964 GLU 520 CD -0.0199 -0.0171 0.0006 2965 GLU 520 OE1 -0.0175 -0.0139 -0.0012 2966 GLU 520 OE2 -0.0213 -0.0199 0.0031 2967 THR 521 N -0.0279 -0.0211 -0.0029 2968 THR 521 CA -0.0321 -0.0248 -0.0024 2969 THR 521 C -0.0313 -0.0276 0.0026 2970 THR 521 O -0.0278 -0.0267 0.0054 2971 THR 521 CB -0.0348 -0.0253 -0.0048 2972 THR 521 CG2 -0.0357 -0.0226 -0.0098 2973 THR 521 OG1 -0.0326 -0.0247 -0.0031 2974 GLU 522 N -0.0347 -0.0311 0.0037 2975 GLU 522 CA -0.0344 -0.0341 0.0083 2976 GLU 522 C -0.0336 -0.0346 0.0099 2977 GLU 522 O -0.0310 -0.0351 0.0137 2978 GLU 522 CB -0.0385 -0.0377 0.0089 2979 GLU 522 CG -0.0394 -0.0377 0.0077 2980 GLU 522 CD -0.0357 -0.0364 0.0103 2981 GLU 522 OE1 -0.0341 -0.0380 0.0144 2982 GLU 522 OE2 -0.0343 -0.0339 0.0081 2983 GLU 523 N -0.0360 -0.0341 0.0068 2984 GLU 523 CA -0.0349 -0.0340 0.0079 2985 GLU 523 C -0.0302 -0.0309 0.0088 2986 GLU 523 O -0.0282 -0.0313 0.0119 2987 GLU 523 CB -0.0377 -0.0336 0.0041 2988 GLU 523 CG -0.0395 -0.0321 -0.0005 2989 GLU 523 CD -0.0436 -0.0349 -0.0010 2990 GLU 523 OE1 -0.0458 -0.0381 0.0014 2991 GLU 523 OE2 -0.0446 -0.0339 -0.0037 2992 ASN 524 N -0.0284 -0.0278 0.0061 2993 ASN 524 CA -0.0239 -0.0247 0.0068 2994 ASN 524 C -0.0211 -0.0254 0.0112 2995 ASN 524 O -0.0177 -0.0242 0.0133 2996 ASN 524 CB -0.0228 -0.0213 0.0028 2997 ASN 524 CG -0.0243 -0.0198 -0.0013 2998 ASN 524 ND2 -0.0244 -0.0174 -0.0052 2999 ASN 524 OD1 -0.0253 -0.0208 -0.0010 3000 LYS 525 N -0.0225 -0.0274 0.0125 3001 LYS 525 CA -0.0200 -0.0282 0.0168 3002 LYS 525 C -0.0200 -0.0308 0.0208 3003 LYS 525 O -0.0166 -0.0302 0.0239 3004 LYS 525 CB -0.0218 -0.0299 0.0172 3005 LYS 525 CG -0.0185 -0.0293 0.0203 3006 LYS 525 CD -0.0144 -0.0254 0.0191 3007 LYS 525 CE -0.0115 -0.0245 0.0213 3008 LYS 525 NZ -0.0076 -0.0207 0.0200 3009 THR 526 N -0.0239 -0.0333 0.0202 3010 THR 526 CA -0.0241 -0.0357 0.0237 3011 THR 526 C -0.0214 -0.0338 0.0238 3012 THR 526 O -0.0191 -0.0343 0.0274 3013 THR 526 CB -0.0288 -0.0388 0.0229 3014 THR 526 CG2 -0.0290 -0.0411 0.0263 3015 THR 526 OG1 -0.0311 -0.0409 0.0235 3016 LYS 527 N -0.0217 -0.0314 0.0198 3017 LYS 527 CA -0.0192 -0.0294 0.0195 3018 LYS 527 C -0.0144 -0.0269 0.0213 3019 LYS 527 O -0.0120 -0.0265 0.0236 3020 LYS 527 CB -0.0206 -0.0272 0.0147 3021 LYS 527 CG -0.0204 -0.0267 0.0141 3022 LYS 527 CD -0.0219 -0.0246 0.0092 3023 LYS 527 CE -0.0262 -0.0263 0.0067 3024 LYS 527 NZ -0.0275 -0.0240 0.0018 3025 GLY 528 N -0.0131 -0.0252 0.0203 3026 GLY 528 CA -0.0086 -0.0229 0.0220 3027 GLY 528 C -0.0070 -0.0250 0.0270 3028 GLY 528 O -0.0036 -0.0238 0.0292 3029 PHE 529 N -0.0096 -0.0275 0.0288 3030 PHE 529 CA -0.0078 -0.0301 0.0345 3031 PHE 529 C -0.0080 -0.0317 0.0363 3032 PHE 529 O -0.0049 -0.0316 0.0404 3033 PHE 529 CB -0.0104 -0.0342 0.0366 3034 PHE 529 CG -0.0084 -0.0367 0.0424 3035 PHE 529 CD1 -0.0047 -0.0351 0.0453 3036 PHE 529 CD2 -0.0102 -0.0405 0.0451 3037 PHE 529 CE1 -0.0028 -0.0374 0.0507 3038 PHE 529 CE2 -0.0083 -0.0427 0.0506 3039 PHE 529 CZ -0.0046 -0.0412 0.0533 3040 ASP 734 N 0.0003 0.0024 -0.0030 3041 ASP 734 CA 0.0004 0.0035 -0.0040 3042 ASP 734 C -0.0008 0.0031 -0.0044 3043 ASP 734 O -0.0005 0.0036 -0.0047 3044 ASP 734 CB 0.0002 0.0046 -0.0051 3045 THR 735 N -0.0020 0.0021 -0.0044 3046 THR 735 CA -0.0032 0.0016 -0.0048 3047 THR 735 C -0.0029 0.0008 -0.0037 3048 THR 735 O -0.0030 0.0009 -0.0039 3049 THR 735 CB -0.0046 0.0009 -0.0051 3050 THR 735 CG2 -0.0050 0.0018 -0.0062 3051 THR 735 OG1 -0.0046 -0.0002 -0.0041 3052 ASP 736 N -0.0025 -0.0002 -0.0026 3053 ASP 736 CA -0.0022 -0.0010 -0.0015 3054 ASP 736 C -0.0008 -0.0003 -0.0011 3055 ASP 736 O -0.0006 -0.0008 -0.0005 3056 ASP 736 CB -0.0023 -0.0022 -0.0004 3057 ASP 736 CG -0.0037 -0.0030 -0.0007 3058 ASP 736 OD1 -0.0048 -0.0030 -0.0015 3059 ASP 736 OD2 -0.0039 -0.0038 -0.0001 3060 SER 737 N 0.0003 0.0007 -0.0014 3061 SER 737 CA 0.0016 0.0015 -0.0012 3062 SER 737 C 0.0012 0.0020 -0.0020 3063 SER 737 O 0.0017 0.0020 -0.0015 3064 SER 737 CB 0.0026 0.0025 -0.0014 3065 SER 737 OG 0.0035 0.0021 -0.0003 3066 GLU 738 N 0.0002 0.0026 -0.0031 3067 GLU 738 CA -0.0003 0.0031 -0.0039 3068 GLU 738 C -0.0010 0.0020 -0.0035 3069 GLU 738 O -0.0008 0.0022 -0.0034 3070 GLU 738 CB -0.0013 0.0037 -0.0052 3071 GLU 738 CG -0.0007 0.0051 -0.0061 3072 GLU 738 CD -0.0003 0.0058 -0.0063 3073 GLU 738 OE1 0.0009 0.0058 -0.0056 3074 GLU 738 OE2 -0.0011 0.0062 -0.0073 3075 GLU 739 N -0.0019 0.0009 -0.0031 3076 GLU 739 CA -0.0026 -0.0002 -0.0025 3077 GLU 739 C -0.0015 -0.0006 -0.0014 3078 GLU 739 O -0.0016 -0.0010 -0.0012 3079 GLU 739 CB -0.0037 -0.0013 -0.0023 3080 GLU 739 CG -0.0045 -0.0025 -0.0018 3081 GLU 739 CD -0.0058 -0.0024 -0.0028 3082 GLU 739 OE1 -0.0058 -0.0013 -0.0038 3083 GLU 739 OE2 -0.0068 -0.0034 -0.0026 3084 GLU 740 N -0.0003 -0.0004 -0.0007 3085 GLU 740 CA 0.0008 -0.0006 0.0003 3086 GLU 740 C 0.0016 0.0003 0.0000 3087 GLU 740 O 0.0020 -0.0000 0.0006 3088 GLU 740 CB 0.0017 -0.0007 0.0011 3089 GLU 740 CG 0.0012 -0.0018 0.0018 3090 GLU 740 CD 0.0016 -0.0016 0.0020 3091 GLU 740 OE1 0.0026 -0.0007 0.0017 3092 GLU 740 OE2 0.0010 -0.0025 0.0023 3093 ILE 741 N 0.0018 0.0014 -0.0009 3094 ILE 741 CA 0.0026 0.0023 -0.0013 3095 ILE 741 C 0.0018 0.0021 -0.0017 3096 ILE 741 O 0.0024 0.0023 -0.0015 3097 ILE 741 CB 0.0029 0.0035 -0.0023 3098 ILE 741 CG1 0.0040 0.0038 -0.0018 3099 ILE 741 CG2 0.0035 0.0045 -0.0029 3100 ILE 741 CD1 0.0053 0.0037 -0.0008 3101 ARG 742 N 0.0005 0.0018 -0.0024 3102 ARG 742 CA -0.0004 0.0015 -0.0027 3103 ARG 742 C -0.0004 0.0004 -0.0016 3104 ARG 742 O -0.0003 0.0004 -0.0015 3105 ARG 742 CB -0.0018 0.0013 -0.0035 3106 ARG 742 CG -0.0020 0.0024 -0.0048 3107 ARG 742 CD -0.0035 0.0022 -0.0056 3108 ARG 742 NE -0.0041 0.0014 -0.0053 3109 ARG 742 CZ -0.0043 0.0018 -0.0058 3110 ARG 742 NH1 -0.0038 0.0029 -0.0066 3111 ARG 742 NH2 -0.0049 0.0010 -0.0054 3112 GLU 743 N -0.0003 -0.0003 -0.0007 3113 GLU 743 CA -0.0002 -0.0012 0.0003 3114 GLU 743 C 0.0011 -0.0009 0.0008 3115 GLU 743 O 0.0012 -0.0013 0.0013 3116 GLU 743 CB -0.0003 -0.0020 0.0010 3117 GLU 743 CG -0.0017 -0.0026 0.0008 3118 GLU 743 CD -0.0017 -0.0033 0.0014 3119 GLU 743 OE1 -0.0011 -0.0038 0.0024 3120 GLU 743 OE2 -0.0025 -0.0033 0.0010 3121 ALA 744 N 0.0020 -0.0002 0.0007 3122 ALA 744 CA 0.0033 0.0001 0.0012 3123 ALA 744 C 0.0034 0.0007 0.0006 3124 ALA 744 O 0.0040 0.0006 0.0012 3125 ALA 744 CB 0.0042 0.0008 0.0011 3126 PHE 745 N 0.0027 0.0013 -0.0004 3127 PHE 745 CA 0.0027 0.0018 -0.0009 3128 PHE 745 C 0.0021 0.0011 -0.0006 3129 PHE 745 O 0.0025 0.0012 -0.0004 3130 PHE 745 CB 0.0021 0.0026 -0.0021 3131 PHE 745 CG 0.0022 0.0032 -0.0028 3132 PHE 745 CD1 0.0032 0.0041 -0.0029 3133 PHE 745 CD2 0.0011 0.0030 -0.0032 3134 PHE 745 CE1 0.0033 0.0047 -0.0035 3135 PHE 745 CE2 0.0012 0.0037 -0.0038 3136 PHE 745 CZ 0.0023 0.0045 -0.0040 3137 ARG 746 N 0.0010 0.0004 -0.0007 3138 ARG 746 CA 0.0004 -0.0004 -0.0004 3139 ARG 746 C 0.0011 -0.0010 0.0007 3140 ARG 746 O 0.0009 -0.0014 0.0010 3141 ARG 746 CB -0.0008 -0.0011 -0.0004 3142 ARG 746 CG -0.0017 -0.0006 -0.0015 3143 ARG 746 CD -0.0030 -0.0014 -0.0015 3144 ARG 746 NE -0.0036 -0.0018 -0.0015 3145 ARG 746 CZ -0.0040 -0.0028 -0.0008 3146 ARG 746 NH1 -0.0037 -0.0034 0.0000 3147 ARG 746 NH2 -0.0046 -0.0031 -0.0008 3148 VAL 747 N 0.0020 -0.0010 0.0013 3149 VAL 747 CA 0.0028 -0.0015 0.0023 3150 VAL 747 C 0.0035 -0.0010 0.0022 3151 VAL 747 O 0.0036 -0.0015 0.0028 3152 VAL 747 CB 0.0037 -0.0015 0.0029 3153 VAL 747 CG1 0.0046 -0.0019 0.0039 3154 VAL 747 CG2 0.0029 -0.0022 0.0031 3155 PHE 748 N 0.0039 0.0000 0.0015 3156 PHE 748 CA 0.0047 0.0006 0.0014 3157 PHE 748 C 0.0040 0.0009 0.0007 3158 PHE 748 O 0.0044 0.0011 0.0008 3159 PHE 748 CB 0.0057 0.0015 0.0012 3160 PHE 748 CG 0.0064 0.0013 0.0018 3161 PHE 748 CD1 0.0073 0.0009 0.0028 3162 PHE 748 CD2 0.0062 0.0014 0.0015 3163 PHE 748 CE1 0.0079 0.0007 0.0034 3164 PHE 748 CE2 0.0068 0.0012 0.0022 3165 PHE 748 CZ 0.0077 0.0008 0.0031 3166 ASP 749 N 0.0034 0.0007 0.0000 3167 ASP 749 CA 0.0029 0.0009 -0.0005 3168 ASP 749 C 0.0023 0.0002 -0.0001 3169 ASP 749 O 0.0015 -0.0002 -0.0002 3170 ASP 749 CB 0.0022 0.0012 -0.0013 3171 ASP 749 CG 0.0018 0.0014 -0.0019 3172 ASP 749 OD1 0.0020 0.0015 -0.0018 3173 ASP 749 OD2 0.0011 0.0015 -0.0025 3174 LYS 750 N 0.0028 0.0001 0.0005 3175 LYS 750 CA 0.0024 -0.0006 0.0011 3176 LYS 750 C 0.0016 -0.0008 0.0006 3177 LYS 750 O 0.0010 -0.0013 0.0009 3178 LYS 750 CB 0.0032 -0.0007 0.0016 3179 LYS 750 CG 0.0031 -0.0014 0.0025 3180 LYS 750 CD 0.0031 -0.0017 0.0029 3181 LYS 750 CE 0.0022 -0.0023 0.0030 3182 LYS 750 NZ 0.0021 -0.0024 0.0031 3183 ASP 751 N 0.0016 -0.0002 -0.0000 3184 ASP 751 CA 0.0008 -0.0003 -0.0004 3185 ASP 751 C 0.0001 -0.0001 -0.0011 3186 ASP 751 O -0.0006 -0.0002 -0.0015 3187 ASP 751 CB 0.0012 0.0001 -0.0007 3188 ASP 751 CG 0.0014 0.0009 -0.0015 3189 ASP 751 OD1 0.0017 0.0012 -0.0016 3190 ASP 751 OD2 0.0014 0.0012 -0.0020 3191 GLY 752 N 0.0003 -0.0001 -0.0014 3192 GLY 752 CA -0.0004 0.0001 -0.0020 3193 GLY 752 C -0.0007 0.0007 -0.0028 3194 GLY 752 O -0.0014 0.0008 -0.0032 3195 ASN 753 N -0.0001 0.0013 -0.0029 3196 ASN 753 CA -0.0003 0.0019 -0.0037 3197 ASN 753 C 0.0000 0.0026 -0.0042 3198 ASN 753 O -0.0002 0.0032 -0.0048 3199 ASN 753 CB 0.0002 0.0022 -0.0037 3200 ASN 753 CG 0.0012 0.0027 -0.0036 3201 ASN 753 ND2 0.0015 0.0033 -0.0040 3202 ASN 753 OD1 0.0017 0.0025 -0.0031 3203 GLY 754 N 0.0005 0.0025 -0.0038 3204 GLY 754 CA 0.0008 0.0031 -0.0042 3205 GLY 754 C 0.0019 0.0036 -0.0041 3206 GLY 754 O 0.0022 0.0042 -0.0045 3207 TYR 755 N 0.0017 0.0042 -0.0031 3208 TYR 755 CA 0.0027 0.0047 -0.0030 3209 TYR 755 C 0.0033 0.0041 -0.0022 3210 TYR 755 O 0.0029 0.0035 -0.0019 3211 TYR 755 CB 0.0027 0.0053 -0.0034 3212 TYR 755 CG 0.0021 0.0059 -0.0041 3213 TYR 755 CD1 0.0026 0.0067 -0.0045 3214 TYR 755 CD2 0.0012 0.0057 -0.0045 3215 TYR 755 CE1 0.0021 0.0073 -0.0052 3216 TYR 755 CE2 0.0007 0.0063 -0.0052 3217 TYR 755 CZ 0.0011 0.0071 -0.0055 3218 TYR 755 OH 0.0006 0.0077 -0.0062 3219 ILE 756 N 0.0041 0.0043 -0.0019 3220 ILE 756 CA 0.0048 0.0038 -0.0012 3221 ILE 756 C 0.0054 0.0042 -0.0012 3222 ILE 756 O 0.0059 0.0049 -0.0015 3223 ILE 756 CB 0.0054 0.0038 -0.0009 3224 ILE 756 CG1 0.0048 0.0035 -0.0010 3225 ILE 756 CG2 0.0061 0.0032 -0.0002 3226 ILE 756 CD1 0.0054 0.0035 -0.0007 3227 SER 757 N 0.0052 0.0037 -0.0010 3228 SER 757 CA 0.0058 0.0040 -0.0009 3229 SER 757 C 0.0067 0.0037 -0.0002 3230 SER 757 O 0.0068 0.0031 0.0002 3231 SER 757 CB 0.0052 0.0037 -0.0010 3232 SER 757 OG 0.0051 0.0028 -0.0004 3233 ALA 758 N 0.0065 0.0042 0.0001 3234 ALA 758 CA 0.0072 0.0040 0.0006 3235 ALA 758 C 0.0070 0.0032 0.0010 3236 ALA 758 O 0.0074 0.0028 0.0015 3237 ALA 758 CB 0.0077 0.0047 0.0006 3238 ALA 759 N 0.0064 0.0030 0.0008 3239 ALA 759 CA 0.0062 0.0022 0.0011 3240 ALA 759 C 0.0060 0.0016 0.0013 3241 ALA 759 O 0.0062 0.0010 0.0018 3242 ALA 759 CB 0.0056 0.0022 0.0007 3243 GLU 760 N 0.0055 0.0017 0.0009 3244 GLU 760 CA 0.0053 0.0012 0.0011 3245 GLU 760 C 0.0060 0.0011 0.0016 3246 GLU 760 O 0.0060 0.0004 0.0020 3247 GLU 760 CB 0.0047 0.0014 0.0006 3248 GLU 760 CG 0.0039 0.0013 0.0001 3249 GLU 760 CD 0.0034 0.0016 -0.0004 3250 GLU 760 OE1 0.0037 0.0022 -0.0005 3251 GLU 760 OE2 0.0027 0.0013 -0.0006 3252 LEU 761 N 0.0069 0.0020 0.0022 3253 LEU 761 CA 0.0077 0.0020 0.0025 3254 LEU 761 C 0.0084 0.0014 0.0032 3255 LEU 761 O 0.0087 0.0009 0.0037 3256 LEU 761 CB 0.0084 0.0029 0.0019 3257 LEU 761 CG 0.0091 0.0030 0.0021 3258 LEU 761 CD1 0.0085 0.0027 0.0021 3259 LEU 761 CD2 0.0098 0.0039 0.0015 3260 ARG 762 N 0.0087 0.0013 0.0033 3261 ARG 762 CA 0.0093 0.0007 0.0041 3262 ARG 762 C 0.0087 -0.0002 0.0046 3263 ARG 762 O 0.0091 -0.0007 0.0052 3264 ARG 762 CB 0.0096 0.0009 0.0041 3265 ARG 762 CG 0.0100 0.0001 0.0048 3266 ARG 762 CD 0.0112 0.0002 0.0051 3267 ARG 762 NE 0.0114 -0.0002 0.0055 3268 ARG 762 CZ 0.0123 -0.0001 0.0057 3269 ARG 762 NH1 0.0132 0.0005 0.0055 3270 ARG 762 NH2 0.0123 -0.0005 0.0061 3271 HIS 763 N 0.0077 -0.0004 0.0045 3272 HIS 763 CA 0.0070 -0.0012 0.0049 3273 HIS 763 C 0.0069 -0.0015 0.0051 3274 HIS 763 O 0.0070 -0.0022 0.0058 3275 HIS 763 CB 0.0059 -0.0013 0.0046 3276 HIS 763 CG 0.0051 -0.0021 0.0050 3277 HIS 763 CD2 0.0044 -0.0022 0.0049 3278 HIS 763 ND1 0.0049 -0.0028 0.0056 3279 HIS 763 CE1 0.0042 -0.0034 0.0058 3280 HIS 763 NE2 0.0038 -0.0031 0.0054 3281 VAL 764 N 0.0070 -0.0013 0.0047 3282 VAL 764 CA 0.0069 -0.0016 0.0048 3283 VAL 764 C 0.0080 -0.0018 0.0055 3284 VAL 764 O 0.0080 -0.0025 0.0061 3285 VAL 764 CB 0.0064 -0.0009 0.0040 3286 VAL 764 CG1 0.0065 -0.0011 0.0042 3287 VAL 764 CG2 0.0052 -0.0010 0.0035 3288 MET 765 N 0.0089 -0.0011 0.0053 3289 MET 765 CA 0.0101 -0.0012 0.0059 3290 MET 765 C 0.0103 -0.0021 0.0068 3291 MET 765 O 0.0107 -0.0026 0.0074 3292 MET 765 CB 0.0110 -0.0003 0.0056 3293 MET 765 CG 0.0110 0.0006 0.0049 3294 MET 765 SD 0.0107 0.0004 0.0050 3295 MET 765 CE 0.0109 0.0016 0.0040 3296 THR 766 N 0.0101 -0.0023 0.0069 3297 THR 766 CA 0.0104 -0.0031 0.0077 3298 THR 766 C 0.0096 -0.0041 0.0081 3299 THR 766 O 0.0099 -0.0048 0.0089 3300 THR 766 CB 0.0102 -0.0031 0.0076 3301 THR 766 CG2 0.0104 -0.0040 0.0085 3302 THR 766 OG1 0.0111 -0.0023 0.0073 3303 ASN 767 N 0.0085 -0.0038 0.0080 3304 ASN 767 CA 0.0077 -0.0046 0.0084 3305 ASN 767 C 0.0080 -0.0048 0.0086 3306 ASN 767 O 0.0078 -0.0056 0.0092 3307 ASN 767 CB 0.0065 -0.0045 0.0078 3308 ASN 767 CG 0.0056 -0.0054 0.0081 3309 ASN 767 ND2 0.0047 -0.0053 0.0077 3310 ASN 767 OD1 0.0057 -0.0062 0.0089 3311 LEU 768 N 0.0084 -0.0041 0.0082 3312 LEU 768 CA 0.0086 -0.0042 0.0084 3313 LEU 768 C 0.0098 -0.0044 0.0090 3314 LEU 768 O 0.0101 -0.0044 0.0092 3315 LEU 768 CB 0.0086 -0.0033 0.0076 3316 LEU 768 CG 0.0074 -0.0032 0.0070 3317 LEU 768 CD1 0.0074 -0.0022 0.0062 3318 LEU 768 CD2 0.0066 -0.0040 0.0073 3319 GLY 769 N 0.0104 -0.0044 0.0093 3320 GLY 769 CA 0.0115 -0.0046 0.0099 3321 GLY 769 C 0.0124 -0.0038 0.0096 3322 GLY 769 O 0.0134 -0.0039 0.0101 3323 GLU 770 N 0.0125 -0.0033 0.0085 3324 GLU 770 CA 0.0134 -0.0025 0.0081 3325 GLU 770 C 0.0142 -0.0023 0.0083 3326 GLU 770 O 0.0138 -0.0025 0.0083 3327 GLU 770 CB 0.0128 -0.0016 0.0072 3328 GLU 770 CG 0.0119 -0.0017 0.0070 3329 GLU 770 CD 0.0125 -0.0016 0.0071 3330 GLU 770 OE1 0.0127 -0.0007 0.0065 3331 GLU 770 OE2 0.0127 -0.0023 0.0077 3332 LYS 771 N 0.0153 -0.0020 0.0084 3333 LYS 771 CA 0.0162 -0.0018 0.0086 3334 LYS 771 C 0.0166 -0.0008 0.0079 3335 LYS 771 O 0.0174 -0.0003 0.0078 3336 LYS 771 CB 0.0172 -0.0023 0.0093 3337 LYS 771 CG 0.0168 -0.0034 0.0101 3338 LYS 771 CD 0.0168 -0.0038 0.0105 3339 LYS 771 CE 0.0156 -0.0042 0.0103 3340 LYS 771 NZ 0.0155 -0.0045 0.0106 3341 LEU 772 N 0.0160 -0.0004 0.0074 3342 LEU 772 CA 0.0163 0.0005 0.0067 3343 LEU 772 C 0.0163 0.0005 0.0067 3344 LEU 772 O 0.0156 -0.0000 0.0069 3345 LEU 772 CB 0.0154 0.0010 0.0059 3346 LEU 772 CG 0.0150 0.0009 0.0059 3347 LEU 772 CD1 0.0140 0.0013 0.0052 3348 LEU 772 CD2 0.0160 0.0013 0.0059 3349 THR 773 N 0.0174 0.0003 0.0061 3350 THR 773 CA 0.0171 0.0004 0.0059 3351 THR 773 C 0.0158 0.0013 0.0051 3352 THR 773 O 0.0155 0.0020 0.0046 3353 THR 773 CB 0.0183 0.0011 0.0061 3354 THR 773 CG2 0.0188 0.0026 0.0057 3355 THR 773 OG1 0.0180 0.0010 0.0060 3356 ASP 774 N 0.0152 0.0012 0.0049 3357 ASP 774 CA 0.0140 0.0019 0.0041 3358 ASP 774 C 0.0144 0.0035 0.0036 3359 ASP 774 O 0.0135 0.0042 0.0030 3360 ASP 774 CB 0.0134 0.0016 0.0040 3361 ASP 774 CG 0.0128 0.0000 0.0044 3362 ASP 774 OD1 0.0132 -0.0008 0.0049 3363 ASP 774 OD2 0.0119 -0.0003 0.0042 3364 GLU 775 N 0.0157 0.0040 0.0039 3365 GLU 775 CA 0.0162 0.0055 0.0035 3366 GLU 775 C 0.0163 0.0059 0.0033 3367 GLU 775 O 0.0158 0.0070 0.0027 3368 GLU 775 CB 0.0176 0.0059 0.0038 3369 GLU 776 N 0.0165 0.0044 0.0036 3370 GLU 776 CA 0.0166 0.0047 0.0035 3371 GLU 776 C 0.0154 0.0047 0.0031 3372 GLU 776 O 0.0152 0.0054 0.0027 3373 GLU 776 CB 0.0173 0.0037 0.0041 3374 GLU 776 CG 0.0186 0.0039 0.0046 3375 GLU 776 CD 0.0192 0.0029 0.0052 3376 GLU 776 OE1 0.0195 0.0030 0.0052 3377 GLU 776 OE2 0.0194 0.0021 0.0056 3378 VAL 777 N 0.0145 0.0039 0.0031 3379 VAL 777 CA 0.0132 0.0038 0.0027 3380 VAL 777 C 0.0127 0.0050 0.0020 3381 VAL 777 O 0.0122 0.0055 0.0016 3382 VAL 777 CB 0.0124 0.0027 0.0029 3383 VAL 777 CG1 0.0111 0.0028 0.0024 3384 VAL 777 CG2 0.0129 0.0016 0.0035 3385 ASP 778 N 0.0128 0.0053 0.0020 3386 ASP 778 CA 0.0124 0.0064 0.0014 3387 ASP 778 C 0.0130 0.0074 0.0011 3388 ASP 778 O 0.0124 0.0083 0.0006 3389 ASP 778 CB 0.0125 0.0065 0.0014 3390 ASP 778 CG 0.0117 0.0056 0.0014 3391 ASP 778 OD1 0.0114 0.0046 0.0017 3392 ASP 778 OD2 0.0113 0.0059 0.0012 3393 GLU 779 N 0.0147 0.0071 0.0013 3394 GLU 779 CA 0.0152 0.0079 0.0009 3395 GLU 779 C 0.0145 0.0079 0.0007 3396 GLU 779 O 0.0145 0.0087 0.0001 3397 GLU 779 CB 0.0165 0.0079 0.0015 3398 GLU 779 CG 0.0171 0.0088 0.0011 3399 GLU 779 CD 0.0168 0.0099 0.0003 3400 GLU 779 OE1 0.0170 0.0102 0.0002 3401 GLU 779 OE2 0.0164 0.0104 -0.0002 3402 MET 780 N 0.0141 0.0069 0.0011 3403 MET 780 CA 0.0133 0.0068 0.0009 3404 MET 780 C 0.0123 0.0073 0.0001 3405 MET 780 O 0.0120 0.0079 -0.0005 3406 MET 780 CB 0.0129 0.0056 0.0015 3407 MET 780 CG 0.0139 0.0052 0.0022 3408 MET 780 SD 0.0134 0.0038 0.0030 3409 MET 780 CE 0.0125 0.0037 0.0026 3410 ILE 781 N 0.0117 0.0070 0.0000 3411 ILE 781 CA 0.0107 0.0074 -0.0007 3412 ILE 781 C 0.0110 0.0086 -0.0014 3413 ILE 781 O 0.0105 0.0092 -0.0020 3414 ILE 781 CB 0.0101 0.0070 -0.0007 3415 ILE 781 CG1 0.0097 0.0058 -0.0000 3416 ILE 781 CG2 0.0090 0.0075 -0.0014 3417 ILE 781 CD1 0.0086 0.0054 -0.0002 3418 ARG 782 N 0.0122 0.0089 -0.0016 3419 ARG 782 CA 0.0126 0.0100 -0.0022 3420 ARG 782 C 0.0129 0.0106 -0.0024 3421 ARG 782 O 0.0126 0.0114 -0.0031 3422 ARG 782 CB 0.0137 0.0103 -0.0019 3423 ARG 782 CG 0.0139 0.0115 -0.0025 3424 ARG 782 CD 0.0152 0.0118 -0.0022 3425 ARG 782 NE 0.0158 0.0118 -0.0019 3426 ARG 782 CZ 0.0159 0.0125 -0.0023 3427 ARG 782 NH1 0.0154 0.0133 -0.0031 3428 ARG 782 NH2 0.0164 0.0123 -0.0020 3429 GLU 783 N 0.0135 0.0101 -0.0019 3430 GLU 783 CA 0.0139 0.0106 -0.0020 3431 GLU 783 C 0.0128 0.0106 -0.0025 3432 GLU 783 O 0.0128 0.0115 -0.0031 3433 GLU 783 CB 0.0146 0.0099 -0.0012 3434 GLU 783 CG 0.0149 0.0102 -0.0013 3435 GLU 783 CD 0.0158 0.0096 -0.0005 3436 GLU 783 OE1 0.0168 0.0099 -0.0003 3437 GLU 783 OE2 0.0154 0.0088 -0.0002 3438 ALA 784 N 0.0119 0.0098 -0.0023 3439 ALA 784 CA 0.0109 0.0098 -0.0028 3440 ALA 784 C 0.0100 0.0104 -0.0036 3441 ALA 784 O 0.0092 0.0106 -0.0041 3442 ALA 784 CB 0.0102 0.0087 -0.0024 3443 ASP 785 N 0.0107 0.0102 -0.0041 3444 ASP 785 CA 0.0098 0.0107 -0.0046 3445 ASP 785 C 0.0102 0.0118 -0.0054 3446 ASP 785 O 0.0110 0.0122 -0.0055 3447 ASP 785 CB 0.0099 0.0102 -0.0042 3448 ASP 785 CG 0.0088 0.0104 -0.0046 3449 ASP 785 OD1 0.0080 0.0109 -0.0052 3450 ASP 785 OD2 0.0089 0.0101 -0.0044 3451 ILE 786 N 0.0096 0.0124 -0.0059 3452 ILE 786 CA 0.0098 0.0135 -0.0067 3453 ILE 786 C 0.0092 0.0140 -0.0072 3454 ILE 786 O 0.0097 0.0148 -0.0076 3455 ILE 786 CB 0.0093 0.0139 -0.0071 3456 ILE 786 CG1 0.0101 0.0135 -0.0066 3457 ILE 786 CG2 0.0094 0.0151 -0.0079 3458 ILE 786 CD1 0.0095 0.0135 -0.0067 3459 ASP 787 N 0.0080 0.0136 -0.0071 3460 ASP 787 CA 0.0073 0.0140 -0.0076 3461 ASP 787 C 0.0078 0.0138 -0.0073 3462 ASP 787 O 0.0078 0.0145 -0.0078 3463 ASP 787 CB 0.0059 0.0136 -0.0076 3464 ASP 787 CG 0.0057 0.0125 -0.0068 3465 ASP 787 OD1 0.0056 0.0124 -0.0068 3466 ASP 787 OD2 0.0056 0.0118 -0.0063 3467 GLY 788 N 0.0076 0.0118 -0.0061 3468 GLY 788 CA 0.0082 0.0115 -0.0058 3469 GLY 788 C 0.0075 0.0110 -0.0054 3470 GLY 788 O 0.0078 0.0110 -0.0054 3471 ASP 789 N 0.0066 0.0105 -0.0051 3472 ASP 789 CA 0.0059 0.0099 -0.0047 3473 ASP 789 C 0.0062 0.0091 -0.0038 3474 ASP 789 O 0.0057 0.0085 -0.0034 3475 ASP 789 CB 0.0047 0.0099 -0.0048 3476 ASP 789 CG 0.0045 0.0095 -0.0045 3477 ASP 789 OD1 0.0053 0.0095 -0.0044 3478 ASP 789 OD2 0.0035 0.0091 -0.0043 3479 GLY 790 N 0.0072 0.0089 -0.0035 3480 GLY 790 CA 0.0075 0.0081 -0.0027 3481 GLY 790 C 0.0069 0.0075 -0.0023 3482 GLY 790 O 0.0072 0.0068 -0.0016 3483 GLN 791 N 0.0071 0.0074 -0.0036 3484 GLN 791 CA 0.0065 0.0067 -0.0032 3485 GLN 791 C 0.0066 0.0072 -0.0035 3486 GLN 791 O 0.0069 0.0081 -0.0041 3487 GLN 791 CB 0.0052 0.0064 -0.0032 3488 GLN 791 CG 0.0051 0.0056 -0.0026 3489 GLN 791 CD 0.0039 0.0053 -0.0027 3490 GLN 791 NE2 0.0036 0.0044 -0.0021 3491 GLN 791 OE1 0.0031 0.0058 -0.0033 3492 VAL 792 N 0.0062 0.0066 -0.0032 3493 VAL 792 CA 0.0062 0.0070 -0.0034 3494 VAL 792 C 0.0049 0.0068 -0.0036 3495 VAL 792 O 0.0044 0.0060 -0.0031 3496 VAL 792 CB 0.0070 0.0064 -0.0028 3497 VAL 792 CG1 0.0070 0.0068 -0.0031 3498 VAL 792 CG2 0.0083 0.0065 -0.0026 3499 ASN 793 N 0.0045 0.0076 -0.0044 3500 ASN 793 CA 0.0033 0.0075 -0.0046 3501 ASN 793 C 0.0033 0.0074 -0.0045 3502 ASN 793 O 0.0043 0.0074 -0.0042 3503 ASN 793 CB 0.0027 0.0084 -0.0055 3504 ASN 793 CG 0.0035 0.0094 -0.0060 3505 ASN 793 ND2 0.0039 0.0099 -0.0063 3506 ASN 793 OD1 0.0038 0.0096 -0.0061 3507 TYR 794 N 0.0021 0.0072 -0.0056 3508 TYR 794 CA 0.0020 0.0068 -0.0053 3509 TYR 794 C 0.0027 0.0078 -0.0057 3510 TYR 794 O 0.0033 0.0076 -0.0053 3511 TYR 794 CB 0.0007 0.0063 -0.0056 3512 TYR 794 CG 0.0006 0.0061 -0.0054 3513 TYR 794 CD1 0.0010 0.0052 -0.0046 3514 TYR 794 CD2 0.0000 0.0067 -0.0061 3515 TYR 794 CE1 0.0009 0.0050 -0.0044 3516 TYR 794 CE2 -0.0001 0.0064 -0.0060 3517 TYR 794 CZ 0.0004 0.0056 -0.0051 3518 TYR 794 OH 0.0003 0.0053 -0.0050 3519 GLU 795 N 0.0026 0.0088 -0.0065 3520 GLU 795 CA 0.0032 0.0097 -0.0070 3521 GLU 795 C 0.0046 0.0099 -0.0064 3522 GLU 795 O 0.0052 0.0100 -0.0062 3523 GLU 795 CB 0.0028 0.0108 -0.0079 3524 GLU 795 CG 0.0014 0.0107 -0.0086 3525 GLU 795 CD 0.0005 0.0100 -0.0084 3526 GLU 795 OE1 0.0010 0.0096 -0.0080 3527 GLU 795 OE2 -0.0006 0.0098 -0.0088 3528 GLU 796 N 0.0051 0.0099 -0.0062 3529 GLU 796 CA 0.0065 0.0101 -0.0057 3530 GLU 796 C 0.0069 0.0091 -0.0047 3531 GLU 796 O 0.0080 0.0093 -0.0043 3532 GLU 796 CB 0.0069 0.0103 -0.0056 3533 GLU 796 CG 0.0067 0.0113 -0.0065 3534 GLU 796 CD 0.0066 0.0113 -0.0065 3535 GLU 796 OE1 0.0068 0.0104 -0.0058 3536 GLU 796 OE2 0.0065 0.0121 -0.0072 3537 PHE 797 N 0.0061 0.0083 -0.0044 3538 PHE 797 CA 0.0063 0.0074 -0.0035 3539 PHE 797 C 0.0064 0.0075 -0.0036 3540 PHE 797 O 0.0072 0.0072 -0.0029 3541 PHE 797 CB 0.0053 0.0063 -0.0031 3542 PHE 797 CG 0.0056 0.0053 -0.0022 3543 PHE 797 CD1 0.0065 0.0049 -0.0014 3544 PHE 797 CD2 0.0049 0.0047 -0.0020 3545 PHE 797 CE1 0.0068 0.0039 -0.0005 3546 PHE 797 CE2 0.0052 0.0037 -0.0011 3547 PHE 797 CZ 0.0061 0.0033 -0.0003 3548 VAL 798 N 0.0055 0.0079 -0.0043 3549 VAL 798 CA 0.0055 0.0081 -0.0045 3550 VAL 798 C 0.0067 0.0091 -0.0046 3551 VAL 798 O 0.0074 0.0090 -0.0042 3552 VAL 798 CB 0.0043 0.0084 -0.0053 3553 VAL 798 CG1 0.0044 0.0088 -0.0056 3554 VAL 798 CG2 0.0032 0.0074 -0.0051 3555 GLN 799 N 0.0071 0.0100 -0.0052 3556 GLN 799 CA 0.0082 0.0108 -0.0053 3557 GLN 799 C 0.0094 0.0104 -0.0044 3558 GLN 799 O 0.0102 0.0107 -0.0043 3559 GLN 799 CB 0.0084 0.0117 -0.0060 3560 GLN 799 CG 0.0073 0.0122 -0.0069 3561 GLN 799 CD 0.0068 0.0127 -0.0075 3562 GLN 799 NE2 0.0077 0.0134 -0.0077 3563 GLN 799 OE1 0.0057 0.0123 -0.0078 3564 MET 800 N 0.0093 0.0097 -0.0037 3565 MET 800 CA 0.0104 0.0092 -0.0029 3566 MET 800 C 0.0104 0.0085 -0.0023 3567 MET 800 O 0.0114 0.0085 -0.0018 3568 MET 800 CB 0.0104 0.0086 -0.0024 3569 MET 800 CG 0.0115 0.0081 -0.0014 3570 MET 800 SD 0.0111 0.0067 -0.0005 3571 MET 800 CE 0.0097 0.0061 -0.0007 3572 MET 801 N 0.0093 0.0078 -0.0022 3573 MET 801 CA 0.0092 0.0070 -0.0017 3574 MET 801 C 0.0094 0.0076 -0.0020 3575 MET 801 O 0.0101 0.0074 -0.0015 3576 MET 801 CB 0.0080 0.0061 -0.0015 3577 MET 801 CG 0.0078 0.0054 -0.0010 3578 MET 801 SD 0.0089 0.0045 0.0002 3579 MET 801 CE 0.0083 0.0036 0.0006 3580 THR 802 N 0.0088 0.0084 -0.0029 3581 THR 802 CA 0.0089 0.0090 -0.0034 3582 THR 802 C 0.0100 0.0100 -0.0037 3583 THR 802 O 0.0098 0.0110 -0.0045 3584 THR 802 CB 0.0077 0.0093 -0.0041 3585 THR 802 CG2 0.0066 0.0083 -0.0039 3586 THR 802 OG1 0.0074 0.0101 -0.0049 3587 ALA 803 N 0.0114 0.0101 -0.0030 3588 ALA 803 CA 0.0126 0.0111 -0.0032 3589 ALA 803 C 0.0137 0.0112 -0.0028 3590 ALA 803 O 0.0137 0.0104 -0.0022 3591 ALA 803 CB 0.0132 0.0109 -0.0027 3592 LYS 804 N 0.0147 0.0123 -0.0031 3593 LYS 804 CA 0.0158 0.0127 -0.0028 3594 LYS 804 C 0.0168 0.0117 -0.0018 3595 LYS 804 O 0.0172 0.0113 -0.0013 3596 LYS 804 CB 0.0167 0.0140 -0.0034 3597 LYS 804 CG 0.0159 0.0150 -0.0044 3598 LYS 804 CD 0.0146 0.0150 -0.0049 3599 LYS 804 CE 0.0133 0.0149 -0.0055 3600 LYS 804 NZ 0.0122 0.0137 -0.0051 3601 LYS 804 OXT 0.0172 0.0114 -0.0014