1 VAL 1 N 0.1479 0.0526 0.1459 2 VAL 1 CA 0.1467 0.0192 0.0938 3 VAL 1 C 0.1068 0.0022 0.0821 4 VAL 1 CB 0.1299 0.0018 0.0727 5 VAL 1 O 0.0579 0.0029 0.1016 6 VAL 1 CG1 0.1331 -0.0322 0.0180 7 VAL 1 CG2 0.1667 0.0202 0.0878 8 GLU 2 N 0.0704 -0.0027 0.0633 9 GLU 2 CA 0.0447 -0.0154 0.0523 10 GLU 2 C 0.0359 -0.0168 0.0318 11 GLU 2 CB 0.0418 -0.0146 0.0383 12 GLU 2 O 0.0486 -0.0063 0.0126 13 GLU 2 CG 0.0153 -0.0291 0.0351 14 GLU 2 CD 0.0128 -0.0284 0.0229 15 GLU 2 OE1 -0.0083 -0.0393 0.0163 16 GLU 2 OE2 0.0321 -0.0169 0.0196 17 PRO 3 N 0.0370 -0.0186 0.0395 18 PRO 3 CA 0.0319 -0.0144 0.0249 19 PRO 3 C 0.0226 -0.0102 0.0061 20 PRO 3 CB 0.0178 -0.0238 0.0334 21 PRO 3 O 0.0111 -0.0148 0.0058 22 PRO 3 CG 0.0141 -0.0328 0.0509 23 PRO 3 CD 0.0269 -0.0288 0.0537 24 ALA 4 N 0.0185 -0.0033 -0.0119 25 ALA 4 CA 0.0129 0.0018 -0.0177 26 ALA 4 C 0.0083 0.0004 -0.0189 27 ALA 4 CB 0.0176 0.0101 -0.0208 28 ALA 4 O 0.0119 -0.0004 -0.0168 29 ARG 5 N 0.0100 -0.0003 -0.0091 30 ARG 5 CA 0.0009 -0.0013 -0.0113 31 ARG 5 C -0.0058 0.0101 -0.0211 32 ARG 5 CB -0.0104 -0.0126 -0.0073 33 ARG 5 O -0.0165 0.0110 -0.0251 34 ARG 5 CG -0.0047 -0.0246 0.0025 35 ARG 5 CD -0.0165 -0.0355 0.0061 36 ARG 5 NE -0.0111 -0.0470 0.0155 37 ARG 5 NH1 -0.0327 -0.0591 0.0168 38 ARG 5 NH2 -0.0129 -0.0677 0.0289 39 ARG 5 CZ -0.0189 -0.0580 0.0204 40 ILE 6 N -0.0015 0.0118 -0.0190 41 ILE 6 CA -0.0014 0.0114 -0.0193 42 ILE 6 C -0.0007 0.0090 -0.0196 43 ILE 6 CB -0.0017 0.0121 -0.0172 44 ILE 6 O -0.0004 0.0077 -0.0185 45 ILE 6 CG1 -0.0024 0.0145 -0.0169 46 ILE 6 CG2 -0.0015 0.0114 -0.0175 47 ILE 6 CD1 -0.0026 0.0158 -0.0187 48 THR 7 N 0.0004 0.0070 -0.0190 49 THR 7 CA 0.0014 0.0048 -0.0194 50 THR 7 C 0.0014 0.0046 -0.0191 51 THR 7 CB 0.0019 0.0040 -0.0218 52 THR 7 O 0.0009 0.0060 -0.0198 53 THR 7 CG2 0.0019 0.0042 -0.0221 54 THR 7 OG1 0.0015 0.0054 -0.0236 55 LEU 8 N 0.0062 0.0020 -0.0153 56 LEU 8 CA 0.0071 0.0003 -0.0134 57 LEU 8 C 0.0099 -0.0010 -0.0134 58 LEU 8 CB 0.0053 -0.0005 -0.0110 59 LEU 8 O 0.0105 -0.0013 -0.0133 60 LEU 8 CG 0.0058 -0.0023 -0.0088 61 LEU 8 CD1 0.0052 -0.0020 -0.0089 62 LEU 8 CD2 0.0043 -0.0031 -0.0066 63 THR 9 N 0.0106 -0.0025 -0.0129 64 THR 9 CA 0.0137 -0.0032 -0.0124 65 THR 9 C 0.0142 -0.0044 -0.0095 66 THR 9 CB 0.0155 -0.0027 -0.0145 67 THR 9 O 0.0124 -0.0046 -0.0083 68 THR 9 CG2 0.0151 -0.0014 -0.0174 69 THR 9 OG1 0.0145 -0.0026 -0.0143 70 TYR 10 N 0.0150 -0.0072 -0.0082 71 TYR 10 CA 0.0153 -0.0068 -0.0061 72 TYR 10 C 0.0166 -0.0062 -0.0054 73 TYR 10 CB 0.0161 -0.0064 -0.0058 74 TYR 10 O 0.0181 -0.0057 -0.0063 75 TYR 10 CG 0.0166 -0.0059 -0.0037 76 TYR 10 CD1 0.0184 -0.0051 -0.0032 77 TYR 10 CD2 0.0152 -0.0063 -0.0022 78 TYR 10 CE1 0.0189 -0.0047 -0.0013 79 TYR 10 CE2 0.0157 -0.0058 -0.0002 80 TYR 10 OH 0.0180 -0.0045 0.0021 81 TYR 10 CZ 0.0175 -0.0050 0.0002 82 LYS 11 N 0.0151 -0.0068 -0.0049 83 LYS 11 CA 0.0154 -0.0046 -0.0024 84 LYS 11 C 0.0156 -0.0022 0.0002 85 LYS 11 CB 0.0129 -0.0061 -0.0008 86 LYS 11 O 0.0138 -0.0030 0.0019 87 LYS 11 CG 0.0131 -0.0039 0.0016 88 LYS 11 CD 0.0106 -0.0055 0.0031 89 LYS 11 CE 0.0107 -0.0033 0.0056 90 LYS 11 NZ 0.0083 -0.0049 0.0071 91 GLU 12 N 0.0143 -0.0024 0.0017 92 GLU 12 CA 0.0149 -0.0001 0.0049 93 GLU 12 C 0.0127 0.0004 0.0082 94 GLU 12 CB 0.0188 0.0022 0.0047 95 GLU 12 O 0.0121 -0.0001 0.0081 96 GLU 12 CG 0.0211 0.0022 0.0022 97 GLU 12 CD 0.0249 0.0046 0.0022 98 GLU 12 OE1 0.0270 0.0048 0.0001 99 GLU 12 OE2 0.0256 0.0063 0.0043 100 GLY 13 N 0.0102 0.0008 0.0136 101 GLY 13 CA 0.0058 0.0032 0.0192 102 GLY 13 C 0.0023 0.0127 0.0200 103 GLY 13 O 0.0031 0.0173 0.0165 104 ALA 14 N -0.0053 0.0225 0.0320 105 ALA 14 CA -0.0061 0.0316 0.0346 106 ALA 14 C -0.0058 0.0347 0.0267 107 ALA 14 CB -0.0066 0.0306 0.0443 108 ALA 14 O -0.0050 0.0287 0.0214 109 PRO 15 N -0.0125 0.0487 0.0257 110 PRO 15 CA -0.0152 0.0498 0.0154 111 PRO 15 C -0.0139 0.0379 0.0179 112 PRO 15 CB -0.0155 0.0657 0.0183 113 PRO 15 O -0.0104 0.0341 0.0304 114 PRO 15 CG -0.0144 0.0743 0.0244 115 PRO 15 CD -0.0115 0.0639 0.0333 116 ILE 16 N -0.0213 0.0151 0.0166 117 ILE 16 CA -0.0188 0.0136 0.0123 118 ILE 16 C -0.0224 0.0176 0.0079 119 ILE 16 CB -0.0142 0.0103 0.0083 120 ILE 16 O -0.0250 0.0204 0.0051 121 ILE 16 CG1 -0.0104 0.0061 0.0127 122 ILE 16 CG2 -0.0120 0.0093 0.0033 123 ILE 16 CD1 -0.0061 0.0029 0.0092 124 THR 17 N -0.0259 0.0292 0.0157 125 THR 17 CA -0.0285 0.0318 0.0124 126 THR 17 C -0.0275 0.0278 0.0054 127 THR 17 CB -0.0278 0.0326 0.0175 128 THR 17 O -0.0237 0.0223 0.0054 129 THR 17 CG2 -0.0306 0.0355 0.0141 130 THR 17 OG1 -0.0288 0.0363 0.0240 131 ILE 18 N -0.0394 0.0197 0.0005 132 ILE 18 CA -0.0360 0.0216 -0.0055 133 ILE 18 C -0.0392 0.0250 -0.0095 134 ILE 18 CB -0.0356 0.0226 -0.0077 135 ILE 18 O -0.0449 0.0270 -0.0094 136 ILE 18 CG1 -0.0322 0.0192 -0.0037 137 ILE 18 CG2 -0.0323 0.0247 -0.0140 138 ILE 18 CD1 -0.0323 0.0199 -0.0051 139 MET 19 N -0.0362 0.0293 -0.0086 140 MET 19 CA -0.0390 0.0330 -0.0127 141 MET 19 C -0.0413 0.0377 -0.0195 142 MET 19 CB -0.0335 0.0309 -0.0152 143 MET 19 O -0.0391 0.0376 -0.0219 144 MET 19 CG -0.0312 0.0264 -0.0088 145 MET 19 SD -0.0245 0.0241 -0.0120 146 MET 19 CE -0.0163 0.0202 -0.0136 147 ASP 20 N -0.0509 0.0459 -0.0244 148 ASP 20 CA -0.0552 0.0513 -0.0319 149 ASP 20 C -0.0463 0.0531 -0.0391 150 ASP 20 CB -0.0627 0.0561 -0.0370 151 ASP 20 O -0.0476 0.0558 -0.0433 152 ASP 20 CG -0.0733 0.0553 -0.0309 153 ASP 20 OD1 -0.0758 0.0518 -0.0236 154 ASP 20 OD2 -0.0790 0.0582 -0.0335 155 ASN 21 N -0.0408 0.0449 -0.0387 156 ASN 21 CA -0.0338 0.0452 -0.0451 157 ASN 21 C -0.0281 0.0413 -0.0421 158 ASN 21 CB -0.0287 0.0446 -0.0481 159 ASN 21 O -0.0214 0.0406 -0.0463 160 ASN 21 CG -0.0248 0.0397 -0.0417 161 ASN 21 ND2 -0.0210 0.0391 -0.0437 162 ASN 21 OD1 -0.0253 0.0364 -0.0349 163 GLY 22 N -0.0312 0.0374 -0.0327 164 GLY 22 CA -0.0266 0.0340 -0.0296 165 GLY 22 C -0.0197 0.0295 -0.0260 166 GLY 22 O -0.0150 0.0264 -0.0234 167 ASN 23 N -0.0197 0.0268 -0.0246 168 ASN 23 CA -0.0141 0.0230 -0.0216 169 ASN 23 C -0.0166 0.0202 -0.0141 170 ASN 23 CB -0.0115 0.0239 -0.0256 171 ASN 23 O -0.0229 0.0216 -0.0119 172 ASN 23 CG -0.0073 0.0257 -0.0326 173 ASN 23 ND2 -0.0074 0.0282 -0.0374 174 ASN 23 OD1 -0.0041 0.0250 -0.0337 175 ILE 24 N -0.0103 0.0132 -0.0101 176 ILE 24 CA -0.0111 0.0107 -0.0029 177 ILE 24 C -0.0068 0.0064 -0.0013 178 ILE 24 CB -0.0108 0.0090 0.0004 179 ILE 24 O -0.0024 0.0046 -0.0056 180 ILE 24 CG1 -0.0050 0.0053 -0.0023 181 ILE 24 CG2 -0.0154 0.0134 -0.0008 182 ILE 24 CD1 -0.0039 0.0027 0.0016 183 ASP 25 N -0.0043 0.0059 0.0054 184 ASP 25 CA 0.0004 0.0003 0.0083 185 ASP 25 C 0.0038 -0.0037 0.0085 186 ASP 25 CB -0.0002 0.0009 0.0161 187 ASP 25 O 0.0022 -0.0018 0.0085 188 ASP 25 CG -0.0021 0.0033 0.0161 189 ASP 25 OD1 -0.0014 0.0024 0.0106 190 ASP 25 OD2 -0.0044 0.0060 0.0217 191 THR 26 N 0.0069 -0.0076 0.0096 192 THR 26 CA 0.0087 -0.0105 0.0097 193 THR 26 C 0.0088 -0.0110 0.0142 194 THR 26 CB 0.0110 -0.0141 0.0082 195 THR 26 O 0.0080 -0.0100 0.0174 196 THR 26 CG2 0.0110 -0.0137 0.0037 197 THR 26 OG1 0.0115 -0.0152 0.0111 198 GLU 27 N 0.0098 -0.0127 0.0143 199 GLU 27 CA 0.0103 -0.0132 0.0166 200 GLU 27 C 0.0094 -0.0108 0.0183 201 GLU 27 CB 0.0114 -0.0152 0.0184 202 GLU 27 O 0.0097 -0.0109 0.0207 203 GLU 27 CG 0.0124 -0.0177 0.0170 204 GLU 27 CD 0.0129 -0.0190 0.0163 205 GLU 27 OE1 0.0134 -0.0206 0.0143 206 GLU 27 OE2 0.0129 -0.0185 0.0177 207 LEU 28 N 0.0072 -0.0091 0.0166 208 LEU 28 CA 0.0048 -0.0059 0.0193 209 LEU 28 C 0.0054 -0.0072 0.0197 210 LEU 28 CB 0.0027 -0.0012 0.0165 211 LEU 28 O 0.0070 -0.0085 0.0161 212 LEU 28 CG 0.0017 0.0007 0.0161 213 LEU 28 CD1 -0.0000 0.0050 0.0126 214 LEU 28 CD2 0.0002 0.0014 0.0213 215 LEU 29 N 0.0097 -0.0069 0.0177 216 LEU 29 CA 0.0094 -0.0062 0.0165 217 LEU 29 C 0.0092 -0.0043 0.0151 218 LEU 29 CB 0.0101 -0.0055 0.0179 219 LEU 29 O 0.0098 -0.0027 0.0157 220 LEU 29 CG 0.0099 -0.0047 0.0169 221 LEU 29 CD1 0.0091 -0.0065 0.0159 222 LEU 29 CD2 0.0106 -0.0038 0.0184 223 VAL 30 N 0.0094 -0.0068 0.0127 224 VAL 30 CA 0.0101 -0.0051 0.0108 225 VAL 30 C 0.0104 -0.0039 0.0088 226 VAL 30 CB 0.0088 -0.0061 0.0093 227 VAL 30 O 0.0118 -0.0019 0.0082 228 VAL 30 CG1 0.0094 -0.0044 0.0071 229 VAL 30 CG2 0.0086 -0.0071 0.0112 230 GLY 31 N 0.0133 -0.0072 0.0070 231 GLY 31 CA 0.0134 -0.0070 0.0059 232 GLY 31 C 0.0125 -0.0078 0.0056 233 GLY 31 O 0.0117 -0.0086 0.0062 234 THR 32 N 0.0154 -0.0071 0.0019 235 THR 32 CA 0.0139 -0.0071 0.0009 236 THR 32 C 0.0132 -0.0066 -0.0010 237 THR 32 CB 0.0146 -0.0068 0.0004 238 THR 32 O 0.0144 -0.0059 -0.0021 239 THR 32 CG2 0.0130 -0.0068 -0.0006 240 THR 32 OG1 0.0153 -0.0072 0.0022 241 LEU 33 N 0.0131 -0.0067 -0.0030 242 LEU 33 CA 0.0116 -0.0055 -0.0044 243 LEU 33 C 0.0112 -0.0042 -0.0060 244 LEU 33 CB 0.0093 -0.0059 -0.0034 245 LEU 33 O 0.0105 -0.0044 -0.0056 246 LEU 33 CG 0.0094 -0.0071 -0.0017 247 LEU 33 CD1 0.0071 -0.0077 -0.0005 248 LEU 33 CD2 0.0100 -0.0067 -0.0024 249 THR 34 N 0.0125 -0.0025 -0.0094 250 THR 34 CA 0.0114 -0.0008 -0.0122 251 THR 34 C 0.0087 0.0007 -0.0137 252 THR 34 CB 0.0146 -0.0002 -0.0147 253 THR 34 O 0.0096 0.0011 -0.0149 254 THR 34 CG2 0.0135 0.0016 -0.0176 255 THR 34 OG1 0.0171 -0.0016 -0.0132 256 LEU 35 N 0.0078 0.0032 -0.0159 257 LEU 35 CA 0.0050 0.0049 -0.0163 258 LEU 35 C 0.0048 0.0073 -0.0191 259 LEU 35 CB 0.0022 0.0046 -0.0143 260 LEU 35 O 0.0050 0.0078 -0.0198 261 LEU 35 CG -0.0009 0.0063 -0.0145 262 LEU 35 CD1 -0.0012 0.0061 -0.0141 263 LEU 35 CD2 -0.0035 0.0060 -0.0126 264 GLY 36 N 0.0032 0.0085 -0.0214 265 GLY 36 CA 0.0024 0.0114 -0.0254 266 GLY 36 C -0.0010 0.0135 -0.0264 267 GLY 36 O -0.0025 0.0127 -0.0240 268 GLY 37 N -0.0031 0.0146 -0.0294 269 GLY 37 CA -0.0033 0.0149 -0.0291 270 GLY 37 C -0.0052 0.0177 -0.0268 271 GLY 37 O -0.0053 0.0181 -0.0258 272 TYR 38 N -0.0047 0.0203 -0.0271 273 TYR 38 CA -0.0084 0.0216 -0.0252 274 TYR 38 C -0.0102 0.0245 -0.0279 275 TYR 38 CB -0.0085 0.0197 -0.0222 276 TYR 38 O -0.0084 0.0252 -0.0308 277 TYR 38 CG -0.0061 0.0189 -0.0234 278 TYR 38 CD1 -0.0027 0.0163 -0.0230 279 TYR 38 CD2 -0.0073 0.0207 -0.0249 280 TYR 38 CE1 -0.0004 0.0156 -0.0241 281 TYR 38 CE2 -0.0051 0.0199 -0.0260 282 TYR 38 OH 0.0005 0.0166 -0.0267 283 TYR 38 CZ -0.0017 0.0174 -0.0256 284 LYS 39 N -0.0116 0.0270 -0.0278 285 LYS 39 CA -0.0151 0.0310 -0.0310 286 LYS 39 C -0.0157 0.0319 -0.0322 287 LYS 39 CB -0.0194 0.0337 -0.0280 288 LYS 39 O -0.0155 0.0306 -0.0286 289 LYS 39 CG -0.0231 0.0378 -0.0314 290 LYS 39 CD -0.0273 0.0404 -0.0284 291 LYS 39 CE -0.0310 0.0445 -0.0316 292 LYS 39 NZ -0.0351 0.0470 -0.0287 293 THR 40 N -0.0157 0.0355 -0.0366 294 THR 40 CA -0.0154 0.0361 -0.0377 295 THR 40 C -0.0193 0.0368 -0.0343 296 THR 40 CB -0.0151 0.0396 -0.0427 297 THR 40 O -0.0231 0.0390 -0.0331 298 THR 40 CG2 -0.0148 0.0402 -0.0438 299 THR 40 OG1 -0.0112 0.0388 -0.0459 300 GLY 41 N -0.0173 0.0329 -0.0314 301 GLY 41 CA -0.0208 0.0322 -0.0287 302 GLY 41 C -0.0223 0.0288 -0.0247 303 GLY 41 O -0.0252 0.0279 -0.0221 304 THR 42 N -0.0179 0.0258 -0.0242 305 THR 42 CA -0.0183 0.0229 -0.0203 306 THR 42 C -0.0171 0.0201 -0.0176 307 THR 42 CB -0.0153 0.0217 -0.0207 308 THR 42 O -0.0138 0.0194 -0.0188 309 THR 42 CG2 -0.0156 0.0186 -0.0167 310 THR 42 OG1 -0.0167 0.0243 -0.0230 311 THR 43 N -0.0204 0.0156 -0.0166 312 THR 43 CA -0.0196 0.0127 -0.0132 313 THR 43 C -0.0174 0.0099 -0.0103 314 THR 43 CB -0.0244 0.0122 -0.0111 315 THR 43 O -0.0176 0.0101 -0.0105 316 THR 43 CG2 -0.0267 0.0150 -0.0139 317 THR 43 OG1 -0.0277 0.0120 -0.0097 318 SER 44 N -0.0154 0.0049 -0.0079 319 SER 44 CA -0.0130 0.0024 -0.0052 320 SER 44 C -0.0161 0.0012 -0.0029 321 SER 44 CB -0.0109 -0.0000 -0.0025 322 SER 44 O -0.0146 0.0002 -0.0019 323 SER 44 OG -0.0145 -0.0008 -0.0006 324 THR 45 N -0.0189 0.0014 -0.0025 325 THR 45 CA -0.0213 0.0005 -0.0009 326 THR 45 C -0.0223 0.0020 -0.0034 327 THR 45 CB -0.0251 -0.0001 0.0006 328 THR 45 O -0.0239 0.0016 -0.0024 329 THR 45 CG2 -0.0242 -0.0018 0.0034 330 THR 45 OG1 -0.0272 0.0015 -0.0019 331 SER 46 N -0.0194 0.0073 -0.0055 332 SER 46 CA -0.0206 0.0093 -0.0068 333 SER 46 C -0.0176 0.0074 -0.0067 334 SER 46 CB -0.0206 0.0130 -0.0105 335 SER 46 O -0.0185 0.0084 -0.0072 336 SER 46 OG -0.0238 0.0149 -0.0106 337 VAL 47 N -0.0146 0.0041 -0.0056 338 VAL 47 CA -0.0122 0.0028 -0.0054 339 VAL 47 C -0.0128 0.0002 -0.0025 340 VAL 47 CB -0.0085 0.0024 -0.0066 341 VAL 47 O -0.0129 -0.0014 -0.0009 342 VAL 47 CG1 -0.0060 0.0011 -0.0064 343 VAL 47 CG2 -0.0079 0.0050 -0.0095 344 ASN 48 N -0.0109 -0.0017 -0.0020 345 ASN 48 CA -0.0109 -0.0031 0.0001 346 ASN 48 C -0.0087 -0.0035 0.0001 347 ASN 48 CB -0.0135 -0.0029 0.0006 348 ASN 48 O -0.0084 -0.0026 -0.0013 349 ASN 48 CG -0.0139 -0.0044 0.0029 350 ASN 48 ND2 -0.0153 -0.0043 0.0032 351 ASN 48 OD1 -0.0128 -0.0056 0.0044 352 PHE 49 N -0.0056 -0.0055 0.0013 353 PHE 49 CA -0.0035 -0.0062 0.0017 354 PHE 49 C -0.0041 -0.0071 0.0037 355 PHE 49 CB -0.0012 -0.0069 0.0022 356 PHE 49 O -0.0051 -0.0078 0.0055 357 PHE 49 CG -0.0004 -0.0060 0.0003 358 PHE 49 CD1 0.0013 -0.0054 -0.0015 359 PHE 49 CD2 -0.0013 -0.0059 0.0003 360 PHE 49 CE1 0.0020 -0.0046 -0.0032 361 PHE 49 CE2 -0.0006 -0.0051 -0.0014 362 PHE 49 CZ 0.0011 -0.0045 -0.0032 363 THR 50 N -0.0024 -0.0077 0.0038 364 THR 50 CA -0.0029 -0.0086 0.0062 365 THR 50 C -0.0002 -0.0098 0.0066 366 THR 50 CB -0.0052 -0.0077 0.0059 367 THR 50 O 0.0016 -0.0096 0.0047 368 THR 50 CG2 -0.0080 -0.0066 0.0056 369 THR 50 OG1 -0.0044 -0.0069 0.0035 370 ASP 51 N 0.0026 -0.0099 0.0081 371 ASP 51 CA 0.0039 -0.0109 0.0086 372 ASP 51 C 0.0037 -0.0110 0.0102 373 ASP 51 CB 0.0048 -0.0115 0.0088 374 ASP 51 O 0.0025 -0.0104 0.0108 375 ASP 51 CG 0.0043 -0.0114 0.0102 376 ASP 51 OD1 0.0031 -0.0108 0.0108 377 ASP 51 OD2 0.0051 -0.0120 0.0107 378 ALA 52 N 0.0060 -0.0128 0.0114 379 ALA 52 CA 0.0069 -0.0126 0.0123 380 ALA 52 C 0.0068 -0.0115 0.0129 381 ALA 52 CB 0.0076 -0.0134 0.0125 382 ALA 52 O 0.0073 -0.0110 0.0136 383 ALA 53 N 0.0081 -0.0102 0.0100 384 ALA 53 CA 0.0076 -0.0102 0.0113 385 ALA 53 C 0.0062 -0.0094 0.0115 386 ALA 53 CB 0.0082 -0.0105 0.0113 387 ALA 53 O 0.0057 -0.0093 0.0127 388 GLY 54 N 0.0010 -0.0107 0.0125 389 GLY 54 CA -0.0014 -0.0105 0.0124 390 GLY 54 C -0.0025 -0.0107 0.0142 391 GLY 54 O -0.0044 -0.0106 0.0148 392 ASP 55 N -0.0014 -0.0109 0.0140 393 ASP 55 CA -0.0018 -0.0109 0.0147 394 ASP 55 C -0.0025 -0.0104 0.0139 395 ASP 55 CB -0.0008 -0.0115 0.0151 396 ASP 55 O -0.0020 -0.0103 0.0129 397 ASP 55 CG -0.0012 -0.0115 0.0160 398 ASP 55 OD1 -0.0023 -0.0112 0.0164 399 ASP 55 OD2 -0.0004 -0.0120 0.0164 400 PRO 56 N -0.0069 -0.0114 0.0151 401 PRO 56 CA -0.0083 -0.0108 0.0140 402 PRO 56 C -0.0071 -0.0110 0.0143 403 PRO 56 CB -0.0109 -0.0110 0.0153 404 PRO 56 O -0.0063 -0.0118 0.0162 405 PRO 56 CG -0.0111 -0.0113 0.0162 406 PRO 56 CD -0.0085 -0.0117 0.0169 407 MET 57 N -0.0077 -0.0118 0.0121 408 MET 57 CA -0.0059 -0.0119 0.0121 409 MET 57 C -0.0025 -0.0121 0.0121 410 MET 57 CB -0.0067 -0.0134 0.0144 411 MET 57 O -0.0006 -0.0120 0.0118 412 MET 57 CG -0.0099 -0.0132 0.0144 413 MET 57 SD -0.0107 -0.0149 0.0170 414 MET 57 CE -0.0106 -0.0166 0.0196 415 TYR 58 N 0.0017 -0.0105 0.0106 416 TYR 58 CA 0.0028 -0.0115 0.0103 417 TYR 58 C 0.0026 -0.0113 0.0103 418 TYR 58 CB 0.0029 -0.0131 0.0112 419 TYR 58 O 0.0015 -0.0108 0.0109 420 TYR 58 CG 0.0030 -0.0134 0.0113 421 TYR 58 CD1 0.0042 -0.0135 0.0105 422 TYR 58 CD2 0.0019 -0.0136 0.0121 423 TYR 58 CE1 0.0043 -0.0138 0.0105 424 TYR 58 CE2 0.0020 -0.0139 0.0122 425 TYR 58 OH 0.0034 -0.0143 0.0115 426 TYR 58 CZ 0.0033 -0.0140 0.0114 427 LEU 59 N 0.0049 -0.0118 0.0089 428 LEU 59 CA 0.0056 -0.0118 0.0086 429 LEU 59 C 0.0062 -0.0121 0.0093 430 LEU 59 CB 0.0061 -0.0116 0.0078 431 LEU 59 O 0.0065 -0.0123 0.0097 432 LEU 59 CG 0.0055 -0.0113 0.0071 433 LEU 59 CD1 0.0061 -0.0111 0.0064 434 LEU 59 CD2 0.0051 -0.0111 0.0068 435 THR 60 N 0.0083 -0.0126 0.0091 436 THR 60 CA 0.0088 -0.0117 0.0093 437 THR 60 C 0.0093 -0.0120 0.0091 438 THR 60 CB 0.0096 -0.0112 0.0094 439 THR 60 O 0.0099 -0.0126 0.0087 440 THR 60 CG2 0.0101 -0.0103 0.0096 441 THR 60 OG1 0.0091 -0.0110 0.0096 442 PHE 61 N 0.0086 -0.0104 0.0084 443 PHE 61 CA 0.0079 -0.0114 0.0087 444 PHE 61 C 0.0079 -0.0110 0.0084 445 PHE 61 CB 0.0065 -0.0118 0.0084 446 PHE 61 O 0.0079 -0.0099 0.0077 447 PHE 61 CG 0.0064 -0.0123 0.0087 448 PHE 61 CD1 0.0061 -0.0135 0.0094 449 PHE 61 CD2 0.0065 -0.0115 0.0082 450 PHE 61 CE1 0.0060 -0.0139 0.0097 451 PHE 61 CE2 0.0064 -0.0119 0.0084 452 PHE 61 CZ 0.0061 -0.0131 0.0092 453 THR 62 N 0.0095 -0.0133 0.0088 454 THR 62 CA 0.0112 -0.0111 0.0084 455 THR 62 C 0.0084 -0.0118 0.0083 456 THR 62 CB 0.0157 -0.0125 0.0090 457 THR 62 O 0.0067 -0.0152 0.0090 458 THR 62 CG2 0.0175 -0.0101 0.0086 459 THR 62 OG1 0.0183 -0.0119 0.0091 460 SER 63 N 0.0075 -0.0080 0.0063 461 SER 63 CA 0.0028 -0.0086 0.0059 462 SER 63 C 0.0048 -0.0126 0.0078 463 SER 63 CB 0.0016 -0.0027 0.0034 464 SER 63 O 0.0102 -0.0128 0.0086 465 SER 63 OG 0.0066 -0.0006 0.0032 466 GLN 64 N 0.0013 -0.0155 0.0082 467 GLN 64 CA 0.0027 -0.0204 0.0104 468 GLN 64 C 0.0019 -0.0179 0.0092 469 GLN 64 CB -0.0020 -0.0264 0.0116 470 GLN 64 O 0.0026 -0.0214 0.0107 471 GLN 64 CG -0.0006 -0.0300 0.0133 472 GLN 64 CD -0.0046 -0.0364 0.0148 473 GLN 64 NE2 -0.0020 -0.0409 0.0171 474 GLN 64 OE1 -0.0100 -0.0374 0.0139 475 ASP 65 N -0.0008 -0.0111 0.0062 476 ASP 65 CA -0.0024 -0.0075 0.0047 477 ASP 65 C 0.0039 -0.0049 0.0042 478 ASP 65 CB -0.0071 -0.0023 0.0022 479 ASP 65 O 0.0035 -0.0014 0.0028 480 ASP 65 CG -0.0039 0.0024 0.0006 481 ASP 65 OD1 0.0020 0.0018 0.0013 482 ASP 65 OD2 -0.0074 0.0067 -0.0015 483 GLY 66 N 0.0099 -0.0076 0.0055 484 GLY 66 CA 0.0161 -0.0058 0.0051 485 GLY 66 C 0.0189 0.0004 0.0028 486 GLY 66 O 0.0243 0.0024 0.0023 487 ASN 67 N 0.0147 0.0039 0.0009 488 ASN 67 CA 0.0165 0.0102 -0.0013 489 ASN 67 C 0.0192 0.0101 -0.0011 490 ASN 67 CB 0.0105 0.0144 -0.0033 491 ASN 67 O 0.0208 0.0150 -0.0028 492 ASN 67 CG 0.0084 0.0158 -0.0040 493 ASN 67 ND2 0.0020 0.0164 -0.0046 494 ASN 67 OD1 0.0126 0.0163 -0.0039 495 ASN 68 N 0.0202 0.0047 0.0018 496 ASN 68 CA 0.0232 0.0033 0.0024 497 ASN 68 C 0.0200 0.0068 0.0011 498 ASN 68 CB 0.0306 0.0047 0.0022 499 ASN 68 O 0.0234 0.0091 0.0005 500 ASN 68 CG 0.0345 -0.0003 0.0040 501 ASN 68 ND2 0.0408 0.0009 0.0038 502 ASN 68 OD1 0.0318 -0.0051 0.0055 503 HIS 69 N 0.0132 0.0073 -0.0010 504 HIS 69 CA 0.0108 0.0094 -0.0022 505 HIS 69 C 0.0116 0.0053 0.0001 506 HIS 69 CB 0.0039 0.0111 -0.0031 507 HIS 69 O 0.0107 0.0003 0.0028 508 HIS 69 CG 0.0028 0.0157 -0.0056 509 HIS 69 CD2 0.0060 0.0204 -0.0081 510 HIS 69 ND1 -0.0020 0.0156 -0.0055 511 HIS 69 CE1 -0.0018 0.0202 -0.0080 512 HIS 69 NE2 0.0030 0.0232 -0.0096 513 GLN 70 N 0.0099 0.0014 0.0011 514 GLN 70 CA 0.0102 0.0003 0.0016 515 GLN 70 C 0.0076 0.0009 0.0006 516 GLN 70 CB 0.0131 0.0014 0.0020 517 GLN 70 O 0.0066 0.0032 -0.0006 518 GLN 70 CG 0.0157 0.0006 0.0031 519 GLN 70 CD 0.0186 0.0017 0.0035 520 GLN 70 NE2 0.0209 0.0003 0.0047 521 GLN 70 OE1 0.0187 0.0038 0.0027 522 PHE 71 N 0.0051 -0.0045 0.0033 523 PHE 71 CA 0.0046 -0.0046 0.0037 524 PHE 71 C 0.0062 -0.0055 0.0045 525 PHE 71 CB 0.0025 -0.0051 0.0048 526 PHE 71 O 0.0066 -0.0067 0.0059 527 PHE 71 CG 0.0018 -0.0053 0.0052 528 PHE 71 CD1 0.0009 -0.0064 0.0068 529 PHE 71 CD2 0.0021 -0.0045 0.0041 530 PHE 71 CE1 0.0002 -0.0065 0.0072 531 PHE 71 CE2 0.0015 -0.0047 0.0044 532 PHE 71 CZ 0.0005 -0.0057 0.0060 533 THR 72 N 0.0088 -0.0091 0.0065 534 THR 72 CA 0.0091 -0.0101 0.0066 535 THR 72 C 0.0083 -0.0106 0.0073 536 THR 72 CB 0.0096 -0.0098 0.0061 537 THR 72 O 0.0076 -0.0100 0.0077 538 THR 72 CG2 0.0100 -0.0108 0.0062 539 THR 72 OG1 0.0104 -0.0093 0.0054 540 THR 73 N 0.0074 -0.0120 0.0087 541 THR 73 CA 0.0076 -0.0121 0.0092 542 THR 73 C 0.0076 -0.0125 0.0091 543 THR 73 CB 0.0075 -0.0117 0.0094 544 THR 73 O 0.0076 -0.0127 0.0088 545 THR 73 CG2 0.0075 -0.0112 0.0094 546 THR 73 OG1 0.0075 -0.0116 0.0091 547 LYS 74 N 0.0071 -0.0141 0.0095 548 LYS 74 CA 0.0068 -0.0141 0.0093 549 LYS 74 C 0.0075 -0.0126 0.0092 550 LYS 74 CB 0.0072 -0.0155 0.0100 551 LYS 74 O 0.0086 -0.0119 0.0096 552 LYS 74 CG 0.0088 -0.0156 0.0108 553 LYS 74 CD 0.0092 -0.0171 0.0115 554 LYS 74 CE 0.0108 -0.0172 0.0123 555 LYS 74 NZ 0.0111 -0.0187 0.0129 556 VAL 75 N 0.0045 -0.0130 0.0094 557 VAL 75 CA 0.0050 -0.0117 0.0078 558 VAL 75 C 0.0041 -0.0120 0.0079 559 VAL 75 CB 0.0039 -0.0107 0.0060 560 VAL 75 O 0.0022 -0.0125 0.0081 561 VAL 75 CG1 0.0045 -0.0093 0.0043 562 VAL 75 CG2 0.0046 -0.0105 0.0060 563 ILE 76 N 0.0055 -0.0131 0.0074 564 ILE 76 CA 0.0054 -0.0134 0.0076 565 ILE 76 C 0.0067 -0.0113 0.0062 566 ILE 76 CB 0.0068 -0.0153 0.0096 567 ILE 76 O 0.0086 -0.0100 0.0056 568 ILE 76 CG1 0.0098 -0.0148 0.0102 569 ILE 76 CG2 0.0053 -0.0175 0.0111 570 ILE 76 CD1 0.0116 -0.0163 0.0120 571 GLY 77 N 0.0050 -0.0097 0.0046 572 GLY 77 CA 0.0071 -0.0070 0.0029 573 GLY 77 C 0.0090 -0.0079 0.0037 574 GLY 77 O 0.0085 -0.0107 0.0056 575 LYS 78 N 0.0125 -0.0047 0.0011 576 LYS 78 CA 0.0147 -0.0054 0.0019 577 LYS 78 C 0.0133 -0.0022 -0.0006 578 LYS 78 CB 0.0204 -0.0054 0.0027 579 LYS 78 O 0.0132 0.0014 -0.0032 580 LYS 78 CG 0.0221 -0.0087 0.0052 581 LYS 78 CD 0.0213 -0.0129 0.0082 582 LYS 78 CE 0.0237 -0.0161 0.0108 583 LYS 78 NZ 0.0237 -0.0201 0.0137 584 ASP 79 N 0.0145 -0.0021 -0.0007 585 ASP 79 CA 0.0138 0.0021 -0.0034 586 ASP 79 C 0.0199 0.0035 -0.0041 587 ASP 79 CB 0.0092 0.0005 -0.0025 588 ASP 79 O 0.0247 0.0016 -0.0027 589 ASP 79 CG 0.0116 -0.0034 0.0000 590 ASP 79 OD1 0.0171 -0.0045 0.0009 591 ASP 79 OD2 0.0080 -0.0055 0.0012 592 SER 80 N 0.0206 0.0066 -0.0077 593 SER 80 CA 0.0267 0.0091 -0.0084 594 SER 80 C 0.0304 0.0044 -0.0043 595 SER 80 CB 0.0246 0.0133 -0.0119 596 SER 80 O 0.0365 0.0054 -0.0040 597 SER 80 OG 0.0197 0.0106 -0.0108 598 ARG 81 N 0.0279 0.0013 -0.0012 599 ARG 81 CA 0.0308 -0.0034 0.0021 600 ARG 81 C 0.0329 -0.0080 0.0053 601 ARG 81 CB 0.0258 -0.0060 0.0035 602 ARG 81 O 0.0349 -0.0125 0.0085 603 ARG 81 CG 0.0240 -0.0020 0.0007 604 ARG 81 CD 0.0183 -0.0045 0.0020 605 ARG 81 NE 0.0119 -0.0050 0.0019 606 ARG 81 NH1 0.0058 -0.0091 0.0043 607 ARG 81 NH2 0.0007 -0.0075 0.0029 608 ARG 81 CZ 0.0061 -0.0072 0.0030 609 ASP 82 N 0.0312 -0.0059 0.0049 610 ASP 82 CA 0.0331 -0.0094 0.0073 611 ASP 82 C 0.0284 -0.0148 0.0101 612 ASP 82 CB 0.0404 -0.0111 0.0091 613 ASP 82 O 0.0304 -0.0192 0.0130 614 ASP 82 CG 0.0435 -0.0128 0.0105 615 ASP 82 OD1 0.0411 -0.0109 0.0091 616 ASP 82 OD2 0.0482 -0.0161 0.0131 617 PHE 83 N 0.0231 -0.0136 0.0094 618 PHE 83 CA 0.0177 -0.0182 0.0113 619 PHE 83 C 0.0139 -0.0168 0.0096 620 PHE 83 CB 0.0128 -0.0191 0.0109 621 PHE 83 O 0.0130 -0.0117 0.0062 622 PHE 83 CG 0.0158 -0.0219 0.0132 623 PHE 83 CD1 0.0178 -0.0274 0.0172 624 PHE 83 CD2 0.0166 -0.0189 0.0115 625 PHE 83 CE1 0.0205 -0.0300 0.0194 626 PHE 83 CE2 0.0194 -0.0214 0.0136 627 PHE 83 CZ 0.0213 -0.0269 0.0176 628 ASP 84 N 0.0117 -0.0184 0.0111 629 ASP 84 CA 0.0093 -0.0182 0.0108 630 ASP 84 C 0.0046 -0.0163 0.0092 631 ASP 84 CB 0.0085 -0.0222 0.0135 632 ASP 84 O 0.0021 -0.0171 0.0096 633 ASP 84 CG 0.0130 -0.0239 0.0148 634 ASP 84 OD1 0.0165 -0.0217 0.0136 635 ASP 84 OD2 0.0130 -0.0274 0.0172 636 ILE 85 N 0.0029 -0.0122 0.0066 637 ILE 85 CA -0.0015 -0.0105 0.0051 638 ILE 85 C -0.0030 -0.0115 0.0059 639 ILE 85 CB -0.0012 -0.0064 0.0016 640 ILE 85 O -0.0001 -0.0117 0.0062 641 ILE 85 CG1 0.0022 -0.0048 0.0003 642 ILE 85 CG2 0.0001 -0.0054 0.0007 643 ILE 85 CD1 0.0022 -0.0008 -0.0032 644 SER 86 N -0.0051 -0.0106 0.0071 645 SER 86 CA -0.0060 -0.0117 0.0083 646 SER 86 C -0.0088 -0.0099 0.0064 647 SER 86 CB -0.0079 -0.0144 0.0113 648 SER 86 O -0.0123 -0.0096 0.0062 649 SER 86 OG -0.0054 -0.0162 0.0132 650 PRO 87 N -0.0066 -0.0079 0.0040 651 PRO 87 CA -0.0085 -0.0069 0.0028 652 PRO 87 C -0.0102 -0.0082 0.0047 653 PRO 87 CB -0.0061 -0.0059 0.0012 654 PRO 87 O -0.0097 -0.0100 0.0070 655 PRO 87 CG -0.0032 -0.0072 0.0027 656 PRO 87 CD -0.0029 -0.0082 0.0039 657 LYS 88 N -0.0119 -0.0068 0.0031 658 LYS 88 CA -0.0131 -0.0079 0.0052 659 LYS 88 C -0.0101 -0.0085 0.0056 660 LYS 88 CB -0.0164 -0.0068 0.0039 661 LYS 88 O -0.0081 -0.0074 0.0034 662 LYS 88 CG -0.0198 -0.0064 0.0038 663 LYS 88 CD -0.0230 -0.0054 0.0026 664 LYS 88 CE -0.0263 -0.0049 0.0024 665 LYS 88 NZ -0.0294 -0.0038 0.0011 666 VAL 89 N -0.0082 -0.0092 0.0058 667 VAL 89 CA -0.0060 -0.0094 0.0064 668 VAL 89 C -0.0072 -0.0098 0.0077 669 VAL 89 CB -0.0039 -0.0100 0.0081 670 VAL 89 O -0.0085 -0.0104 0.0097 671 VAL 89 CG1 -0.0016 -0.0102 0.0087 672 VAL 89 CG2 -0.0028 -0.0096 0.0069 673 ASN 90 N -0.0069 -0.0086 0.0067 674 ASN 90 CA -0.0079 -0.0088 0.0076 675 ASN 90 C -0.0107 -0.0089 0.0081 676 ASN 90 CB -0.0064 -0.0095 0.0099 677 ASN 90 O -0.0116 -0.0094 0.0100 678 ASN 90 CG -0.0037 -0.0094 0.0094 679 ASN 90 ND2 -0.0020 -0.0099 0.0111 680 ASN 90 OD1 -0.0030 -0.0089 0.0076 681 GLY 91 N -0.0130 -0.0087 0.0059 682 GLY 91 CA -0.0165 -0.0092 0.0056 683 GLY 91 C -0.0182 -0.0102 0.0077 684 GLY 91 O -0.0211 -0.0106 0.0075 685 GLU 92 N -0.0161 -0.0116 0.0082 686 GLU 92 CA -0.0170 -0.0123 0.0097 687 GLU 92 C -0.0153 -0.0121 0.0097 688 GLU 92 CB -0.0171 -0.0134 0.0123 689 GLU 92 O -0.0130 -0.0117 0.0093 690 GLU 92 CG -0.0192 -0.0138 0.0125 691 GLU 92 CD -0.0197 -0.0149 0.0151 692 GLU 92 OE1 -0.0212 -0.0153 0.0156 693 GLU 92 OE2 -0.0186 -0.0154 0.0166 694 ASN 93 N -0.0182 -0.0139 0.0106 695 ASN 93 CA -0.0159 -0.0137 0.0111 696 ASN 93 C -0.0155 -0.0154 0.0148 697 ASN 93 CB -0.0173 -0.0129 0.0088 698 ASN 93 O -0.0180 -0.0168 0.0167 699 ASN 93 CG -0.0212 -0.0140 0.0095 700 ASN 93 ND2 -0.0219 -0.0142 0.0096 701 ASN 93 OD1 -0.0236 -0.0147 0.0099 702 LEU 94 N -0.0106 -0.0154 0.0128 703 LEU 94 CA -0.0102 -0.0167 0.0154 704 LEU 94 C -0.0123 -0.0168 0.0154 705 LEU 94 CB -0.0067 -0.0165 0.0159 706 LEU 94 O -0.0134 -0.0158 0.0131 707 LEU 94 CG -0.0043 -0.0166 0.0164 708 LEU 94 CD1 -0.0010 -0.0162 0.0163 709 LEU 94 CD2 -0.0048 -0.0181 0.0193 710 VAL 95 N -0.0145 -0.0232 0.0230 711 VAL 95 CA -0.0182 -0.0255 0.0242 712 VAL 95 C -0.0153 -0.0234 0.0226 713 VAL 95 CB -0.0190 -0.0293 0.0308 714 VAL 95 O -0.0099 -0.0218 0.0243 715 VAL 95 CG1 -0.0228 -0.0316 0.0319 716 VAL 95 CG2 -0.0220 -0.0315 0.0324 717 GLY 96 N -0.0181 -0.0214 0.0192 718 GLY 96 CA -0.0158 -0.0194 0.0173 719 GLY 96 C -0.0190 -0.0175 0.0140 720 GLY 96 O -0.0229 -0.0175 0.0130 721 ASP 97 N -0.0165 -0.0158 0.0133 722 ASP 97 CA -0.0195 -0.0139 0.0099 723 ASP 97 C -0.0195 -0.0097 0.0054 724 ASP 97 CB -0.0170 -0.0136 0.0106 725 ASP 97 O -0.0155 -0.0076 0.0049 726 ASP 97 CG -0.0179 -0.0177 0.0147 727 ASP 97 OD1 -0.0217 -0.0206 0.0162 728 ASP 97 OD2 -0.0146 -0.0179 0.0164 729 ASP 98 N -0.0239 -0.0057 0.0052 730 ASP 98 CA -0.0243 -0.0023 0.0017 731 ASP 98 C -0.0216 0.0004 -0.0017 732 ASP 98 CB -0.0299 -0.0008 0.0012 733 ASP 98 O -0.0231 0.0015 -0.0026 734 ASP 98 CG -0.0305 0.0022 -0.0020 735 ASP 98 OD1 -0.0269 0.0027 -0.0032 736 ASP 98 OD2 -0.0347 0.0041 -0.0033 737 VAL 99 N -0.0183 0.0009 -0.0027 738 VAL 99 CA -0.0148 0.0032 -0.0053 739 VAL 99 C -0.0142 0.0069 -0.0092 740 VAL 99 CB -0.0092 0.0013 -0.0036 741 VAL 99 O -0.0141 0.0071 -0.0094 742 VAL 99 CG1 -0.0056 0.0039 -0.0064 743 VAL 99 CG2 -0.0098 -0.0024 0.0004 744 VAL 100 N -0.0137 0.0116 -0.0136 745 VAL 100 CA -0.0129 0.0151 -0.0169 746 VAL 100 C -0.0076 0.0142 -0.0176 747 VAL 100 CB -0.0133 0.0189 -0.0202 748 VAL 100 O -0.0037 0.0127 -0.0173 749 VAL 100 CG1 -0.0120 0.0225 -0.0237 750 VAL 100 CG2 -0.0187 0.0199 -0.0196 751 LEU 101 N -0.0082 0.0153 -0.0178 752 LEU 101 CA -0.0035 0.0140 -0.0187 753 LEU 101 C -0.0006 0.0165 -0.0228 754 LEU 101 CB -0.0040 0.0138 -0.0183 755 LEU 101 O -0.0026 0.0196 -0.0252 756 LEU 101 CG -0.0069 0.0115 -0.0144 757 LEU 101 CD1 -0.0068 0.0114 -0.0143 758 LEU 101 CD2 -0.0049 0.0076 -0.0112 759 ALA 102 N 0.0027 0.0165 -0.0221 760 ALA 102 CA 0.0058 0.0184 -0.0262 761 ALA 102 C 0.0049 0.0214 -0.0298 762 ALA 102 CB 0.0114 0.0164 -0.0258 763 ALA 102 O 0.0039 0.0212 -0.0291 764 THR 103 N 0.0058 0.0243 -0.0358 765 THR 103 CA 0.0050 0.0279 -0.0388 766 THR 103 C 0.0087 0.0263 -0.0395 767 THR 103 CB 0.0058 0.0320 -0.0432 768 THR 103 O 0.0134 0.0239 -0.0402 769 THR 103 CG2 0.0048 0.0359 -0.0462 770 THR 103 OG1 0.0022 0.0336 -0.0424 771 GLY 104 N 0.0054 0.0254 -0.0380 772 GLY 104 CA 0.0078 0.0232 -0.0385 773 GLY 104 C 0.0078 0.0181 -0.0347 774 GLY 104 O 0.0057 0.0174 -0.0324 775 SER 105 N 0.0083 0.0156 -0.0309 776 SER 105 CA 0.0092 0.0126 -0.0279 777 SER 105 C 0.0091 0.0107 -0.0254 778 SER 105 CB 0.0131 0.0110 -0.0290 779 SER 105 O 0.0097 0.0113 -0.0266 780 SER 105 OG 0.0160 0.0105 -0.0305 781 GLN 106 N 0.0094 0.0090 -0.0187 782 GLN 106 CA 0.0094 0.0067 -0.0162 783 GLN 106 C 0.0114 0.0034 -0.0140 784 GLN 106 CB 0.0053 0.0073 -0.0140 785 GLN 106 O 0.0107 0.0027 -0.0128 786 GLN 106 CG 0.0050 0.0050 -0.0113 787 GLN 106 CD 0.0064 0.0052 -0.0125 788 GLN 106 NE2 0.0093 0.0027 -0.0118 789 GLN 106 OE1 0.0049 0.0077 -0.0141 790 ASP 107 N 0.0111 0.0017 -0.0104 791 ASP 107 CA 0.0131 -0.0003 -0.0082 792 ASP 107 C 0.0111 -0.0016 -0.0052 793 ASP 107 CB 0.0163 -0.0011 -0.0084 794 ASP 107 O 0.0095 -0.0017 -0.0044 795 ASP 107 CG 0.0187 -0.0001 -0.0111 796 ASP 107 OD1 0.0183 0.0010 -0.0126 797 ASP 107 OD2 0.0211 -0.0004 -0.0117 798 PHE 108 N 0.0101 -0.0035 -0.0037 799 PHE 108 CA 0.0089 -0.0055 -0.0013 800 PHE 108 C 0.0113 -0.0072 0.0001 801 PHE 108 CB 0.0061 -0.0053 -0.0011 802 PHE 108 O 0.0129 -0.0068 -0.0007 803 PHE 108 CG 0.0035 -0.0038 -0.0022 804 PHE 108 CD1 0.0015 -0.0045 -0.0010 805 PHE 108 CD2 0.0030 -0.0018 -0.0043 806 PHE 108 CE1 -0.0010 -0.0032 -0.0020 807 PHE 108 CE2 0.0006 -0.0004 -0.0054 808 PHE 108 CZ -0.0014 -0.0011 -0.0042 809 PHE 109 N 0.0098 -0.0081 0.0060 810 PHE 109 CA 0.0111 -0.0093 0.0067 811 PHE 109 C 0.0097 -0.0107 0.0074 812 PHE 109 CB 0.0127 -0.0103 0.0074 813 PHE 109 O 0.0083 -0.0117 0.0078 814 PHE 109 CG 0.0141 -0.0090 0.0068 815 PHE 109 CD1 0.0159 -0.0081 0.0064 816 PHE 109 CD2 0.0137 -0.0088 0.0066 817 PHE 109 CE1 0.0171 -0.0069 0.0058 818 PHE 109 CE2 0.0150 -0.0076 0.0060 819 PHE 109 CZ 0.0167 -0.0066 0.0056 820 VAL 110 N 0.0095 -0.0109 0.0077 821 VAL 110 CA 0.0095 -0.0110 0.0080 822 VAL 110 C 0.0102 -0.0112 0.0096 823 VAL 110 CB 0.0100 -0.0100 0.0069 824 VAL 110 O 0.0113 -0.0104 0.0100 825 VAL 110 CG1 0.0099 -0.0103 0.0071 826 VAL 110 CG2 0.0094 -0.0098 0.0053 827 ARG 111 N 0.0094 -0.0111 0.0106 828 ARG 111 CA 0.0101 -0.0117 0.0117 829 ARG 111 C 0.0095 -0.0124 0.0111 830 ARG 111 CB 0.0106 -0.0131 0.0128 831 ARG 111 O 0.0085 -0.0131 0.0101 832 ARG 111 CG 0.0114 -0.0125 0.0136 833 ARG 111 CD 0.0120 -0.0138 0.0148 834 ARG 111 NE 0.0128 -0.0131 0.0156 835 ARG 111 NH1 0.0144 -0.0127 0.0175 836 ARG 111 NH2 0.0146 -0.0121 0.0174 837 ARG 111 CZ 0.0139 -0.0126 0.0168 838 SER 112 N 0.0078 -0.0105 0.0117 839 SER 112 CA 0.0076 -0.0096 0.0090 840 SER 112 C 0.0091 -0.0113 0.0079 841 SER 112 CB 0.0059 -0.0073 0.0093 842 SER 112 O 0.0098 -0.0127 0.0096 843 SER 112 OG 0.0060 -0.0078 0.0108 844 ILE 113 N 0.0075 -0.0122 0.0061 845 ILE 113 CA 0.0095 -0.0131 0.0042 846 ILE 113 C 0.0083 -0.0125 0.0017 847 ILE 113 CB 0.0112 -0.0139 0.0033 848 ILE 113 O 0.0096 -0.0131 -0.0005 849 ILE 113 CG1 0.0096 -0.0131 0.0019 850 ILE 113 CG2 0.0126 -0.0147 0.0058 851 ILE 113 CD1 0.0112 -0.0139 0.0003 852 GLY 114 N 0.0080 -0.0075 0.0009 853 GLY 114 CA 0.0056 -0.0034 -0.0032 854 GLY 114 C 0.0055 -0.0011 -0.0076 855 GLY 114 O 0.0060 -0.0020 -0.0067 856 SER 115 N 0.0039 0.0060 -0.0128 857 SER 115 CA 0.0049 0.0086 -0.0163 858 SER 115 C 0.0086 0.0075 -0.0198 859 SER 115 CB 0.0025 0.0132 -0.0172 860 SER 115 O 0.0095 0.0101 -0.0231 861 SER 115 OG -0.0010 0.0143 -0.0139 862 LYS 116 N 0.0088 0.0011 -0.0114 863 LYS 116 CA 0.0111 -0.0023 -0.0166 864 LYS 116 C 0.0137 -0.0001 -0.0228 865 LYS 116 CB 0.0110 -0.0100 -0.0158 866 LYS 116 O 0.0140 -0.0000 -0.0236 867 LYS 116 CG 0.0099 -0.0134 -0.0130 868 LYS 116 CD 0.0107 -0.0209 -0.0143 869 LYS 116 CE 0.0097 -0.0243 -0.0117 870 LYS 116 NZ 0.0106 -0.0316 -0.0132 871 GLY 117 N 0.0154 0.0087 -0.0263 872 GLY 117 CA 0.0192 0.0091 -0.0288 873 GLY 117 C 0.0165 0.0145 -0.0301 874 GLY 117 O 0.0189 0.0151 -0.0319 875 GLY 118 N 0.0149 0.0178 -0.0328 876 GLY 118 CA 0.0127 0.0241 -0.0340 877 GLY 118 C 0.0071 0.0246 -0.0303 878 GLY 118 O 0.0044 0.0202 -0.0266 879 LYS 119 N 0.0060 0.0296 -0.0342 880 LYS 119 CA -0.0044 0.0299 -0.0303 881 LYS 119 C -0.0069 0.0263 -0.0212 882 LYS 119 CB -0.0120 0.0346 -0.0376 883 LYS 119 O -0.0041 0.0254 -0.0205 884 LYS 119 CG -0.0114 0.0383 -0.0461 885 LYS 119 CD -0.0196 0.0429 -0.0530 886 LYS 119 CE -0.0187 0.0467 -0.0617 887 LYS 119 NZ -0.0265 0.0512 -0.0685 888 LEU 120 N -0.0110 0.0226 -0.0188 889 LEU 120 CA -0.0125 0.0191 -0.0141 890 LEU 120 C -0.0187 0.0214 -0.0140 891 LEU 120 CB -0.0134 0.0151 -0.0090 892 LEU 120 O -0.0233 0.0246 -0.0157 893 LEU 120 CG -0.0073 0.0120 -0.0081 894 LEU 120 CD1 -0.0091 0.0085 -0.0033 895 LEU 120 CD2 -0.0021 0.0094 -0.0074 896 ALA 121 N -0.0172 0.0185 -0.0103 897 ALA 121 CA -0.0217 0.0185 -0.0097 898 ALA 121 C -0.0254 0.0146 -0.0060 899 ALA 121 CB -0.0191 0.0185 -0.0101 900 ALA 121 O -0.0233 0.0110 -0.0033 901 ALA 122 N -0.0309 0.0175 -0.0050 902 ALA 122 CA -0.0363 0.0115 -0.0011 903 ALA 122 C -0.0319 0.0055 0.0004 904 ALA 122 CB -0.0442 0.0153 -0.0008 905 ALA 122 O -0.0266 0.0075 -0.0018 906 GLY 123 N -0.0325 0.0007 0.0020 907 GLY 123 CA -0.0294 -0.0056 0.0056 908 GLY 123 C -0.0270 -0.0090 0.0078 909 GLY 123 O -0.0288 -0.0073 0.0065 910 LYS 124 N -0.0214 -0.0179 0.0031 911 LYS 124 CA -0.0198 -0.0219 0.0045 912 LYS 124 C -0.0130 -0.0185 0.0065 913 LYS 124 CB -0.0192 -0.0302 0.0066 914 LYS 124 O -0.0077 -0.0165 0.0081 915 LYS 124 CG -0.0262 -0.0344 0.0047 916 LYS 124 CD -0.0254 -0.0428 0.0068 917 LYS 124 CE -0.0323 -0.0470 0.0050 918 LYS 124 NZ -0.0315 -0.0552 0.0071 919 TYR 125 N -0.0099 -0.0167 0.0082 920 TYR 125 CA -0.0052 -0.0163 0.0085 921 TYR 125 C -0.0038 -0.0209 0.0105 922 TYR 125 CB -0.0053 -0.0128 0.0071 923 TYR 125 O -0.0068 -0.0233 0.0112 924 TYR 125 CG -0.0059 -0.0080 0.0051 925 TYR 125 CD1 -0.0020 -0.0049 0.0042 926 TYR 125 CD2 -0.0104 -0.0065 0.0041 927 TYR 125 CE1 -0.0024 -0.0004 0.0024 928 TYR 125 CE2 -0.0109 -0.0021 0.0022 929 TYR 125 OH -0.0074 0.0052 -0.0004 930 TYR 125 CZ -0.0069 0.0009 0.0014 931 THR 126 N 0.0026 -0.0214 0.0100 932 THR 126 CA 0.0036 -0.0238 0.0116 933 THR 126 C 0.0069 -0.0224 0.0128 934 THR 126 CB 0.0036 -0.0270 0.0131 935 THR 126 O 0.0087 -0.0203 0.0129 936 THR 126 CG2 0.0058 -0.0265 0.0141 937 THR 126 OG1 0.0046 -0.0293 0.0146 938 ASP 127 N 0.0081 -0.0187 0.0094 939 ASP 127 CA 0.0087 -0.0180 0.0102 940 ASP 127 C 0.0087 -0.0186 0.0103 941 ASP 127 CB 0.0086 -0.0166 0.0099 942 ASP 127 O 0.0082 -0.0192 0.0096 943 ASP 127 CG 0.0093 -0.0158 0.0108 944 ASP 127 OD1 0.0099 -0.0163 0.0117 945 ASP 127 OD2 0.0093 -0.0147 0.0106 946 ALA 128 N 0.0084 -0.0198 0.0082 947 ALA 128 CA 0.0078 -0.0191 0.0073 948 ALA 128 C 0.0064 -0.0162 0.0069 949 ALA 128 CB 0.0086 -0.0199 0.0093 950 ALA 128 O 0.0061 -0.0146 0.0090 951 VAL 129 N 0.0067 -0.0119 0.0039 952 VAL 129 CA 0.0049 -0.0104 0.0037 953 VAL 129 C 0.0037 -0.0089 0.0021 954 VAL 129 CB 0.0054 -0.0104 0.0026 955 VAL 129 O 0.0047 -0.0089 0.0001 956 VAL 129 CG1 0.0035 -0.0088 0.0021 957 VAL 129 CG2 0.0065 -0.0119 0.0042 958 THR 130 N 0.0021 -0.0088 0.0023 959 THR 130 CA 0.0002 -0.0067 0.0005 960 THR 130 C -0.0015 -0.0049 -0.0008 961 THR 130 CB -0.0017 -0.0061 0.0025 962 THR 130 O -0.0025 -0.0049 0.0009 963 THR 130 CG2 -0.0036 -0.0040 0.0006 964 THR 130 OG1 -0.0001 -0.0078 0.0036 965 VAL 131 N -0.0028 -0.0023 -0.0036 966 VAL 131 CA -0.0040 -0.0009 -0.0046 967 VAL 131 C -0.0065 0.0011 -0.0054 968 VAL 131 CB -0.0019 -0.0006 -0.0069 969 VAL 131 O -0.0064 0.0018 -0.0066 970 VAL 131 CG1 -0.0009 0.0004 -0.0092 971 VAL 131 CG2 -0.0033 0.0008 -0.0079 972 THR 132 N -0.0092 0.0022 -0.0043 973 THR 132 CA -0.0125 0.0046 -0.0055 974 THR 132 C -0.0135 0.0061 -0.0070 975 THR 132 CB -0.0158 0.0044 -0.0026 976 THR 132 O -0.0136 0.0051 -0.0055 977 THR 132 CG2 -0.0192 0.0069 -0.0039 978 THR 132 OG1 -0.0148 0.0029 -0.0011 979 VAL 133 N -0.0147 0.0093 -0.0076 980 VAL 133 CA -0.0149 0.0114 -0.0093 981 VAL 133 C -0.0184 0.0141 -0.0090 982 VAL 133 CB -0.0122 0.0128 -0.0126 983 VAL 133 O -0.0193 0.0159 -0.0098 984 VAL 133 CG1 -0.0123 0.0148 -0.0143 985 VAL 133 CG2 -0.0088 0.0101 -0.0129 986 SER 134 N -0.0211 0.0137 -0.0076 987 SER 134 CA -0.0248 0.0159 -0.0074 988 SER 134 C -0.0241 0.0193 -0.0096 989 SER 134 CB -0.0271 0.0137 -0.0051 990 SER 134 O -0.0210 0.0194 -0.0110 991 SER 134 OG -0.0276 0.0104 -0.0030 992 ASN 135 N -0.0256 0.0272 -0.0055 993 ASN 135 CA -0.0256 0.0304 -0.0071 994 ASN 135 C -0.0227 0.0325 -0.0094 995 ASN 135 CB -0.0250 0.0296 -0.0070 996 ASN 135 O -0.0209 0.0339 -0.0109 997 ASN 135 CG -0.0281 0.0281 -0.0050 998 ASN 135 ND2 -0.0272 0.0259 -0.0042 999 ASN 135 OD1 -0.0313 0.0290 -0.0041 1000 GLN 136 N -0.0113 0.0330 -0.0063 1001 GLN 136 CA -0.0113 0.0315 -0.0075 1002 GLN 136 C -0.0113 0.0345 -0.0047 1003 GLN 136 CB -0.0129 0.0263 -0.0065 1004 GLN 136 O -0.0118 0.0363 -0.0008 1005 GLN 136 CG -0.0130 0.0230 -0.0093 1006 GLN 136 CD -0.0117 0.0231 -0.0146 1007 GLN 136 NE2 -0.0110 0.0234 -0.0171 1008 GLN 136 OE1 -0.0113 0.0229 -0.0164