1 GLY 325 N 0.0204 0.0128 -0.0043 2 GLY 325 CA 0.0176 0.0106 -0.0100 3 GLY 325 C 0.0167 0.0078 -0.0084 4 GLY 325 O 0.0189 0.0096 -0.0040 5 ARG 326 N 0.0136 0.0034 -0.0116 6 ARG 326 CA 0.0124 -0.0001 -0.0098 7 ARG 326 C 0.0128 -0.0035 -0.0031 8 ARG 326 O 0.0126 -0.0052 -0.0010 9 ARG 326 CB 0.0088 -0.0044 -0.0147 10 ARG 326 CG 0.0083 -0.0011 -0.0216 11 ARG 326 CD 0.0053 -0.0045 -0.0259 12 ARG 326 NE 0.0051 -0.0009 -0.0323 13 ARG 326 CZ 0.0067 0.0033 -0.0338 14 ARG 326 NH1 0.0061 0.0059 -0.0397 15 ARG 326 NH2 0.0089 0.0053 -0.0297 16 LEU 327 N 0.0150 0.0009 -0.0023 17 LEU 327 CA 0.0145 0.0003 -0.0001 18 LEU 327 C 0.0136 -0.0010 0.0001 19 LEU 327 O 0.0137 -0.0010 -0.0011 20 LEU 327 CB 0.0154 0.0020 0.0015 21 LEU 327 CG 0.0164 0.0034 0.0014 22 LEU 327 CD1 0.0173 0.0050 0.0030 23 LEU 327 CD2 0.0159 0.0027 0.0022 24 ILE 328 N 0.0127 -0.0022 0.0017 25 ILE 328 CA 0.0120 -0.0033 0.0023 26 ILE 328 C 0.0125 -0.0023 0.0041 27 ILE 328 O 0.0125 -0.0021 0.0059 28 ILE 328 CB 0.0107 -0.0052 0.0030 29 ILE 328 CG1 0.0101 -0.0063 0.0012 30 ILE 328 CG2 0.0099 -0.0063 0.0040 31 ILE 328 CD1 0.0090 -0.0080 0.0018 32 TYR 329 N 0.0055 0.0007 0.0027 33 TYR 329 CA 0.0056 0.0005 0.0029 34 TYR 329 C 0.0056 -0.0007 0.0030 35 TYR 329 O 0.0052 -0.0013 0.0023 36 TYR 329 CB 0.0052 0.0010 0.0022 37 TYR 329 CG 0.0052 0.0023 0.0021 38 TYR 329 CD1 0.0049 0.0028 0.0016 39 TYR 329 CD2 0.0055 0.0029 0.0026 40 TYR 329 CE1 0.0049 0.0039 0.0017 41 TYR 329 CE2 0.0056 0.0041 0.0026 42 TYR 329 CZ 0.0053 0.0046 0.0022 43 TYR 329 OH 0.0053 0.0057 0.0022 44 THR 330 N 0.0061 -0.0011 0.0038 45 THR 330 CA 0.0061 -0.0022 0.0039 46 THR 330 C 0.0062 -0.0022 0.0040 47 THR 330 O 0.0066 -0.0015 0.0046 48 THR 330 CB 0.0066 -0.0029 0.0046 49 THR 330 CG2 0.0072 -0.0025 0.0056 50 THR 330 OG1 0.0066 -0.0040 0.0046 51 ALA 331 N -0.0013 -0.0064 0.0059 52 ALA 331 CA -0.0007 -0.0088 0.0072 53 ALA 331 C -0.0012 -0.0093 0.0080 54 ALA 331 O -0.0030 -0.0083 0.0088 55 ALA 331 CB -0.0017 -0.0097 0.0087 56 GLY 332 N 0.0003 -0.0110 0.0080 57 GLY 332 CA 0.0000 -0.0118 0.0089 58 GLY 332 C -0.0004 -0.0101 0.0079 59 GLY 332 O 0.0008 -0.0091 0.0062 60 GLY 333 N -0.0064 -0.0094 0.0116 61 GLY 333 CA -0.0059 -0.0055 0.0096 62 GLY 333 C -0.0057 -0.0054 0.0068 63 GLY 333 O -0.0059 -0.0081 0.0067 64 TYR 334 N -0.0052 -0.0022 0.0047 65 TYR 334 CA -0.0050 -0.0014 0.0021 66 TYR 334 C -0.0046 0.0001 -0.0019 67 TYR 334 O -0.0043 0.0033 -0.0021 68 TYR 334 CB -0.0049 0.0014 0.0041 69 TYR 334 CG -0.0046 0.0023 0.0019 70 TYR 334 CD1 -0.0042 0.0053 -0.0009 71 TYR 334 CD2 -0.0049 0.0002 0.0028 72 TYR 334 CE1 -0.0039 0.0063 -0.0027 73 TYR 334 CE2 -0.0047 0.0011 0.0010 74 TYR 334 CZ -0.0042 0.0042 -0.0018 75 TYR 334 OH -0.0040 0.0052 -0.0036 76 PHE 335 N -0.0043 0.0016 0.0017 77 PHE 335 CA 0.0002 0.0018 -0.0003 78 PHE 335 C 0.0004 -0.0019 -0.0040 79 PHE 335 O -0.0018 -0.0036 -0.0046 80 PHE 335 CB 0.0016 0.0044 0.0016 81 PHE 335 CG 0.0064 0.0051 -0.0000 82 PHE 335 CD1 0.0099 0.0073 0.0004 83 PHE 335 CD2 0.0074 0.0038 -0.0019 84 PHE 335 CE1 0.0144 0.0082 -0.0009 85 PHE 335 CE2 0.0119 0.0046 -0.0033 86 PHE 335 CZ 0.0154 0.0069 -0.0027 87 ARG 336 N 0.0030 -0.0032 -0.0066 88 ARG 336 CA 0.0032 -0.0069 -0.0104 89 ARG 336 C -0.0012 -0.0097 -0.0110 90 ARG 336 O -0.0009 -0.0119 -0.0133 91 ARG 336 CB 0.0048 -0.0080 -0.0122 92 ARG 336 CG 0.0087 -0.0052 -0.0113 93 ARG 336 CD 0.0127 -0.0035 -0.0117 94 ARG 336 NE 0.0167 -0.0012 -0.0114 95 ARG 336 CZ 0.0199 0.0015 -0.0102 96 ARG 336 NH1 0.0197 0.0027 -0.0090 97 ARG 336 NH2 0.0234 0.0031 -0.0104 98 GLN 337 N -0.0121 -0.0086 -0.0117 99 GLN 337 CA -0.0111 -0.0103 -0.0083 100 GLN 337 C -0.0100 -0.0129 -0.0042 101 GLN 337 O -0.0103 -0.0138 -0.0043 102 GLN 337 CB -0.0128 -0.0136 -0.0104 103 GLN 337 CG -0.0147 -0.0181 -0.0122 104 GLN 337 CD -0.0166 -0.0208 -0.0149 105 GLN 337 NE2 -0.0183 -0.0246 -0.0167 106 GLN 337 OE1 -0.0166 -0.0193 -0.0159 107 SER 338 N -0.0087 -0.0142 -0.0004 108 SER 338 CA -0.0080 -0.0175 0.0033 109 SER 338 C -0.0099 -0.0225 0.0018 110 SER 338 O -0.0115 -0.0241 -0.0010 111 SER 338 CB -0.0064 -0.0179 0.0073 112 SER 338 OG -0.0045 -0.0134 0.0090 113 LEU 339 N -0.0021 -0.0230 0.0067 114 LEU 339 CA 0.0007 -0.0237 0.0040 115 LEU 339 C 0.0003 -0.0256 0.0057 116 LEU 339 O -0.0025 -0.0250 0.0084 117 LEU 339 CB 0.0009 -0.0194 0.0009 118 LEU 339 CG 0.0012 -0.0173 -0.0010 119 LEU 339 CD1 0.0010 -0.0129 -0.0036 120 LEU 339 CD2 0.0046 -0.0197 -0.0031 121 SER 340 N 0.0031 -0.0277 0.0039 122 SER 340 CA 0.0033 -0.0295 0.0049 123 SER 340 C 0.0039 -0.0270 0.0026 124 SER 340 O 0.0039 -0.0282 0.0033 125 SER 340 CB 0.0060 -0.0340 0.0049 126 SER 340 OG 0.0056 -0.0364 0.0070 127 TYR 341 N 0.0106 -0.0192 0.0053 128 TYR 341 CA 0.0117 -0.0153 0.0042 129 TYR 341 C 0.0080 -0.0129 0.0049 130 TYR 341 O 0.0050 -0.0121 0.0058 131 TYR 341 CB 0.0137 -0.0126 0.0029 132 TYR 341 CG 0.0173 -0.0145 0.0021 133 TYR 341 CD1 0.0202 -0.0171 0.0016 134 TYR 341 CD2 0.0179 -0.0136 0.0017 135 TYR 341 CE1 0.0237 -0.0188 0.0008 136 TYR 341 CE2 0.0214 -0.0152 0.0009 137 TYR 341 CZ 0.0243 -0.0178 0.0004 138 TYR 341 OH 0.0277 -0.0192 -0.0004 139 LEU 342 N 0.0085 -0.0111 0.0044 140 LEU 342 CA 0.0062 -0.0074 0.0045 141 LEU 342 C 0.0091 -0.0040 0.0028 142 LEU 342 O 0.0120 -0.0046 0.0020 143 LEU 342 CB 0.0037 -0.0084 0.0055 144 LEU 342 CG 0.0013 -0.0047 0.0056 145 LEU 342 CD1 -0.0022 -0.0030 0.0064 146 LEU 342 CD2 -0.0004 -0.0059 0.0064 147 GLU 343 N 0.0148 -0.0010 0.0061 148 GLU 343 CA 0.0159 0.0006 0.0058 149 GLU 343 C 0.0148 0.0023 0.0061 150 GLU 343 O 0.0136 0.0025 0.0065 151 GLU 343 CB 0.0174 0.0007 0.0053 152 GLU 343 CG 0.0187 -0.0009 0.0049 153 GLU 343 CD 0.0202 -0.0008 0.0044 154 GLU 343 OE1 0.0198 -0.0009 0.0045 155 GLU 343 OE2 0.0217 -0.0011 0.0039 156 ALA 344 N 0.0151 0.0035 0.0061 157 ALA 344 CA 0.0142 0.0053 0.0064 158 ALA 344 C 0.0155 0.0069 0.0060 159 ALA 344 O 0.0168 0.0070 0.0055 160 ALA 344 CB 0.0133 0.0054 0.0066 161 TYR 345 N 0.0187 0.0002 0.0032 162 TYR 345 CA 0.0177 -0.0024 0.0043 163 TYR 345 C 0.0189 -0.0048 0.0049 164 TYR 345 O 0.0214 -0.0051 0.0044 165 TYR 345 CB 0.0187 -0.0027 0.0042 166 TYR 345 CG 0.0178 -0.0053 0.0053 167 TYR 345 CD1 0.0150 -0.0057 0.0061 168 TYR 345 CD2 0.0200 -0.0073 0.0055 169 TYR 345 CE1 0.0142 -0.0080 0.0071 170 TYR 345 CE2 0.0192 -0.0096 0.0065 171 TYR 345 CZ 0.0163 -0.0100 0.0073 172 TYR 345 OH 0.0155 -0.0123 0.0083 173 ASN 346 N 0.0171 -0.0067 0.0060 174 ASN 346 CA 0.0179 -0.0094 0.0068 175 ASN 346 C 0.0179 -0.0117 0.0075 176 ASN 346 O 0.0157 -0.0126 0.0084 177 ASN 346 CB 0.0158 -0.0099 0.0074 178 ASN 346 CG 0.0165 -0.0126 0.0082 179 ASN 346 ND2 0.0152 -0.0130 0.0086 180 ASN 346 OD1 0.0185 -0.0142 0.0083 181 PRO 347 N 0.0180 -0.0194 0.0074 182 PRO 347 CA 0.0187 -0.0228 0.0089 183 PRO 347 C 0.0169 -0.0263 0.0115 184 PRO 347 O 0.0168 -0.0291 0.0129 185 PRO 347 CB 0.0232 -0.0239 0.0076 186 PRO 347 CG 0.0247 -0.0201 0.0050 187 PRO 347 CD 0.0218 -0.0183 0.0052 188 SER 348 N 0.0158 -0.0264 0.0119 189 SER 348 CA 0.0142 -0.0297 0.0143 190 SER 348 C 0.0097 -0.0297 0.0161 191 SER 348 O 0.0085 -0.0328 0.0183 192 SER 348 CB 0.0152 -0.0300 0.0140 193 SER 348 OG 0.0132 -0.0268 0.0132 194 ASP 349 N 0.0155 -0.0326 0.0162 195 ASP 349 CA 0.0088 -0.0326 0.0169 196 ASP 349 C 0.0069 -0.0283 0.0148 197 ASP 349 O 0.0016 -0.0283 0.0154 198 ASP 349 CB 0.0048 -0.0319 0.0170 199 ASP 349 CG 0.0055 -0.0263 0.0139 200 ASP 349 OD1 0.0077 -0.0223 0.0115 201 ASP 349 OD2 0.0044 -0.0261 0.0139 202 GLY 350 N 0.0113 -0.0250 0.0125 203 GLY 350 CA 0.0103 -0.0209 0.0104 204 GLY 350 C 0.0068 -0.0154 0.0078 205 GLY 350 O 0.0049 -0.0121 0.0062 206 THR 351 N 0.0110 -0.0112 0.0107 207 THR 351 CA 0.0091 -0.0086 0.0097 208 THR 351 C 0.0112 -0.0057 0.0083 209 THR 351 O 0.0142 -0.0058 0.0081 210 THR 351 CB 0.0075 -0.0095 0.0102 211 THR 351 CG2 0.0050 -0.0121 0.0115 212 THR 351 OG1 0.0098 -0.0103 0.0104 213 TRP 352 N 0.0094 -0.0030 0.0073 214 TRP 352 CA 0.0106 0.0000 0.0058 215 TRP 352 C 0.0089 0.0011 0.0055 216 TRP 352 O 0.0059 0.0010 0.0057 217 TRP 352 CB 0.0100 0.0024 0.0049 218 TRP 352 CG 0.0123 0.0021 0.0048 219 TRP 352 CD1 0.0117 0.0004 0.0056 220 TRP 352 CD2 0.0156 0.0033 0.0040 221 TRP 352 CE2 0.0168 0.0024 0.0043 222 TRP 352 CE3 0.0177 0.0051 0.0031 223 TRP 352 NE1 0.0144 0.0006 0.0053 224 TRP 352 CZ2 0.0200 0.0033 0.0037 225 TRP 352 CZ3 0.0209 0.0060 0.0025 226 TRP 352 CH2 0.0220 0.0051 0.0028 227 LEU 353 N 0.0319 0.0213 0.0167 228 LEU 353 CA 0.0297 0.0217 0.0157 229 LEU 353 C 0.0282 0.0150 0.0127 230 LEU 353 O 0.0247 0.0125 0.0100 231 LEU 353 CB 0.0241 0.0269 0.0145 232 LEU 353 CG 0.0238 0.0315 0.0159 233 LEU 353 CD1 0.0173 0.0347 0.0136 234 LEU 353 CD2 0.0258 0.0282 0.0158 235 ARG 354 N 0.0304 0.0124 0.0130 236 ARG 354 CA 0.0281 0.0069 0.0100 237 ARG 354 C 0.0226 0.0091 0.0079 238 ARG 354 O 0.0228 0.0134 0.0093 239 ARG 354 CB 0.0331 0.0026 0.0111 240 ARG 354 CG 0.0308 -0.0033 0.0080 241 ARG 354 CD 0.0349 -0.0096 0.0080 242 ARG 354 NE 0.0327 -0.0149 0.0051 243 ARG 354 CZ 0.0356 -0.0190 0.0052 244 ARG 354 NH1 0.0413 -0.0190 0.0081 245 ARG 354 NH2 0.0329 -0.0233 0.0024 246 LEU 355 N 0.0131 0.0021 0.0129 247 LEU 355 CA 0.0084 0.0030 0.0111 248 LEU 355 C 0.0075 -0.0020 0.0096 249 LEU 355 O 0.0110 -0.0055 0.0102 250 LEU 355 CB 0.0042 0.0046 0.0098 251 LEU 355 CG 0.0048 0.0100 0.0113 252 LEU 355 CD1 0.0010 0.0108 0.0099 253 LEU 355 CD2 0.0040 0.0146 0.0120 254 ALA 356 N 0.0032 -0.0021 0.0078 255 ALA 356 CA 0.0018 -0.0066 0.0062 256 ALA 356 C 0.0020 -0.0117 0.0050 257 ALA 356 O -0.0007 -0.0120 0.0038 258 ALA 356 CB -0.0034 -0.0053 0.0043 259 ASP 357 N 0.0073 -0.0192 0.0058 260 ASP 357 CA 0.0070 -0.0224 0.0055 261 ASP 357 C 0.0008 -0.0250 0.0068 262 ASP 357 O -0.0023 -0.0271 0.0073 263 ASP 357 CB 0.0115 -0.0273 0.0036 264 ASP 357 CG 0.0177 -0.0249 0.0023 265 ASP 357 OD1 0.0188 -0.0195 0.0027 266 ASP 357 OD2 0.0218 -0.0286 0.0008 267 LEU 358 N -0.0008 -0.0253 0.0072 268 LEU 358 CA -0.0059 -0.0286 0.0081 269 LEU 358 C -0.0055 -0.0353 0.0071 270 LEU 358 O -0.0011 -0.0381 0.0056 271 LEU 358 CB -0.0060 -0.0282 0.0081 272 LEU 358 CG -0.0075 -0.0220 0.0093 273 LEU 358 CD1 -0.0051 -0.0215 0.0088 274 LEU 358 CD2 -0.0141 -0.0214 0.0112 275 GLN 359 N -0.0075 -0.0265 0.0077 276 GLN 359 CA -0.0075 -0.0311 0.0076 277 GLN 359 C -0.0068 -0.0371 0.0076 278 GLN 359 O -0.0048 -0.0410 0.0078 279 GLN 359 CB -0.0129 -0.0307 0.0066 280 GLN 359 CG -0.0136 -0.0249 0.0066 281 GLN 359 CD -0.0180 -0.0251 0.0057 282 GLN 359 NE2 -0.0173 -0.0220 0.0060 283 GLN 359 OE1 -0.0222 -0.0281 0.0049 284 VAL 360 N -0.0082 -0.0378 0.0073 285 VAL 360 CA -0.0072 -0.0429 0.0073 286 VAL 360 C -0.0049 -0.0410 0.0078 287 VAL 360 O -0.0072 -0.0369 0.0075 288 VAL 360 CB -0.0127 -0.0463 0.0063 289 VAL 360 CG1 -0.0118 -0.0518 0.0063 290 VAL 360 CG2 -0.0155 -0.0479 0.0057 291 PRO 361 N -0.0035 -0.0301 0.0052 292 PRO 361 CA -0.0019 -0.0272 0.0048 293 PRO 361 C -0.0036 -0.0255 0.0064 294 PRO 361 O -0.0051 -0.0271 0.0071 295 PRO 361 CB 0.0006 -0.0282 0.0028 296 PRO 361 CG 0.0009 -0.0315 0.0018 297 PRO 361 CD -0.0020 -0.0329 0.0036 298 ARG 362 N -0.0033 -0.0223 0.0069 299 ARG 362 CA -0.0048 -0.0204 0.0084 300 ARG 362 C -0.0030 -0.0176 0.0078 301 ARG 362 O -0.0016 -0.0156 0.0073 302 ARG 362 CB -0.0071 -0.0190 0.0104 303 ARG 362 CG -0.0088 -0.0212 0.0111 304 ARG 362 CD -0.0111 -0.0236 0.0121 305 ARG 362 NE -0.0135 -0.0221 0.0142 306 ARG 362 CZ -0.0154 -0.0215 0.0157 307 ARG 362 NH1 -0.0152 -0.0223 0.0154 308 ARG 362 NH2 -0.0175 -0.0202 0.0175 309 SER 363 N -0.0050 -0.0092 0.0093 310 SER 363 CA -0.0055 -0.0087 0.0091 311 SER 363 C -0.0058 -0.0084 0.0096 312 SER 363 O -0.0057 -0.0085 0.0101 313 SER 363 CB -0.0057 -0.0085 0.0088 314 SER 363 OG -0.0059 -0.0083 0.0093 315 GLY 364 N -0.0061 -0.0081 0.0093 316 GLY 364 CA -0.0063 -0.0078 0.0097 317 GLY 364 C -0.0061 -0.0081 0.0100 318 GLY 364 O -0.0062 -0.0080 0.0105 319 LEU 365 N -0.0062 -0.0092 0.0121 320 LEU 365 CA -0.0068 -0.0088 0.0121 321 LEU 365 C -0.0072 -0.0077 0.0118 322 LEU 365 O -0.0068 -0.0072 0.0115 323 LEU 365 CB -0.0061 -0.0089 0.0120 324 LEU 365 CG -0.0052 -0.0082 0.0116 325 LEU 365 CD1 -0.0048 -0.0082 0.0115 326 LEU 365 CD2 -0.0042 -0.0084 0.0115 327 ALA 366 N -0.0079 -0.0073 0.0118 328 ALA 366 CA -0.0081 -0.0062 0.0115 329 ALA 366 C -0.0077 -0.0059 0.0113 330 ALA 366 O -0.0076 -0.0065 0.0115 331 ALA 366 CB -0.0092 -0.0059 0.0116 332 GLY 367 N -0.0078 -0.0035 0.0029 333 GLY 367 CA -0.0072 -0.0015 0.0022 334 GLY 367 C -0.0090 -0.0003 0.0007 335 GLY 367 O -0.0101 -0.0006 0.0003 336 CYS 368 N -0.0091 0.0010 -0.0000 337 CYS 368 CA -0.0104 0.0025 -0.0015 338 CYS 368 C -0.0095 0.0044 -0.0020 339 CYS 368 O -0.0080 0.0044 -0.0012 340 CYS 368 CB -0.0127 0.0016 -0.0021 341 CYS 368 SG -0.0130 0.0008 -0.0019 342 VAL 369 N -0.0126 0.0031 -0.0085 343 VAL 369 CA -0.0126 0.0035 -0.0086 344 VAL 369 C -0.0119 0.0036 -0.0095 345 VAL 369 O -0.0114 0.0027 -0.0098 346 VAL 369 CB -0.0131 0.0029 -0.0079 347 VAL 369 CG1 -0.0130 0.0031 -0.0080 348 VAL 369 CG2 -0.0139 0.0031 -0.0070 349 VAL 370 N -0.0117 0.0045 -0.0098 350 VAL 370 CA -0.0111 0.0046 -0.0105 351 VAL 370 C -0.0113 0.0051 -0.0103 352 VAL 370 O -0.0118 0.0059 -0.0099 353 VAL 370 CB -0.0105 0.0052 -0.0113 354 VAL 370 CG1 -0.0098 0.0052 -0.0121 355 VAL 370 CG2 -0.0103 0.0048 -0.0115 356 GLY 371 N -0.0123 0.0021 -0.0166 357 GLY 371 CA -0.0108 0.0024 -0.0172 358 GLY 371 C -0.0112 0.0025 -0.0168 359 GLY 371 O -0.0100 0.0030 -0.0169 360 GLY 372 N -0.0128 0.0019 -0.0164 361 GLY 372 CA -0.0134 0.0020 -0.0158 362 GLY 372 C -0.0138 0.0030 -0.0140 363 GLY 372 O -0.0146 0.0030 -0.0134 364 LEU 373 N -0.0157 0.0055 -0.0102 365 LEU 373 CA -0.0150 0.0043 -0.0090 366 LEU 373 C -0.0152 0.0022 -0.0084 367 LEU 373 O -0.0163 0.0012 -0.0093 368 LEU 373 CB -0.0157 0.0041 -0.0097 369 LEU 373 CG -0.0156 0.0061 -0.0104 370 LEU 373 CD1 -0.0164 0.0058 -0.0112 371 LEU 373 CD2 -0.0140 0.0073 -0.0091 372 LEU 374 N -0.0140 0.0015 -0.0069 373 LEU 374 CA -0.0140 -0.0006 -0.0061 374 LEU 374 C -0.0145 -0.0020 -0.0060 375 LEU 374 O -0.0139 -0.0016 -0.0055 376 LEU 374 CB -0.0125 -0.0005 -0.0044 377 LEU 374 CG -0.0121 -0.0026 -0.0032 378 LEU 374 CD1 -0.0129 -0.0037 -0.0037 379 LEU 374 CD2 -0.0105 -0.0023 -0.0015 380 TYR 375 N -0.0123 0.0008 -0.0003 381 TYR 375 CA -0.0129 -0.0008 0.0013 382 TYR 375 C -0.0134 -0.0025 0.0030 383 TYR 375 O -0.0148 -0.0030 0.0025 384 TYR 375 CB -0.0149 -0.0013 0.0002 385 TYR 375 CG -0.0143 0.0002 -0.0012 386 TYR 375 CD1 -0.0145 0.0018 -0.0034 387 TYR 375 CD2 -0.0136 -0.0000 -0.0003 388 TYR 375 CE1 -0.0140 0.0031 -0.0046 389 TYR 375 CE2 -0.0131 0.0013 -0.0016 390 TYR 375 CZ -0.0133 0.0028 -0.0037 391 TYR 375 OH -0.0129 0.0041 -0.0050 392 ALA 376 N -0.0125 -0.0035 0.0051 393 ALA 376 CA -0.0131 -0.0054 0.0070 394 ALA 376 C -0.0145 -0.0069 0.0077 395 ALA 376 O -0.0137 -0.0070 0.0086 396 ALA 376 CB -0.0108 -0.0053 0.0088 397 VAL 377 N -0.0056 -0.0037 0.0098 398 VAL 377 CA -0.0071 -0.0053 0.0090 399 VAL 377 C -0.0065 -0.0075 0.0095 400 VAL 377 O -0.0057 -0.0079 0.0101 401 VAL 377 CB -0.0086 -0.0048 0.0080 402 VAL 377 CG1 -0.0103 -0.0059 0.0070 403 VAL 377 CG2 -0.0089 -0.0024 0.0076 404 GLY 378 N -0.0069 -0.0089 0.0094 405 GLY 378 CA -0.0065 -0.0112 0.0098 406 GLY 378 C -0.0046 -0.0117 0.0110 407 GLY 378 O -0.0034 -0.0109 0.0117 408 GLY 379 N -0.0021 -0.0137 0.0119 409 GLY 379 CA -0.0028 -0.0127 0.0097 410 GLY 379 C -0.0028 -0.0124 0.0097 411 GLY 379 O -0.0025 -0.0120 0.0117 412 ARG 380 N -0.0033 -0.0125 0.0076 413 ARG 380 CA -0.0034 -0.0125 0.0073 414 ARG 380 C -0.0036 -0.0138 0.0048 415 ARG 380 O -0.0040 -0.0138 0.0031 416 ARG 380 CB -0.0039 -0.0099 0.0075 417 ARG 380 CG -0.0047 -0.0082 0.0054 418 ARG 380 CD -0.0051 -0.0057 0.0062 419 ARG 380 NE -0.0060 -0.0039 0.0042 420 ARG 380 CZ -0.0064 -0.0017 0.0044 421 ARG 380 NH1 -0.0072 -0.0002 0.0026 422 ARG 380 NH2 -0.0062 -0.0007 0.0065 423 ASN 381 N -0.0035 -0.0199 0.0093 424 ASN 381 CA -0.0050 -0.0207 0.0062 425 ASN 381 C -0.0064 -0.0171 0.0053 426 ASN 381 O -0.0058 -0.0158 0.0070 427 ASN 381 CB -0.0039 -0.0237 0.0067 428 ASN 381 CG -0.0053 -0.0249 0.0034 429 ASN 381 ND2 -0.0047 -0.0270 0.0036 430 ASN 381 OD1 -0.0070 -0.0239 0.0007 431 ASN 382 N -0.0080 -0.0153 0.0030 432 ASN 382 CA -0.0096 -0.0119 0.0018 433 ASN 382 C -0.0112 -0.0128 -0.0018 434 ASN 382 O -0.0122 -0.0137 -0.0043 435 ASN 382 CB -0.0103 -0.0092 0.0017 436 ASN 382 CG -0.0118 -0.0054 0.0008 437 ASN 382 ND2 -0.0130 -0.0034 -0.0005 438 ASN 382 OD1 -0.0118 -0.0039 0.0016 439 SER 383 N -0.0150 -0.0139 -0.0007 440 SER 383 CA -0.0183 -0.0136 -0.0013 441 SER 383 C -0.0231 -0.0070 0.0033 442 SER 383 O -0.0226 -0.0027 0.0073 443 SER 383 CB -0.0112 -0.0155 -0.0011 444 SER 383 OG -0.0068 -0.0104 0.0045 445 PRO 384 N -0.0280 -0.0059 0.0030 446 PRO 384 CA -0.0321 0.0005 0.0076 447 PRO 384 C -0.0263 0.0052 0.0133 448 PRO 384 O -0.0284 0.0107 0.0176 449 PRO 384 CB -0.0374 -0.0004 0.0055 450 PRO 384 CG -0.0333 -0.0067 0.0010 451 PRO 384 CD -0.0304 -0.0105 -0.0016 452 ASP 385 N -0.0320 0.0063 0.0151 453 ASP 385 CA -0.0263 0.0133 0.0153 454 ASP 385 C -0.0196 0.0134 0.0130 455 ASP 385 O -0.0148 0.0192 0.0131 456 ASP 385 CB -0.0231 0.0140 0.0144 457 ASP 385 CG -0.0296 0.0150 0.0170 458 ASP 385 OD1 -0.0335 0.0208 0.0202 459 ASP 385 OD2 -0.0313 0.0095 0.0158 460 GLY 386 N -0.0194 0.0071 0.0109 461 GLY 386 CA -0.0136 0.0062 0.0085 462 GLY 386 C -0.0099 -0.0017 0.0048 463 GLY 386 O -0.0115 -0.0065 0.0038 464 ASN 387 N -0.0068 -0.0033 0.0098 465 ASN 387 CA -0.0053 -0.0051 0.0102 466 ASN 387 C -0.0019 -0.0062 0.0130 467 ASN 387 O -0.0010 -0.0038 0.0157 468 ASN 387 CB -0.0068 -0.0027 0.0103 469 ASN 387 CG -0.0053 -0.0046 0.0105 470 ASN 387 ND2 -0.0036 -0.0034 0.0132 471 ASN 387 OD1 -0.0057 -0.0072 0.0083 472 THR 388 N -0.0002 -0.0094 0.0126 473 THR 388 CA 0.0030 -0.0106 0.0152 474 THR 388 C 0.0037 -0.0123 0.0147 475 THR 388 O 0.0033 -0.0151 0.0123 476 THR 388 CB 0.0050 -0.0132 0.0155 477 THR 388 CG2 0.0083 -0.0141 0.0184 478 THR 388 OG1 0.0041 -0.0118 0.0156 479 ASP 389 N 0.0003 -0.0090 0.0081 480 ASP 389 CA 0.0010 -0.0095 0.0095 481 ASP 389 C 0.0004 -0.0104 0.0103 482 ASP 389 O 0.0001 -0.0103 0.0099 483 ASP 389 CB 0.0025 -0.0087 0.0097 484 ASP 389 CG 0.0030 -0.0078 0.0090 485 ASP 389 OD1 0.0025 -0.0080 0.0087 486 ASP 389 OD2 0.0041 -0.0070 0.0088 487 SER 390 N 0.0003 -0.0113 0.0114 488 SER 390 CA -0.0003 -0.0122 0.0121 489 SER 390 C 0.0006 -0.0124 0.0133 490 SER 390 O 0.0016 -0.0123 0.0140 491 SER 390 CB -0.0012 -0.0131 0.0126 492 SER 390 OG -0.0018 -0.0141 0.0134 493 SER 391 N -0.0042 -0.0037 0.0117 494 SER 391 CA -0.0035 -0.0042 0.0121 495 SER 391 C -0.0043 -0.0049 0.0128 496 SER 391 O -0.0038 -0.0054 0.0132 497 SER 391 CB -0.0029 -0.0034 0.0113 498 SER 391 OG -0.0040 -0.0028 0.0108 499 ALA 392 N -0.0056 -0.0050 0.0131 500 ALA 392 CA -0.0065 -0.0056 0.0137 501 ALA 392 C -0.0060 -0.0067 0.0147 502 ALA 392 O -0.0056 -0.0072 0.0151 503 ALA 392 CB -0.0079 -0.0055 0.0137 504 LEU 393 N -0.0122 0.0010 0.0089 505 LEU 393 CA -0.0122 -0.0010 0.0092 506 LEU 393 C -0.0134 -0.0036 0.0080 507 LEU 393 O -0.0133 -0.0047 0.0084 508 LEU 393 CB -0.0105 -0.0016 0.0119 509 LEU 393 CG -0.0104 -0.0038 0.0125 510 LEU 393 CD1 -0.0106 -0.0026 0.0119 511 LEU 393 CD2 -0.0087 -0.0046 0.0151 512 ASP 394 N -0.0145 -0.0046 0.0066 513 ASP 394 CA -0.0157 -0.0071 0.0054 514 ASP 394 C -0.0157 -0.0089 0.0056 515 ASP 394 O -0.0158 -0.0079 0.0054 516 ASP 394 CB -0.0173 -0.0064 0.0028 517 ASP 394 CG -0.0172 -0.0043 0.0025 518 ASP 394 OD1 -0.0180 -0.0052 0.0015 519 ASP 394 OD2 -0.0169 -0.0018 0.0025 520 CYS 395 N -0.0230 -0.0008 0.0010 521 CYS 395 CA -0.0227 -0.0003 -0.0009 522 CYS 395 C -0.0215 0.0004 -0.0005 523 CYS 395 O -0.0199 0.0013 0.0003 524 CYS 395 CB -0.0220 0.0004 -0.0024 525 CYS 395 SG -0.0214 0.0012 -0.0047 526 TYR 396 N -0.0221 0.0001 -0.0012 527 TYR 396 CA -0.0210 0.0009 -0.0013 528 TYR 396 C -0.0205 0.0016 -0.0036 529 TYR 396 O -0.0216 0.0011 -0.0051 530 TYR 396 CB -0.0220 0.0001 -0.0005 531 TYR 396 CG -0.0210 0.0007 -0.0006 532 TYR 396 CD1 -0.0197 0.0013 0.0010 533 TYR 396 CD2 -0.0215 0.0007 -0.0023 534 TYR 396 CE1 -0.0188 0.0019 0.0010 535 TYR 396 CE2 -0.0205 0.0013 -0.0023 536 TYR 396 CZ -0.0192 0.0019 -0.0007 537 TYR 396 OH -0.0184 0.0025 -0.0008 538 ASN 397 N -0.0199 0.0137 -0.0076 539 ASN 397 CA -0.0181 0.0102 -0.0105 540 ASN 397 C -0.0217 0.0081 -0.0113 541 ASN 397 O -0.0218 0.0095 -0.0102 542 ASN 397 CB -0.0131 0.0113 -0.0108 543 ASN 397 CG -0.0107 0.0078 -0.0138 544 ASN 397 ND2 -0.0061 0.0083 -0.0144 545 ASN 397 OD1 -0.0130 0.0044 -0.0158 546 PRO 398 N -0.0240 0.0044 -0.0134 547 PRO 398 CA -0.0274 0.0020 -0.0144 548 PRO 398 C -0.0252 0.0012 -0.0154 549 PRO 398 O -0.0277 0.0012 -0.0149 550 PRO 398 CB -0.0291 -0.0019 -0.0168 551 PRO 398 CG -0.0283 -0.0009 -0.0163 552 PRO 398 CD -0.0239 0.0022 -0.0149 553 MET 399 N -0.0223 -0.0300 -0.0334 554 MET 399 CA -0.0145 -0.0308 -0.0365 555 MET 399 C -0.0148 -0.0116 -0.0270 556 MET 399 O -0.0123 -0.0117 -0.0279 557 MET 399 CB 0.0077 -0.0358 -0.0466 558 MET 399 CG 0.0090 -0.0565 -0.0571 559 MET 399 SD -0.0021 -0.0766 -0.0631 560 MET 399 CE 0.0163 -0.0738 -0.0681 561 THR 400 N -0.0167 0.0049 -0.0183 562 THR 400 CA -0.0172 0.0242 -0.0087 563 THR 400 C -0.0378 0.0320 0.0022 564 THR 400 O -0.0420 0.0452 0.0100 565 THR 400 CB 0.0001 0.0398 -0.0071 566 THR 400 CG2 0.0219 0.0341 -0.0174 567 THR 400 OG1 -0.0033 0.0438 -0.0040 568 ASN 401 N -0.0234 0.0180 -0.0002 569 ASN 401 CA -0.0264 0.0150 0.0074 570 ASN 401 C -0.0255 0.0184 0.0093 571 ASN 401 O -0.0265 0.0204 0.0166 572 ASN 401 CB -0.0279 0.0158 0.0148 573 ASN 401 CG -0.0313 0.0117 0.0225 574 ASN 401 ND2 -0.0316 0.0155 0.0300 575 ASN 401 OD1 -0.0339 0.0048 0.0220 576 GLN 402 N -0.0237 0.0190 0.0027 577 GLN 402 CA -0.0229 0.0214 0.0033 578 GLN 402 C -0.0245 0.0148 -0.0008 579 GLN 402 O -0.0246 0.0108 -0.0074 580 GLN 402 CB -0.0188 0.0295 -0.0008 581 GLN 402 CG -0.0170 0.0364 0.0033 582 GLN 402 CD -0.0129 0.0446 -0.0003 583 GLN 402 NE2 -0.0109 0.0497 -0.0002 584 GLN 402 OE1 -0.0115 0.0468 -0.0026 585 TRP 403 N -0.0247 -0.0051 0.0024 586 TRP 403 CA -0.0257 -0.0073 0.0006 587 TRP 403 C -0.0293 -0.0083 -0.0012 588 TRP 403 O -0.0296 -0.0092 -0.0019 589 TRP 403 CB -0.0228 -0.0103 -0.0003 590 TRP 403 CG -0.0194 -0.0098 0.0012 591 TRP 403 CD1 -0.0164 -0.0092 0.0025 592 TRP 403 CD2 -0.0185 -0.0097 0.0015 593 TRP 403 CE2 -0.0150 -0.0091 0.0031 594 TRP 403 CE3 -0.0205 -0.0101 0.0006 595 TRP 403 NE1 -0.0138 -0.0088 0.0037 596 TRP 403 CZ2 -0.0134 -0.0088 0.0038 597 TRP 403 CZ3 -0.0190 -0.0098 0.0013 598 TRP 403 CH2 -0.0154 -0.0091 0.0029 599 SER 404 N -0.0316 -0.0086 -0.0022 600 SER 404 CA -0.0349 -0.0100 -0.0042 601 SER 404 C -0.0348 -0.0126 -0.0059 602 SER 404 O -0.0341 -0.0121 -0.0053 603 SER 404 CB -0.0382 -0.0074 -0.0036 604 SER 404 OG -0.0385 -0.0049 -0.0021 605 PRO 405 N -0.0313 -0.0083 -0.0048 606 PRO 405 CA -0.0259 -0.0008 -0.0024 607 PRO 405 C -0.0202 -0.0030 0.0057 608 PRO 405 O -0.0205 -0.0093 0.0088 609 PRO 405 CB -0.0273 0.0027 -0.0061 610 PRO 405 CG -0.0342 -0.0014 -0.0122 611 PRO 405 CD -0.0357 -0.0098 -0.0093 612 CYS 406 N -0.0150 0.0026 0.0089 613 CYS 406 CA -0.0089 0.0026 0.0163 614 CYS 406 C -0.0052 0.0101 0.0166 615 CYS 406 O -0.0073 0.0156 0.0111 616 CYS 406 CB -0.0057 0.0031 0.0200 617 CYS 406 SG -0.0097 -0.0055 0.0199 618 ALA 407 N 0.0043 0.0101 0.0150 619 ALA 407 CA 0.0046 0.0097 0.0142 620 ALA 407 C 0.0035 0.0073 0.0154 621 ALA 407 O 0.0031 0.0052 0.0153 622 ALA 407 CB 0.0057 0.0094 0.0114 623 PRO 408 N 0.0032 0.0077 0.0164 624 PRO 408 CA 0.0023 0.0055 0.0173 625 PRO 408 C 0.0027 0.0035 0.0152 626 PRO 408 O 0.0037 0.0043 0.0132 627 PRO 408 CB 0.0019 0.0068 0.0189 628 PRO 408 CG 0.0031 0.0093 0.0175 629 PRO 408 CD 0.0037 0.0101 0.0166 630 MET 409 N 0.0035 -0.0041 0.0117 631 MET 409 CA 0.0034 -0.0049 0.0110 632 MET 409 C 0.0034 -0.0053 0.0106 633 MET 409 O 0.0035 -0.0053 0.0110 634 MET 409 CB 0.0037 -0.0057 0.0116 635 MET 409 CG 0.0037 -0.0055 0.0120 636 MET 409 SD 0.0040 -0.0064 0.0127 637 MET 409 CE 0.0042 -0.0065 0.0137 638 SER 410 N 0.0032 -0.0058 0.0098 639 SER 410 CA 0.0032 -0.0063 0.0092 640 SER 410 C 0.0034 -0.0071 0.0098 641 SER 410 O 0.0033 -0.0072 0.0096 642 SER 410 CB 0.0030 -0.0069 0.0084 643 SER 410 OG 0.0032 -0.0077 0.0087 644 VAL 411 N 0.0097 -0.0087 0.0088 645 VAL 411 CA 0.0099 -0.0086 0.0085 646 VAL 411 C 0.0095 -0.0088 0.0090 647 VAL 411 O 0.0094 -0.0091 0.0098 648 VAL 411 CB 0.0110 -0.0087 0.0084 649 VAL 411 CG1 0.0114 -0.0085 0.0077 650 VAL 411 CG2 0.0115 -0.0092 0.0092 651 PRO 412 N 0.0094 -0.0086 0.0087 652 PRO 412 CA 0.0092 -0.0088 0.0092 653 PRO 412 C 0.0100 -0.0092 0.0097 654 PRO 412 O 0.0108 -0.0092 0.0094 655 PRO 412 CB 0.0089 -0.0085 0.0086 656 PRO 412 CG 0.0086 -0.0081 0.0078 657 PRO 412 CD 0.0093 -0.0082 0.0078 658 ARG 413 N 0.0066 -0.0079 0.0077 659 ARG 413 CA 0.0063 -0.0080 0.0074 660 ARG 413 C 0.0053 -0.0083 0.0067 661 ARG 413 O 0.0052 -0.0091 0.0063 662 ARG 413 CB 0.0069 -0.0088 0.0076 663 ARG 413 CG 0.0079 -0.0086 0.0083 664 ARG 413 CD 0.0085 -0.0094 0.0084 665 ARG 413 NE 0.0094 -0.0092 0.0091 666 ARG 413 CZ 0.0097 -0.0087 0.0095 667 ARG 413 NH1 0.0092 -0.0082 0.0093 668 ARG 413 NH2 0.0106 -0.0086 0.0101 669 ASN 414 N 0.0046 -0.0075 0.0066 670 ASN 414 CA 0.0037 -0.0075 0.0059 671 ASN 414 C 0.0035 -0.0076 0.0058 672 ASN 414 O 0.0038 -0.0071 0.0062 673 ASN 414 CB 0.0031 -0.0066 0.0059 674 ASN 414 CG 0.0021 -0.0065 0.0053 675 ASN 414 ND2 0.0017 -0.0057 0.0054 676 ASN 414 OD1 0.0017 -0.0072 0.0048 677 ARG 415 N 0.0020 -0.0070 -0.0029 678 ARG 415 CA 0.0013 -0.0054 -0.0034 679 ARG 415 C 0.0017 -0.0055 -0.0012 680 ARG 415 O 0.0011 -0.0035 -0.0003 681 ARG 415 CB 0.0000 -0.0026 -0.0040 682 ARG 415 CG -0.0005 -0.0024 -0.0064 683 ARG 415 CD -0.0018 0.0004 -0.0070 684 ARG 415 NE -0.0025 0.0016 -0.0082 685 ARG 415 CZ -0.0035 0.0041 -0.0081 686 ARG 415 NH1 -0.0040 0.0059 -0.0070 687 ARG 415 NH2 -0.0040 0.0048 -0.0092 688 ILE 416 N 0.0028 -0.0078 -0.0003 689 ILE 416 CA 0.0035 -0.0086 0.0014 690 ILE 416 C 0.0031 -0.0082 0.0001 691 ILE 416 O 0.0026 -0.0082 -0.0025 692 ILE 416 CB 0.0048 -0.0115 0.0019 693 ILE 416 CG1 0.0056 -0.0125 0.0042 694 ILE 416 CG2 0.0050 -0.0133 -0.0008 695 ILE 416 CD1 0.0069 -0.0153 0.0048 696 GLY 417 N 0.0053 -0.0075 0.0021 697 GLY 417 CA 0.0050 -0.0048 0.0035 698 GLY 417 C 0.0020 -0.0029 0.0029 699 GLY 417 O 0.0000 -0.0040 0.0012 700 VAL 418 N 0.0017 -0.0002 0.0043 701 VAL 418 CA -0.0011 0.0018 0.0039 702 VAL 418 C -0.0016 0.0042 0.0051 703 VAL 418 O 0.0004 0.0050 0.0066 704 VAL 418 CB -0.0018 0.0029 0.0042 705 VAL 418 CG1 -0.0015 0.0007 0.0031 706 VAL 418 CG2 0.0000 0.0050 0.0064 707 GLY 419 N 0.0003 0.0118 0.0036 708 GLY 419 CA -0.0007 0.0148 0.0038 709 GLY 419 C -0.0029 0.0159 0.0035 710 GLY 419 O -0.0042 0.0142 0.0030 711 VAL 420 N -0.0032 0.0189 0.0038 712 VAL 420 CA -0.0052 0.0203 0.0036 713 VAL 420 C -0.0077 0.0221 0.0033 714 VAL 420 O -0.0071 0.0241 0.0037 715 VAL 420 CB -0.0035 0.0223 0.0042 716 VAL 420 CG1 -0.0056 0.0238 0.0039 717 VAL 420 CG2 -0.0012 0.0205 0.0044 718 ILE 421 N -0.0017 0.0282 0.0042 719 ILE 421 CA -0.0042 0.0296 0.0026 720 ILE 421 C -0.0076 0.0328 0.0010 721 ILE 421 O -0.0089 0.0319 -0.0008 722 ILE 421 CB -0.0048 0.0260 -0.0003 723 ILE 421 CG1 -0.0013 0.0225 0.0010 724 ILE 421 CG2 -0.0070 0.0277 -0.0015 725 ILE 421 CD1 -0.0016 0.0186 -0.0017 726 ASP 422 N -0.0091 0.0365 0.0019 727 ASP 422 CA -0.0125 0.0397 0.0004 728 ASP 422 C -0.0130 0.0413 0.0009 729 ASP 422 O -0.0159 0.0431 -0.0009 730 ASP 422 CB -0.0154 0.0383 -0.0034 731 ASP 422 CG -0.0151 0.0374 -0.0037 732 ASP 422 OD1 -0.0130 0.0382 -0.0010 733 ASP 422 OD2 -0.0169 0.0355 -0.0067 734 GLY 423 N -0.0051 0.0278 -0.0059 735 GLY 423 CA -0.0026 0.0270 -0.0048 736 GLY 423 C -0.0025 0.0243 -0.0031 737 GLY 423 O -0.0002 0.0235 -0.0021 738 HIS 424 N -0.0047 0.0228 -0.0028 739 HIS 424 CA -0.0049 0.0201 -0.0012 740 HIS 424 C -0.0041 0.0190 -0.0003 741 HIS 424 O -0.0051 0.0196 -0.0009 742 HIS 424 CB -0.0078 0.0190 -0.0013 743 HIS 424 CG -0.0086 0.0202 -0.0021 744 HIS 424 CD2 -0.0112 0.0201 -0.0027 745 HIS 424 ND1 -0.0067 0.0212 -0.0023 746 HIS 424 CE1 -0.0083 0.0219 -0.0031 747 HIS 424 NE2 -0.0110 0.0212 -0.0033 748 ILE 425 N -0.0056 0.0122 0.0035 749 ILE 425 CA -0.0043 0.0119 0.0032 750 ILE 425 C -0.0042 0.0111 0.0026 751 ILE 425 O -0.0047 0.0103 0.0020 752 ILE 425 CB -0.0038 0.0114 0.0028 753 ILE 425 CG1 -0.0040 0.0121 0.0033 754 ILE 425 CG2 -0.0024 0.0111 0.0025 755 ILE 425 CD1 -0.0038 0.0115 0.0029 756 TYR 426 N -0.0035 0.0114 0.0028 757 TYR 426 CA -0.0031 0.0107 0.0022 758 TYR 426 C -0.0019 0.0101 0.0017 759 TYR 426 O -0.0009 0.0105 0.0020 760 TYR 426 CB -0.0028 0.0112 0.0026 761 TYR 426 CG -0.0041 0.0116 0.0030 762 TYR 426 CD1 -0.0047 0.0125 0.0036 763 TYR 426 CD2 -0.0047 0.0110 0.0025 764 TYR 426 CE1 -0.0059 0.0127 0.0039 765 TYR 426 CE2 -0.0059 0.0113 0.0028 766 TYR 426 CZ -0.0064 0.0122 0.0035 767 TYR 426 OH -0.0076 0.0125 0.0038 768 ALA 427 N 0.0008 0.0011 0.0054 769 ALA 427 CA 0.0026 -0.0005 0.0052 770 ALA 427 C 0.0023 -0.0017 0.0049 771 ALA 427 O 0.0007 -0.0028 0.0044 772 ALA 427 CB 0.0025 -0.0021 0.0048 773 VAL 428 N 0.0040 -0.0016 0.0052 774 VAL 428 CA 0.0040 -0.0024 0.0050 775 VAL 428 C 0.0057 -0.0042 0.0048 776 VAL 428 O 0.0077 -0.0039 0.0051 777 VAL 428 CB 0.0044 -0.0005 0.0055 778 VAL 428 CG1 0.0043 -0.0011 0.0053 779 VAL 428 CG2 0.0027 0.0014 0.0057 780 GLY 429 N 0.0100 -0.0057 0.0026 781 GLY 429 CA 0.0097 -0.0053 0.0025 782 GLY 429 C 0.0103 -0.0059 0.0020 783 GLY 429 O 0.0107 -0.0067 0.0023 784 GLY 430 N 0.0102 -0.0055 0.0013 785 GLY 430 CA 0.0106 -0.0059 0.0008 786 GLY 430 C 0.0105 -0.0060 0.0015 787 GLY 430 O 0.0100 -0.0057 0.0024 788 SER 431 N 0.0103 -0.0057 0.0053 789 SER 431 CA 0.0103 -0.0042 0.0060 790 SER 431 C 0.0107 -0.0053 0.0062 791 SER 431 O 0.0106 -0.0071 0.0051 792 SER 431 CB 0.0089 -0.0023 0.0047 793 SER 431 OG 0.0078 -0.0031 0.0027 794 HIS 432 N 0.0111 -0.0041 0.0074 795 HIS 432 CA 0.0113 -0.0045 0.0075 796 HIS 432 C 0.0106 -0.0023 0.0074 797 HIS 432 O 0.0109 -0.0007 0.0087 798 HIS 432 CB 0.0128 -0.0054 0.0094 799 HIS 432 CG 0.0131 -0.0057 0.0097 800 HIS 432 CD2 0.0123 -0.0062 0.0083 801 HIS 432 ND1 0.0142 -0.0057 0.0115 802 HIS 432 CE1 0.0141 -0.0061 0.0112 803 HIS 432 NE2 0.0130 -0.0064 0.0093 804 GLY 433 N 0.0128 -0.0011 0.0076 805 GLY 433 CA 0.0088 0.0036 0.0086 806 GLY 433 C 0.0069 0.0037 0.0082 807 GLY 433 O 0.0043 0.0002 0.0058 808 CYS 434 N 0.0081 0.0079 0.0104 809 CYS 434 CA 0.0071 0.0086 0.0104 810 CYS 434 C 0.0120 0.0060 0.0106 811 CYS 434 O 0.0112 0.0056 0.0102 812 CYS 434 CB 0.0057 0.0145 0.0128 813 CYS 434 SG 0.0117 0.0181 0.0162 814 ILE 435 N 0.0139 0.0018 0.0092 815 ILE 435 CA 0.0156 0.0008 0.0094 816 ILE 435 C 0.0150 -0.0012 0.0056 817 ILE 435 O 0.0160 -0.0033 0.0034 818 ILE 435 CB 0.0197 -0.0004 0.0114 819 ILE 435 CG1 0.0204 0.0017 0.0152 820 ILE 435 CG2 0.0215 -0.0014 0.0114 821 ILE 435 CD1 0.0189 0.0043 0.0176 822 HIS 436 N 0.0133 -0.0006 0.0050 823 HIS 436 CA 0.0128 -0.0024 0.0017 824 HIS 436 C 0.0156 -0.0037 0.0024 825 HIS 436 O 0.0157 -0.0022 0.0047 826 HIS 436 CB 0.0089 -0.0008 0.0005 827 HIS 436 CG 0.0061 0.0003 -0.0005 828 HIS 436 CD2 0.0037 -0.0004 -0.0038 829 HIS 436 ND1 0.0055 0.0020 0.0016 830 HIS 436 CE1 0.0029 0.0023 -0.0004 831 HIS 436 NE2 0.0017 0.0009 -0.0037 832 HIS 437 N 0.0140 -0.0041 0.0049 833 HIS 437 CA 0.0146 -0.0044 0.0054 834 HIS 437 C 0.0139 -0.0040 0.0049 835 HIS 437 O 0.0135 -0.0039 0.0037 836 HIS 437 CB 0.0158 -0.0054 0.0049 837 HIS 437 CG 0.0165 -0.0059 0.0054 838 HIS 437 CD2 0.0171 -0.0065 0.0046 839 HIS 437 ND1 0.0167 -0.0059 0.0067 840 HIS 437 CE1 0.0174 -0.0064 0.0067 841 HIS 437 NE2 0.0177 -0.0068 0.0054 842 ASN 438 N 0.0140 -0.0039 0.0058 843 ASN 438 CA 0.0138 -0.0038 0.0054 844 ASN 438 C 0.0149 -0.0047 0.0054 845 ASN 438 O 0.0150 -0.0048 0.0050 846 ASN 438 CB 0.0130 -0.0031 0.0064 847 ASN 438 CG 0.0134 -0.0032 0.0079 848 ASN 438 ND2 0.0129 -0.0026 0.0087 849 ASN 438 OD1 0.0141 -0.0036 0.0084 850 SER 439 N 0.0106 -0.0043 0.0051 851 SER 439 CA 0.0089 -0.0033 0.0050 852 SER 439 C 0.0096 -0.0009 0.0058 853 SER 439 O 0.0118 -0.0004 0.0062 854 SER 439 CB 0.0085 -0.0050 0.0046 855 SER 439 OG 0.0106 -0.0054 0.0048 856 VAL 440 N 0.0078 0.0005 0.0058 857 VAL 440 CA 0.0080 0.0029 0.0064 858 VAL 440 C 0.0063 0.0032 0.0062 859 VAL 440 O 0.0043 0.0024 0.0056 860 VAL 440 CB 0.0075 0.0047 0.0067 861 VAL 440 CG1 0.0077 0.0073 0.0074 862 VAL 440 CG2 0.0090 0.0043 0.0069 863 GLU 441 N -0.0025 0.0009 0.0079 864 GLU 441 CA -0.0034 0.0016 0.0077 865 GLU 441 C -0.0026 0.0048 0.0077 866 GLU 441 O -0.0007 0.0061 0.0080 867 GLU 441 CB -0.0023 -0.0007 0.0080 868 GLU 441 CG 0.0010 -0.0014 0.0086 869 GLU 441 CD 0.0017 -0.0043 0.0089 870 GLU 441 OE1 0.0004 -0.0052 0.0087 871 GLU 441 OE2 0.0031 -0.0062 0.0092 872 ARG 442 N -0.0043 0.0060 0.0074 873 ARG 442 CA -0.0041 0.0091 0.0072 874 ARG 442 C -0.0035 0.0092 0.0073 875 ARG 442 O -0.0052 0.0078 0.0071 876 ARG 442 CB -0.0070 0.0106 0.0067 877 ARG 442 CG -0.0070 0.0139 0.0065 878 ARG 442 CD -0.0101 0.0152 0.0059 879 ARG 442 NE -0.0121 0.0142 0.0056 880 ARG 442 CZ -0.0145 0.0125 0.0053 881 ARG 442 NH1 -0.0155 0.0117 0.0052 882 ARG 442 NH2 -0.0159 0.0117 0.0051 883 TYR 443 N -0.0066 0.0067 0.0070 884 TYR 443 CA -0.0036 0.0075 0.0071 885 TYR 443 C -0.0031 0.0095 0.0044 886 TYR 443 O -0.0037 0.0107 0.0025 887 TYR 443 CB -0.0012 0.0075 0.0080 888 TYR 443 CG 0.0021 0.0083 0.0083 889 TYR 443 CD1 0.0034 0.0072 0.0103 890 TYR 443 CD2 0.0039 0.0101 0.0065 891 TYR 443 CE1 0.0065 0.0079 0.0107 892 TYR 443 CE2 0.0071 0.0108 0.0068 893 TYR 443 CZ 0.0083 0.0097 0.0090 894 TYR 443 OH 0.0114 0.0103 0.0093 895 GLU 444 N -0.0017 0.0099 0.0044 896 GLU 444 CA -0.0009 0.0118 0.0021 897 GLU 444 C 0.0026 0.0127 0.0023 898 GLU 444 O 0.0040 0.0121 0.0037 899 GLU 444 CB -0.0024 0.0116 0.0017 900 GLU 444 CG -0.0059 0.0111 0.0010 901 GLU 444 CD -0.0077 0.0107 0.0008 902 GLU 444 OE1 -0.0068 0.0118 -0.0004 903 GLU 444 OE2 -0.0105 0.0098 0.0010 904 PRO 445 N 0.0102 0.0144 -0.0013 905 PRO 445 CA 0.0145 0.0172 0.0007 906 PRO 445 C 0.0197 0.0206 -0.0013 907 PRO 445 O 0.0235 0.0231 0.0019 908 PRO 445 CB 0.0135 0.0166 -0.0018 909 PRO 445 CG 0.0077 0.0128 -0.0023 910 PRO 445 CD 0.0063 0.0119 -0.0041 911 GLU 446 N 0.0201 0.0208 -0.0065 912 GLU 446 CA 0.0249 0.0239 -0.0091 913 GLU 446 C 0.0268 0.0252 -0.0057 914 GLU 446 O 0.0311 0.0279 -0.0068 915 GLU 446 CB 0.0242 0.0234 -0.0158 916 GLU 446 CG 0.0227 0.0223 -0.0199 917 GLU 446 CD 0.0170 0.0186 -0.0197 918 GLU 446 OE1 0.0140 0.0167 -0.0165 919 GLU 446 OE2 0.0158 0.0178 -0.0223 920 ARG 447 N 0.0212 0.0176 -0.0074 921 ARG 447 CA 0.0217 0.0158 -0.0008 922 ARG 447 C 0.0229 0.0142 0.0059 923 ARG 447 O 0.0261 0.0132 0.0110 924 ARG 447 CB 0.0149 0.0148 -0.0002 925 ARG 447 CG 0.0140 0.0163 -0.0059 926 ARG 447 CD 0.0199 0.0169 -0.0055 927 ARG 447 NE 0.0269 0.0185 -0.0082 928 ARG 447 CZ 0.0335 0.0189 -0.0067 929 ARG 447 NH1 0.0348 0.0180 -0.0030 930 ARG 447 NH2 0.0390 0.0201 -0.0088 931 ASP 448 N 0.0213 0.0141 0.0054 932 ASP 448 CA 0.0210 0.0124 0.0114 933 ASP 448 C 0.0156 0.0103 0.0170 934 ASP 448 O 0.0172 0.0087 0.0234 935 ASP 448 CB 0.0287 0.0126 0.0143 936 ASP 448 CG 0.0285 0.0112 0.0194 937 ASP 448 OD1 0.0237 0.0110 0.0181 938 ASP 448 OD2 0.0341 0.0109 0.0232 939 GLU 449 N 0.0075 0.0054 0.0100 940 GLU 449 CA 0.0054 0.0044 0.0114 941 GLU 449 C 0.0030 0.0041 0.0111 942 GLU 449 O 0.0020 0.0049 0.0091 943 GLU 449 CB 0.0045 0.0046 0.0108 944 GLU 449 CG 0.0064 0.0043 0.0119 945 GLU 449 CD 0.0054 0.0045 0.0113 946 GLU 449 OE1 0.0070 0.0045 0.0117 947 GLU 449 OE2 0.0031 0.0045 0.0104 948 TRP 450 N 0.0019 0.0030 0.0132 949 TRP 450 CA -0.0008 0.0025 0.0133 950 TRP 450 C -0.0028 0.0020 0.0138 951 TRP 450 O -0.0026 0.0011 0.0156 952 TRP 450 CB -0.0008 0.0016 0.0152 953 TRP 450 CG 0.0006 0.0021 0.0147 954 TRP 450 CD1 0.0031 0.0021 0.0154 955 TRP 450 CD2 -0.0004 0.0026 0.0133 956 TRP 450 CE2 0.0016 0.0029 0.0133 957 TRP 450 CE3 -0.0028 0.0028 0.0120 958 TRP 450 NE1 0.0037 0.0026 0.0146 959 TRP 450 CZ2 0.0012 0.0034 0.0122 960 TRP 450 CZ3 -0.0032 0.0034 0.0107 961 TRP 450 CH2 -0.0012 0.0036 0.0108 962 HIS 451 N -0.0077 0.0016 0.0080 963 HIS 451 CA -0.0092 0.0010 0.0078 964 HIS 451 C -0.0064 0.0013 0.0076 965 HIS 451 O -0.0046 0.0035 0.0089 966 HIS 451 CB -0.0120 0.0030 0.0096 967 HIS 451 CG -0.0150 0.0024 0.0097 968 HIS 451 CD2 -0.0153 0.0035 0.0104 969 HIS 451 ND1 -0.0178 0.0005 0.0088 970 HIS 451 CE1 -0.0197 0.0005 0.0091 971 HIS 451 NE2 -0.0183 0.0023 0.0100 972 LEU 452 N -0.0062 -0.0008 0.0062 973 LEU 452 CA -0.0041 -0.0005 0.0060 974 LEU 452 C -0.0053 0.0018 0.0078 975 LEU 452 O -0.0083 0.0018 0.0082 976 LEU 452 CB -0.0040 -0.0033 0.0041 977 LEU 452 CG -0.0016 -0.0055 0.0023 978 LEU 452 CD1 0.0022 -0.0045 0.0024 979 LEU 452 CD2 -0.0021 -0.0063 0.0018 980 VAL 453 N 0.0012 0.0085 0.0033 981 VAL 453 CA 0.0019 0.0090 0.0045 982 VAL 453 C 0.0046 0.0078 0.0033 983 VAL 453 O 0.0055 0.0066 0.0014 984 VAL 453 CB 0.0024 0.0105 0.0075 985 VAL 453 CG1 -0.0003 0.0117 0.0087 986 VAL 453 CG2 0.0050 0.0105 0.0085 987 ALA 454 N 0.0057 0.0081 0.0043 988 ALA 454 CA 0.0083 0.0071 0.0034 989 ALA 454 C 0.0108 0.0066 0.0035 990 ALA 454 O 0.0115 0.0076 0.0055 991 ALA 454 CB 0.0091 0.0077 0.0049 992 PRO 455 N 0.0129 0.0002 0.0063 993 PRO 455 CA 0.0123 0.0006 0.0057 994 PRO 455 C 0.0121 0.0008 0.0055 995 PRO 455 O 0.0123 0.0010 0.0059 996 PRO 455 CB 0.0122 0.0014 0.0060 997 PRO 455 CG 0.0128 0.0016 0.0067 998 PRO 455 CD 0.0132 0.0008 0.0069 999 MET 456 N 0.0115 0.0008 0.0049 1000 MET 456 CA 0.0111 0.0012 0.0047 1001 MET 456 C 0.0112 0.0021 0.0050 1002 MET 456 O 0.0112 0.0026 0.0052 1003 MET 456 CB 0.0105 0.0012 0.0039 1004 MET 456 CG 0.0104 0.0003 0.0035 1005 MET 456 SD 0.0097 0.0003 0.0027 1006 MET 456 CE 0.0095 0.0007 0.0027 1007 LEU 457 N 0.0120 -0.0015 0.0061 1008 LEU 457 CA 0.0104 0.0011 0.0074 1009 LEU 457 C 0.0089 0.0025 0.0064 1010 LEU 457 O 0.0081 0.0044 0.0081 1011 LEU 457 CB 0.0094 0.0020 0.0066 1012 LEU 457 CG 0.0108 0.0006 0.0073 1013 LEU 457 CD1 0.0096 0.0016 0.0063 1014 LEU 457 CD2 0.0121 0.0007 0.0105 1015 THR 458 N 0.0085 0.0016 0.0038 1016 THR 458 CA 0.0071 0.0027 0.0025 1017 THR 458 C 0.0082 0.0011 0.0022 1018 THR 458 O 0.0096 -0.0011 0.0012 1019 THR 458 CB 0.0055 0.0032 -0.0004 1020 THR 458 CG2 0.0035 0.0053 -0.0012 1021 THR 458 OG1 0.0049 0.0039 -0.0004 1022 ARG 459 N 0.0052 -0.0005 -0.0000 1023 ARG 459 CA 0.0061 -0.0014 -0.0005 1024 ARG 459 C 0.0053 -0.0018 -0.0033 1025 ARG 459 O 0.0035 -0.0006 -0.0042 1026 ARG 459 CB 0.0055 -0.0003 0.0012 1027 ARG 459 CG 0.0065 -0.0001 0.0040 1028 ARG 459 CD 0.0057 0.0011 0.0058 1029 ARG 459 NE 0.0067 0.0013 0.0084 1030 ARG 459 CZ 0.0086 0.0002 0.0096 1031 ARG 459 NH1 0.0099 -0.0012 0.0086 1032 ARG 459 NH2 0.0093 0.0005 0.0120 1033 ARG 460 N 0.0067 -0.0033 -0.0047 1034 ARG 460 CA 0.0060 -0.0037 -0.0074 1035 ARG 460 C 0.0072 -0.0049 -0.0082 1036 ARG 460 O 0.0091 -0.0064 -0.0082 1037 ARG 460 CB 0.0063 -0.0045 -0.0090 1038 ARG 460 CG 0.0051 -0.0034 -0.0085 1039 ARG 460 CD 0.0055 -0.0043 -0.0103 1040 ARG 460 NE 0.0045 -0.0034 -0.0097 1041 ARG 460 CZ 0.0026 -0.0023 -0.0108 1042 ARG 460 NH1 0.0013 -0.0019 -0.0125 1043 ARG 460 NH2 0.0020 -0.0015 -0.0101 1044 ILE 461 N 0.0020 -0.0023 -0.0080 1045 ILE 461 CA 0.0028 -0.0029 -0.0087 1046 ILE 461 C 0.0020 -0.0028 -0.0105 1047 ILE 461 O 0.0006 -0.0021 -0.0108 1048 ILE 461 CB 0.0030 -0.0028 -0.0074 1049 ILE 461 CG1 0.0016 -0.0021 -0.0075 1050 ILE 461 CG2 0.0034 -0.0026 -0.0056 1051 ILE 461 CD1 0.0021 -0.0021 -0.0066 1052 GLY 462 N 0.0030 -0.0035 -0.0116 1053 GLY 462 CA 0.0024 -0.0035 -0.0134 1054 GLY 462 C 0.0021 -0.0035 -0.0143 1055 GLY 462 O 0.0009 -0.0030 -0.0152 1056 VAL 463 N 0.0004 -0.0022 -0.0100 1057 VAL 463 CA -0.0003 -0.0012 -0.0086 1058 VAL 463 C -0.0003 -0.0009 -0.0085 1059 VAL 463 O -0.0004 -0.0021 -0.0089 1060 VAL 463 CB -0.0015 -0.0020 -0.0073 1061 VAL 463 CG1 -0.0021 -0.0038 -0.0072 1062 VAL 463 CG2 -0.0021 -0.0008 -0.0058 1063 GLY 464 N -0.0000 0.0007 -0.0081 1064 GLY 464 CA -0.0002 0.0011 -0.0078 1065 GLY 464 C -0.0014 0.0009 -0.0061 1066 GLY 464 O -0.0019 0.0014 -0.0052 1067 VAL 465 N -0.0024 0.0051 -0.0013 1068 VAL 465 CA -0.0030 0.0049 -0.0004 1069 VAL 465 C -0.0032 0.0049 0.0003 1070 VAL 465 O -0.0034 0.0047 0.0001 1071 VAL 465 CB -0.0037 0.0042 -0.0007 1072 VAL 465 CG1 -0.0043 0.0040 0.0001 1073 VAL 465 CG2 -0.0034 0.0043 -0.0014 1074 ALA 466 N -0.0032 0.0052 0.0012 1075 ALA 466 CA -0.0036 0.0051 0.0021 1076 ALA 466 C -0.0039 0.0051 0.0029 1077 ALA 466 O -0.0038 0.0052 0.0029 1078 ALA 466 CB -0.0029 0.0057 0.0023 1079 VAL 467 N -0.0073 0.0100 0.0082 1080 VAL 467 CA -0.0057 0.0098 0.0064 1081 VAL 467 C -0.0055 0.0073 0.0064 1082 VAL 467 O -0.0066 0.0066 0.0077 1083 VAL 467 CB -0.0054 0.0120 0.0060 1084 VAL 467 CG1 -0.0038 0.0117 0.0042 1085 VAL 467 CG2 -0.0054 0.0144 0.0058 1086 LEU 468 N -0.0041 0.0060 0.0049 1087 LEU 468 CA -0.0036 0.0036 0.0046 1088 LEU 468 C -0.0018 0.0034 0.0025 1089 LEU 468 O -0.0007 0.0041 0.0013 1090 LEU 468 CB -0.0042 0.0015 0.0054 1091 LEU 468 CG -0.0037 -0.0011 0.0050 1092 LEU 468 CD1 -0.0044 -0.0017 0.0058 1093 LEU 468 CD2 -0.0043 -0.0030 0.0058 1094 ASN 469 N -0.0034 0.0056 0.0054 1095 ASN 469 CA -0.0006 0.0054 0.0022 1096 ASN 469 C 0.0014 0.0091 0.0008 1097 ASN 469 O 0.0035 0.0088 -0.0017 1098 ASN 469 CB 0.0000 0.0015 0.0006 1099 ASN 469 CG -0.0019 -0.0020 0.0019 1100 ASN 469 ND2 -0.0028 -0.0049 0.0023 1101 ASN 469 OD1 -0.0028 -0.0019 0.0030 1102 ARG 470 N 0.0006 0.0126 0.0025 1103 ARG 470 CA 0.0020 0.0164 0.0018 1104 ARG 470 C 0.0023 0.0168 0.0016 1105 ARG 470 O 0.0036 0.0197 0.0008 1106 ARG 470 CB 0.0047 0.0177 -0.0009 1107 ARG 470 CG 0.0043 0.0187 -0.0003 1108 ARG 470 CD 0.0070 0.0194 -0.0031 1109 ARG 470 NE 0.0088 0.0228 -0.0045 1110 ARG 470 CZ 0.0107 0.0227 -0.0066 1111 ARG 470 NH1 0.0111 0.0194 -0.0079 1112 ARG 470 NH2 0.0121 0.0258 -0.0075 1113 LEU 471 N 0.0008 0.0111 0.0035 1114 LEU 471 CA 0.0011 0.0109 0.0031 1115 LEU 471 C 0.0010 0.0110 0.0033 1116 LEU 471 O 0.0009 0.0110 0.0039 1117 LEU 471 CB 0.0016 0.0104 0.0031 1118 LEU 471 CG 0.0018 0.0103 0.0029 1119 LEU 471 CD1 0.0024 0.0097 0.0030 1120 LEU 471 CD2 0.0018 0.0105 0.0022 1121 LEU 472 N 0.0009 0.0111 0.0028 1122 LEU 472 CA 0.0008 0.0112 0.0030 1123 LEU 472 C 0.0013 0.0107 0.0029 1124 LEU 472 O 0.0017 0.0105 0.0025 1125 LEU 472 CB 0.0005 0.0116 0.0024 1126 LEU 472 CG 0.0004 0.0117 0.0025 1127 LEU 472 CD1 -0.0001 0.0121 0.0030 1128 LEU 472 CD2 0.0002 0.0120 0.0018 1129 TYR 473 N -0.0039 0.0043 0.0003 1130 TYR 473 CA -0.0024 0.0034 0.0003 1131 TYR 473 C -0.0024 0.0033 -0.0003 1132 TYR 473 O -0.0031 0.0038 0.0003 1133 TYR 473 CB -0.0016 0.0031 0.0020 1134 TYR 473 CG -0.0013 0.0030 0.0025 1135 TYR 473 CD1 -0.0024 0.0037 0.0031 1136 TYR 473 CD2 0.0001 0.0021 0.0023 1137 TYR 473 CE1 -0.0021 0.0036 0.0034 1138 TYR 473 CE2 0.0004 0.0019 0.0025 1139 TYR 473 CZ -0.0008 0.0027 0.0031 1140 TYR 473 OH -0.0006 0.0026 0.0032 1141 ALA 474 N -0.0014 0.0026 -0.0015 1142 ALA 474 CA -0.0011 0.0023 -0.0021 1143 ALA 474 C 0.0005 0.0013 -0.0016 1144 ALA 474 O 0.0015 0.0007 -0.0022 1145 ALA 474 CB -0.0015 0.0023 -0.0040 1146 VAL 475 N -0.0070 -0.0036 -0.0103 1147 VAL 475 CA -0.0049 -0.0026 -0.0102 1148 VAL 475 C -0.0040 -0.0027 -0.0125 1149 VAL 475 O -0.0050 -0.0034 -0.0137 1150 VAL 475 CB -0.0050 -0.0023 -0.0084 1151 VAL 475 CG1 -0.0028 -0.0013 -0.0083 1152 VAL 475 CG2 -0.0058 -0.0022 -0.0060 1153 GLY 476 N -0.0021 -0.0020 -0.0132 1154 GLY 476 CA -0.0009 -0.0019 -0.0154 1155 GLY 476 C -0.0021 -0.0028 -0.0175 1156 GLY 476 O -0.0031 -0.0033 -0.0177 1157 GLY 477 N -0.0007 -0.0035 -0.0217 1158 GLY 477 CA -0.0001 -0.0037 -0.0206 1159 GLY 477 C -0.0009 -0.0040 -0.0196 1160 GLY 477 O -0.0018 -0.0040 -0.0197 1161 PHE 478 N -0.0005 -0.0042 -0.0186 1162 PHE 478 CA -0.0010 -0.0044 -0.0175 1163 PHE 478 C -0.0009 -0.0046 -0.0168 1164 PHE 478 O 0.0001 -0.0045 -0.0167 1165 PHE 478 CB -0.0005 -0.0045 -0.0170 1166 PHE 478 CG -0.0010 -0.0048 -0.0159 1167 PHE 478 CD1 -0.0020 -0.0048 -0.0158 1168 PHE 478 CD2 -0.0003 -0.0049 -0.0149 1169 PHE 478 CE1 -0.0025 -0.0051 -0.0148 1170 PHE 478 CE2 -0.0008 -0.0052 -0.0139 1171 PHE 478 CZ -0.0018 -0.0053 -0.0138 1172 ASP 479 N 0.0009 -0.0035 -0.0136 1173 ASP 479 CA 0.0023 -0.0028 -0.0126 1174 ASP 479 C 0.0028 -0.0014 -0.0091 1175 ASP 479 O 0.0045 -0.0006 -0.0081 1176 ASP 479 CB 0.0006 -0.0036 -0.0136 1177 ASP 479 CG -0.0028 -0.0041 -0.0122 1178 ASP 479 OD1 -0.0036 -0.0035 -0.0099 1179 ASP 479 OD2 -0.0046 -0.0050 -0.0134 1180 GLY 480 N 0.0014 -0.0012 -0.0074 1181 GLY 480 CA 0.0011 -0.0001 -0.0041 1182 GLY 480 C -0.0022 -0.0006 -0.0026 1183 GLY 480 O -0.0029 0.0001 -0.0002 1184 THR 481 N -0.0032 -0.0098 -0.0073 1185 THR 481 CA -0.0077 -0.0146 -0.0049 1186 THR 481 C -0.0094 -0.0153 -0.0074 1187 THR 481 O -0.0096 -0.0167 -0.0036 1188 THR 481 CB -0.0122 -0.0180 -0.0068 1189 THR 481 CG2 -0.0170 -0.0231 -0.0042 1190 THR 481 OG1 -0.0107 -0.0174 -0.0045 1191 ASN 482 N -0.0101 -0.0140 -0.0139 1192 ASN 482 CA -0.0121 -0.0148 -0.0173 1193 ASN 482 C -0.0081 -0.0103 -0.0201 1194 ASN 482 O -0.0047 -0.0066 -0.0223 1195 ASN 482 CB -0.0167 -0.0173 -0.0226 1196 ASN 482 CG -0.0209 -0.0219 -0.0198 1197 ASN 482 ND2 -0.0222 -0.0224 -0.0216 1198 ASN 482 OD1 -0.0228 -0.0248 -0.0155 1199 ARG 483 N -0.0038 -0.0090 -0.0277 1200 ARG 483 CA -0.0035 -0.0089 -0.0283 1201 ARG 483 C -0.0045 -0.0071 -0.0268 1202 ARG 483 O -0.0052 -0.0054 -0.0261 1203 ARG 483 CB -0.0023 -0.0081 -0.0308 1204 ARG 483 CG -0.0011 -0.0101 -0.0325 1205 ARG 483 CD -0.0008 -0.0103 -0.0330 1206 ARG 483 NE 0.0003 -0.0123 -0.0345 1207 ARG 483 CZ 0.0008 -0.0129 -0.0353 1208 ARG 483 NH1 0.0004 -0.0117 -0.0349 1209 ARG 483 NH2 0.0018 -0.0148 -0.0365 1210 LEU 484 N -0.0047 -0.0077 -0.0263 1211 LEU 484 CA -0.0058 -0.0065 -0.0245 1212 LEU 484 C -0.0056 -0.0049 -0.0256 1213 LEU 484 O -0.0048 -0.0058 -0.0268 1214 LEU 484 CB -0.0063 -0.0086 -0.0228 1215 LEU 484 CG -0.0065 -0.0104 -0.0218 1216 LEU 484 CD1 -0.0067 -0.0126 -0.0204 1217 LEU 484 CD2 -0.0075 -0.0092 -0.0202 1218 ASN 485 N -0.0064 -0.0036 -0.0176 1219 ASN 485 CA -0.0063 -0.0042 -0.0170 1220 ASN 485 C -0.0059 -0.0047 -0.0160 1221 ASN 485 O -0.0058 -0.0052 -0.0155 1222 ASN 485 CB -0.0059 -0.0035 -0.0169 1223 ASN 485 CG -0.0051 -0.0026 -0.0165 1224 ASN 485 ND2 -0.0048 -0.0025 -0.0161 1225 ASN 485 OD1 -0.0049 -0.0019 -0.0166 1226 SER 486 N -0.0056 -0.0045 -0.0158 1227 SER 486 CA -0.0052 -0.0049 -0.0148 1228 SER 486 C -0.0056 -0.0060 -0.0146 1229 SER 486 O -0.0062 -0.0063 -0.0152 1230 SER 486 CB -0.0048 -0.0043 -0.0147 1231 SER 486 OG -0.0053 -0.0045 -0.0152 1232 ALA 487 N -0.0046 0.0008 -0.0029 1233 ALA 487 CA -0.0027 -0.0003 -0.0034 1234 ALA 487 C -0.0005 -0.0003 -0.0030 1235 ALA 487 O -0.0005 0.0000 -0.0027 1236 ALA 487 CB -0.0033 -0.0021 -0.0052 1237 GLU 488 N 0.0015 -0.0005 -0.0028 1238 GLU 488 CA 0.0037 -0.0006 -0.0024 1239 GLU 488 C 0.0055 -0.0019 -0.0032 1240 GLU 488 O 0.0051 -0.0024 -0.0037 1241 GLU 488 CB 0.0045 0.0013 -0.0006 1242 GLU 488 CG 0.0044 0.0023 0.0002 1243 GLU 488 CD 0.0046 0.0042 0.0020 1244 GLU 488 OE1 0.0065 0.0046 0.0027 1245 GLU 488 OE2 0.0029 0.0053 0.0027 1246 CYS 489 N 0.0053 0.0059 0.0071 1247 CYS 489 CA 0.0057 0.0071 0.0063 1248 CYS 489 C 0.0063 0.0084 0.0049 1249 CYS 489 O 0.0064 0.0078 0.0036 1250 CYS 489 CB 0.0057 0.0058 0.0053 1251 CYS 489 SG 0.0063 0.0072 0.0039 1252 TYR 490 N 0.0066 0.0103 0.0050 1253 TYR 490 CA 0.0072 0.0118 0.0037 1254 TYR 490 C 0.0076 0.0122 0.0023 1255 TYR 490 O 0.0075 0.0127 0.0030 1256 TYR 490 CB 0.0073 0.0135 0.0048 1257 TYR 490 CG 0.0079 0.0153 0.0037 1258 TYR 490 CD1 0.0081 0.0154 0.0028 1259 TYR 490 CD2 0.0082 0.0169 0.0038 1260 TYR 490 CE1 0.0086 0.0171 0.0019 1261 TYR 490 CE2 0.0087 0.0186 0.0029 1262 TYR 490 CZ 0.0089 0.0187 0.0020 1263 TYR 490 OH 0.0095 0.0204 0.0011 1264 TYR 491 N 0.0123 0.0222 0.0024 1265 TYR 491 CA 0.0116 0.0222 0.0034 1266 TYR 491 C 0.0102 0.0222 0.0028 1267 TYR 491 O 0.0103 0.0221 0.0019 1268 TYR 491 CB 0.0127 0.0222 0.0039 1269 TYR 491 CG 0.0123 0.0222 0.0050 1270 TYR 491 CD1 0.0112 0.0222 0.0060 1271 TYR 491 CD2 0.0130 0.0223 0.0050 1272 TYR 491 CE1 0.0108 0.0222 0.0070 1273 TYR 491 CE2 0.0125 0.0222 0.0059 1274 TYR 491 CZ 0.0114 0.0222 0.0070 1275 TYR 491 OH 0.0110 0.0222 0.0079 1276 PRO 492 N 0.0089 0.0221 0.0031 1277 PRO 492 CA 0.0075 0.0221 0.0024 1278 PRO 492 C 0.0072 0.0221 0.0025 1279 PRO 492 O 0.0069 0.0221 0.0013 1280 PRO 492 CB 0.0063 0.0221 0.0032 1281 PRO 492 CG 0.0071 0.0221 0.0038 1282 PRO 492 CD 0.0086 0.0221 0.0041 1283 GLU 493 N 0.0131 0.0238 0.0020 1284 GLU 493 CA 0.0108 0.0237 0.0045 1285 GLU 493 C 0.0097 0.0239 0.0058 1286 GLU 493 O 0.0077 0.0231 0.0078 1287 GLU 493 CB 0.0103 0.0263 0.0055 1288 GLU 493 CG 0.0111 0.0260 0.0046 1289 GLU 493 CD 0.0133 0.0275 0.0023 1290 GLU 493 OE1 0.0146 0.0281 0.0010 1291 GLU 493 OE2 0.0138 0.0278 0.0018 1292 ARG 494 N 0.0108 0.0249 0.0047 1293 ARG 494 CA 0.0099 0.0247 0.0057 1294 ARG 494 C 0.0108 0.0222 0.0043 1295 ARG 494 O 0.0098 0.0213 0.0052 1296 ARG 494 CB 0.0103 0.0280 0.0057 1297 ARG 494 CG 0.0091 0.0283 0.0072 1298 ARG 494 CD 0.0096 0.0314 0.0070 1299 ARG 494 NE 0.0089 0.0341 0.0082 1300 ARG 494 CZ 0.0091 0.0370 0.0085 1301 ARG 494 NH1 0.0101 0.0377 0.0075 1302 ARG 494 NH2 0.0082 0.0392 0.0098 1303 ASN 495 N 0.0093 0.0163 0.0040 1304 ASN 495 CA 0.0089 0.0167 0.0019 1305 ASN 495 C 0.0112 0.0168 0.0008 1306 ASN 495 O 0.0117 0.0172 -0.0012 1307 ASN 495 CB 0.0073 0.0169 0.0003 1308 ASN 495 CG 0.0066 0.0173 -0.0019 1309 ASN 495 ND2 0.0065 0.0176 -0.0038 1310 ASN 495 OD1 0.0060 0.0173 -0.0018 1311 GLU 496 N 0.0128 0.0166 0.0022 1312 GLU 496 CA 0.0152 0.0167 0.0016 1313 GLU 496 C 0.0159 0.0166 0.0024 1314 GLU 496 O 0.0155 0.0162 0.0044 1315 GLU 496 CB 0.0168 0.0165 0.0026 1316 GLU 496 CG 0.0194 0.0166 0.0022 1317 GLU 496 CD 0.0209 0.0164 0.0031 1318 GLU 496 OE1 0.0209 0.0166 0.0022 1319 GLU 496 OE2 0.0220 0.0161 0.0049 1320 TRP 497 N 0.0203 0.0093 0.0056 1321 TRP 497 CA 0.0178 0.0091 0.0049 1322 TRP 497 C 0.0197 0.0094 0.0054 1323 TRP 497 O 0.0221 0.0116 0.0056 1324 TRP 497 CB 0.0152 0.0121 0.0036 1325 TRP 497 CG 0.0126 0.0117 0.0030 1326 TRP 497 CD1 0.0130 0.0129 0.0029 1327 TRP 497 CD2 0.0091 0.0098 0.0025 1328 TRP 497 CE2 0.0077 0.0100 0.0021 1329 TRP 497 CE3 0.0072 0.0078 0.0024 1330 TRP 497 NE1 0.0101 0.0120 0.0023 1331 TRP 497 CZ2 0.0045 0.0082 0.0016 1332 TRP 497 CZ3 0.0039 0.0061 0.0018 1333 TRP 497 CH2 0.0026 0.0063 0.0014 1334 ARG 498 N 0.0182 0.0074 0.0054 1335 ARG 498 CA 0.0193 0.0077 0.0056 1336 ARG 498 C 0.0161 0.0075 0.0048 1337 ARG 498 O 0.0136 0.0054 0.0046 1338 ARG 498 CB 0.0217 0.0048 0.0068 1339 ARG 498 CG 0.0253 0.0054 0.0077 1340 ARG 498 CD 0.0278 0.0025 0.0089 1341 ARG 498 NE 0.0312 0.0033 0.0097 1342 ARG 498 CZ 0.0343 0.0036 0.0104 1343 ARG 498 NH1 0.0349 0.0028 0.0108 1344 ARG 498 NH2 0.0369 0.0048 0.0109 1345 MET 499 N 0.0044 0.0023 0.0024 1346 MET 499 CA 0.0016 0.0018 0.0017 1347 MET 499 C 0.0014 -0.0011 0.0008 1348 MET 499 O 0.0033 -0.0021 0.0009 1349 MET 499 CB 0.0007 0.0038 0.0022 1350 MET 499 CG 0.0009 0.0068 0.0031 1351 MET 499 SD -0.0008 0.0079 0.0032 1352 MET 499 CE -0.0043 0.0072 0.0023 1353 ILE 500 N -0.0009 -0.0023 0.0000 1354 ILE 500 CA -0.0017 -0.0049 -0.0009 1355 ILE 500 C -0.0042 -0.0043 -0.0011 1356 ILE 500 O -0.0052 -0.0020 -0.0006 1357 ILE 500 CB -0.0022 -0.0070 -0.0016 1358 ILE 500 CG1 -0.0047 -0.0062 -0.0018 1359 ILE 500 CG2 0.0004 -0.0076 -0.0013 1360 ILE 500 CD1 -0.0059 -0.0086 -0.0028 1361 THR 501 N -0.0110 -0.0072 -0.0073 1362 THR 501 CA -0.0103 -0.0067 -0.0077 1363 THR 501 C -0.0103 -0.0070 -0.0085 1364 THR 501 O -0.0108 -0.0074 -0.0087 1365 THR 501 CB -0.0101 -0.0064 -0.0071 1366 THR 501 CG2 -0.0094 -0.0059 -0.0073 1367 THR 501 OG1 -0.0102 -0.0062 -0.0063 1368 ALA 502 N -0.0099 -0.0067 -0.0091 1369 ALA 502 CA -0.0098 -0.0069 -0.0099 1370 ALA 502 C -0.0096 -0.0067 -0.0099 1371 ALA 502 O -0.0092 -0.0063 -0.0095 1372 ALA 502 CB -0.0093 -0.0066 -0.0105 1373 MET 503 N -0.0063 -0.0073 -0.0154 1374 MET 503 CA -0.0055 -0.0069 -0.0146 1375 MET 503 C -0.0033 -0.0068 -0.0148 1376 MET 503 O -0.0025 -0.0072 -0.0162 1377 MET 503 CB -0.0063 -0.0073 -0.0154 1378 MET 503 CG -0.0084 -0.0073 -0.0151 1379 MET 503 SD -0.0094 -0.0078 -0.0161 1380 MET 503 CE -0.0092 -0.0087 -0.0185 1381 ASN 504 N -0.0023 -0.0062 -0.0135 1382 ASN 504 CA -0.0002 -0.0061 -0.0138 1383 ASN 504 C 0.0003 -0.0067 -0.0155 1384 ASN 504 O 0.0019 -0.0069 -0.0162 1385 ASN 504 CB 0.0004 -0.0054 -0.0121 1386 ASN 504 CG 0.0001 -0.0048 -0.0103 1387 ASN 504 ND2 -0.0014 -0.0045 -0.0093 1388 ASN 504 OD1 0.0014 -0.0045 -0.0097 1389 THR 505 N -0.0032 -0.0076 -0.0223 1390 THR 505 CA -0.0022 -0.0088 -0.0227 1391 THR 505 C -0.0039 -0.0096 -0.0248 1392 THR 505 O -0.0061 -0.0084 -0.0252 1393 THR 505 CB -0.0015 -0.0074 -0.0208 1394 THR 505 CG2 0.0005 -0.0087 -0.0206 1395 THR 505 OG1 -0.0008 -0.0059 -0.0187 1396 ILE 506 N -0.0029 -0.0115 -0.0260 1397 ILE 506 CA -0.0042 -0.0121 -0.0276 1398 ILE 506 C -0.0047 -0.0106 -0.0264 1399 ILE 506 O -0.0029 -0.0105 -0.0250 1400 ILE 506 CB -0.0028 -0.0145 -0.0290 1401 ILE 506 CG1 -0.0029 -0.0160 -0.0305 1402 ILE 506 CG2 -0.0039 -0.0151 -0.0303 1403 ILE 506 CD1 -0.0014 -0.0184 -0.0318 1404 ARG 507 N -0.0033 -0.0079 -0.0248 1405 ARG 507 CA -0.0040 -0.0058 -0.0233 1406 ARG 507 C -0.0052 -0.0045 -0.0250 1407 ARG 507 O -0.0064 -0.0032 -0.0264 1408 ARG 507 CB -0.0046 -0.0041 -0.0221 1409 ARG 507 CG -0.0036 -0.0051 -0.0206 1410 ARG 507 CD -0.0043 -0.0033 -0.0196 1411 ARG 507 NE -0.0033 -0.0043 -0.0182 1412 ARG 507 CZ -0.0026 -0.0043 -0.0157 1413 ARG 507 NH1 -0.0025 -0.0035 -0.0141 1414 ARG 507 NH2 -0.0017 -0.0054 -0.0148 1415 SER 508 N -0.0050 -0.0045 -0.0243 1416 SER 508 CA -0.0062 -0.0030 -0.0252 1417 SER 508 C -0.0067 -0.0010 -0.0231 1418 SER 508 O -0.0058 -0.0014 -0.0210 1419 SER 508 CB -0.0056 -0.0044 -0.0262 1420 SER 508 OG -0.0068 -0.0028 -0.0270 1421 GLY 509 N -0.0023 0.0034 -0.0221 1422 GLY 509 CA -0.0034 0.0044 -0.0209 1423 GLY 509 C -0.0032 0.0043 -0.0190 1424 GLY 509 O -0.0034 0.0045 -0.0176 1425 ALA 510 N -0.0026 0.0038 -0.0188 1426 ALA 510 CA -0.0027 0.0039 -0.0171 1427 ALA 510 C -0.0041 0.0052 -0.0168 1428 ALA 510 O -0.0050 0.0059 -0.0181 1429 ALA 510 CB -0.0017 0.0031 -0.0173 1430 GLY 511 N -0.0021 0.0029 -0.0092 1431 GLY 511 CA -0.0030 0.0020 -0.0082 1432 GLY 511 C -0.0029 0.0026 -0.0065 1433 GLY 511 O -0.0021 0.0037 -0.0061 1434 VAL 512 N -0.0036 0.0019 -0.0055 1435 VAL 512 CA -0.0037 0.0023 -0.0038 1436 VAL 512 C -0.0047 0.0013 -0.0029 1437 VAL 512 O -0.0055 0.0002 -0.0033 1438 VAL 512 CB -0.0035 0.0027 -0.0033 1439 VAL 512 CG1 -0.0037 0.0029 -0.0015 1440 VAL 512 CG2 -0.0024 0.0038 -0.0040 1441 CYS 513 N -0.0030 -0.0026 0.0031 1442 CYS 513 CA -0.0044 -0.0031 0.0044 1443 CYS 513 C -0.0040 -0.0024 0.0062 1444 CYS 513 O -0.0027 -0.0014 0.0065 1445 CYS 513 CB -0.0048 -0.0035 0.0040 1446 CYS 513 SG -0.0034 -0.0024 0.0045 1447 VAL 514 N -0.0052 -0.0028 0.0075 1448 VAL 514 CA -0.0050 -0.0021 0.0094 1449 VAL 514 C -0.0051 -0.0020 0.0100 1450 VAL 514 O -0.0061 -0.0028 0.0096 1451 VAL 514 CB -0.0061 -0.0026 0.0105 1452 VAL 514 CG1 -0.0078 -0.0036 0.0107 1453 VAL 514 CG2 -0.0057 -0.0018 0.0123 1454 LEU 515 N -0.0025 -0.0106 0.0108 1455 LEU 515 CA -0.0025 -0.0104 0.0114 1456 LEU 515 C -0.0021 -0.0093 0.0133 1457 LEU 515 O -0.0011 -0.0081 0.0135 1458 LEU 515 CB -0.0015 -0.0099 0.0099 1459 LEU 515 CG -0.0013 -0.0094 0.0105 1460 LEU 515 CD1 -0.0026 -0.0107 0.0105 1461 LEU 515 CD2 -0.0000 -0.0085 0.0092 1462 HIS 516 N -0.0030 -0.0096 0.0148 1463 HIS 516 CA -0.0027 -0.0087 0.0167 1464 HIS 516 C -0.0023 -0.0081 0.0176 1465 HIS 516 O -0.0014 -0.0068 0.0184 1466 HIS 516 CB -0.0016 -0.0076 0.0167 1467 HIS 516 CG -0.0018 -0.0081 0.0160 1468 HIS 516 CD2 -0.0031 -0.0094 0.0161 1469 HIS 516 ND1 -0.0008 -0.0072 0.0156 1470 HIS 516 CE1 -0.0015 -0.0079 0.0154 1471 HIS 516 NE2 -0.0029 -0.0092 0.0156 1472 ASN 517 N -0.0095 -0.0071 0.0118 1473 ASN 517 CA -0.0088 -0.0066 0.0123 1474 ASN 517 C -0.0080 -0.0054 0.0116 1475 ASN 517 O -0.0075 -0.0049 0.0120 1476 ASN 517 CB -0.0086 -0.0067 0.0138 1477 ASN 517 CG -0.0094 -0.0079 0.0144 1478 ASN 517 ND2 -0.0095 -0.0082 0.0153 1479 ASN 517 OD1 -0.0101 -0.0085 0.0139 1480 CYS 518 N -0.0080 -0.0051 0.0105 1481 CYS 518 CA -0.0073 -0.0041 0.0096 1482 CYS 518 C -0.0078 -0.0042 0.0083 1483 CYS 518 O -0.0086 -0.0049 0.0077 1484 CYS 518 CB -0.0069 -0.0035 0.0093 1485 CYS 518 SG -0.0061 -0.0031 0.0108 1486 ILE 519 N -0.0052 -0.0022 0.0070 1487 ILE 519 CA -0.0054 -0.0027 0.0052 1488 ILE 519 C -0.0041 -0.0023 0.0044 1489 ILE 519 O -0.0027 -0.0018 0.0042 1490 ILE 519 CB -0.0052 -0.0028 0.0043 1491 ILE 519 CG1 -0.0064 -0.0031 0.0050 1492 ILE 519 CG2 -0.0054 -0.0033 0.0024 1493 ILE 519 CD1 -0.0081 -0.0039 0.0047 1494 TYR 520 N -0.0045 -0.0026 0.0039 1495 TYR 520 CA -0.0035 -0.0024 0.0029 1496 TYR 520 C -0.0034 -0.0028 0.0010 1497 TYR 520 O -0.0046 -0.0034 0.0003 1498 TYR 520 CB -0.0040 -0.0025 0.0033 1499 TYR 520 CG -0.0036 -0.0020 0.0050 1500 TYR 520 CD1 -0.0045 -0.0021 0.0065 1501 TYR 520 CD2 -0.0024 -0.0015 0.0052 1502 TYR 520 CE1 -0.0042 -0.0016 0.0081 1503 TYR 520 CE2 -0.0021 -0.0010 0.0068 1504 TYR 520 CZ -0.0030 -0.0011 0.0082 1505 TYR 520 OH -0.0026 -0.0006 0.0098 1506 ALA 521 N -0.0055 0.0016 -0.0052 1507 ALA 521 CA -0.0052 0.0010 -0.0064 1508 ALA 521 C -0.0041 0.0011 -0.0063 1509 ALA 521 O -0.0029 0.0012 -0.0060 1510 ALA 521 CB -0.0047 0.0007 -0.0072 1511 ALA 522 N -0.0045 0.0010 -0.0066 1512 ALA 522 CA -0.0037 0.0010 -0.0065 1513 ALA 522 C -0.0033 0.0004 -0.0078 1514 ALA 522 O -0.0041 0.0001 -0.0086 1515 ALA 522 CB -0.0045 0.0013 -0.0058 1516 GLY 523 N -0.0043 0.0031 -0.0116 1517 GLY 523 CA -0.0039 0.0021 -0.0111 1518 GLY 523 C -0.0040 0.0014 -0.0139 1519 GLY 523 O -0.0038 0.0000 -0.0160 1520 GLY 524 N -0.0043 0.0021 -0.0139 1521 GLY 524 CA -0.0043 0.0013 -0.0162 1522 GLY 524 C -0.0032 -0.0012 -0.0154 1523 GLY 524 O -0.0025 -0.0019 -0.0129 1524 TYR 525 N -0.0046 -0.0020 -0.0201 1525 TYR 525 CA -0.0024 -0.0064 -0.0198 1526 TYR 525 C -0.0014 -0.0106 -0.0241 1527 TYR 525 O -0.0029 -0.0096 -0.0290 1528 TYR 525 CB -0.0034 -0.0047 -0.0207 1529 TYR 525 CG -0.0014 -0.0087 -0.0201 1530 TYR 525 CD1 0.0003 -0.0099 -0.0148 1531 TYR 525 CD2 -0.0012 -0.0112 -0.0247 1532 TYR 525 CE1 0.0021 -0.0135 -0.0140 1533 TYR 525 CE2 0.0006 -0.0148 -0.0239 1534 TYR 525 CZ 0.0023 -0.0160 -0.0186 1535 TYR 525 OH 0.0041 -0.0194 -0.0177 1536 ASP 526 N 0.0011 -0.0152 -0.0225 1537 ASP 526 CA 0.0024 -0.0195 -0.0260 1538 ASP 526 C 0.0032 -0.0227 -0.0292 1539 ASP 526 O 0.0037 -0.0257 -0.0332 1540 ASP 526 CB 0.0046 -0.0228 -0.0226 1541 ASP 526 CG 0.0068 -0.0255 -0.0182 1542 ASP 526 OD1 0.0070 -0.0259 -0.0182 1543 ASP 526 OD2 0.0086 -0.0280 -0.0152 1544 GLY 527 N 0.0040 -0.0277 -0.0334 1545 GLY 527 CA 0.0064 -0.0313 -0.0398 1546 GLY 527 C 0.0095 -0.0348 -0.0335 1547 GLY 527 O 0.0093 -0.0349 -0.0372 1548 GLN 528 N 0.0112 -0.0365 -0.0236 1549 GLN 528 CA 0.0143 -0.0401 -0.0162 1550 GLN 528 C 0.0106 -0.0347 -0.0063 1551 GLN 528 O 0.0079 -0.0310 -0.0043 1552 GLN 528 CB 0.0212 -0.0488 -0.0138 1553 GLN 528 CG 0.0253 -0.0546 -0.0234 1554 GLN 528 CD 0.0238 -0.0532 -0.0308 1555 GLN 528 NE2 0.0218 -0.0504 -0.0274 1556 GLN 528 OE1 0.0239 -0.0539 -0.0401 1557 ASP 529 N 0.0057 -0.0327 -0.0127 1558 ASP 529 CA 0.0050 -0.0281 -0.0054 1559 ASP 529 C 0.0024 -0.0204 -0.0077 1560 ASP 529 O 0.0014 -0.0194 -0.0148 1561 ASP 529 CB 0.0073 -0.0337 -0.0004 1562 ASP 529 CG 0.0098 -0.0405 0.0037 1563 ASP 529 OD1 0.0097 -0.0383 0.0095 1564 ASP 529 OD2 0.0118 -0.0477 0.0010 1565 GLN 530 N 0.0013 -0.0147 -0.0015 1566 GLN 530 CA -0.0008 -0.0082 -0.0020 1567 GLN 530 C 0.0003 -0.0113 -0.0003 1568 GLN 530 O 0.0023 -0.0155 0.0057 1569 GLN 530 CB -0.0024 -0.0010 0.0041 1570 GLN 530 CG -0.0047 0.0050 -0.0001 1571 GLN 530 CD -0.0040 0.0028 0.0003 1572 GLN 530 NE2 -0.0057 0.0069 -0.0043 1573 GLN 530 OE1 -0.0018 -0.0027 0.0045 1574 LEU 531 N -0.0012 -0.0046 -0.0088 1575 LEU 531 CA -0.0014 -0.0048 -0.0094 1576 LEU 531 C -0.0011 -0.0022 -0.0081 1577 LEU 531 O -0.0012 0.0004 -0.0082 1578 LEU 531 CB -0.0023 -0.0049 -0.0127 1579 LEU 531 CG -0.0027 -0.0074 -0.0142 1580 LEU 531 CD1 -0.0036 -0.0068 -0.0174 1581 LEU 531 CD2 -0.0024 -0.0104 -0.0137 1582 ASN 532 N -0.0008 -0.0028 -0.0071 1583 ASN 532 CA -0.0007 -0.0006 -0.0066 1584 ASN 532 C -0.0014 -0.0006 -0.0090 1585 ASN 532 O -0.0015 0.0013 -0.0090 1586 ASN 532 CB 0.0002 -0.0009 -0.0036 1587 ASN 532 CG 0.0005 -0.0040 -0.0028 1588 ASN 532 ND2 0.0000 -0.0057 -0.0047 1589 ASN 532 OD1 0.0012 -0.0051 -0.0006 1590 SER 533 N 0.0025 -0.0000 -0.0072 1591 SER 533 CA 0.0023 0.0002 -0.0069 1592 SER 533 C 0.0009 0.0007 -0.0071 1593 SER 533 O 0.0002 0.0007 -0.0080 1594 SER 533 CB 0.0031 -0.0005 -0.0075 1595 SER 533 OG 0.0026 -0.0010 -0.0088 1596 VAL 534 N 0.0006 0.0012 -0.0064 1597 VAL 534 CA -0.0006 0.0018 -0.0065 1598 VAL 534 C -0.0005 0.0018 -0.0065 1599 VAL 534 O 0.0002 0.0018 -0.0057 1600 VAL 534 CB -0.0012 0.0026 -0.0055 1601 VAL 534 CG1 -0.0026 0.0032 -0.0056 1602 VAL 534 CG2 -0.0012 0.0026 -0.0054 1603 GLU 535 N -0.0025 -0.0031 -0.0050 1604 GLU 535 CA -0.0028 -0.0023 -0.0034 1605 GLU 535 C -0.0059 -0.0025 -0.0024 1606 GLU 535 O -0.0078 -0.0036 -0.0037 1607 GLU 535 CB -0.0013 -0.0027 -0.0048 1608 GLU 535 CG -0.0024 -0.0044 -0.0074 1609 GLU 535 CD -0.0004 -0.0047 -0.0090 1610 GLU 535 OE1 0.0003 -0.0040 -0.0080 1611 GLU 535 OE2 0.0008 -0.0056 -0.0112 1612 ARG 536 N -0.0064 -0.0014 -0.0001 1613 ARG 536 CA -0.0093 -0.0015 0.0011 1614 ARG 536 C -0.0095 -0.0012 0.0016 1615 ARG 536 O -0.0075 -0.0002 0.0026 1616 ARG 536 CB -0.0103 -0.0004 0.0034 1617 ARG 536 CG -0.0088 0.0013 0.0059 1618 ARG 536 CD -0.0098 0.0022 0.0081 1619 ARG 536 NE -0.0083 0.0038 0.0104 1620 ARG 536 CZ -0.0077 0.0049 0.0121 1621 ARG 536 NH1 -0.0086 0.0046 0.0120 1622 ARG 536 NH2 -0.0061 0.0062 0.0139 1623 TYR 537 N -0.0139 -0.0071 0.0038 1624 TYR 537 CA -0.0138 -0.0074 0.0027 1625 TYR 537 C -0.0142 -0.0068 0.0028 1626 TYR 537 O -0.0148 -0.0058 0.0029 1627 TYR 537 CB -0.0141 -0.0071 0.0015 1628 TYR 537 CG -0.0140 -0.0075 0.0002 1629 TYR 537 CD1 -0.0133 -0.0086 -0.0001 1630 TYR 537 CD2 -0.0145 -0.0068 -0.0006 1631 TYR 537 CE1 -0.0132 -0.0090 -0.0013 1632 TYR 537 CE2 -0.0144 -0.0071 -0.0018 1633 TYR 537 CZ -0.0137 -0.0082 -0.0021 1634 TYR 537 OH -0.0136 -0.0086 -0.0032 1635 ASP 538 N -0.0138 -0.0074 0.0025 1636 ASP 538 CA -0.0141 -0.0070 0.0023 1637 ASP 538 C -0.0141 -0.0072 0.0009 1638 ASP 538 O -0.0136 -0.0081 0.0004 1639 ASP 538 CB -0.0137 -0.0074 0.0032 1640 ASP 538 CG -0.0140 -0.0070 0.0031 1641 ASP 538 OD1 -0.0137 -0.0073 0.0038 1642 ASP 538 OD2 -0.0144 -0.0065 0.0021 1643 VAL 539 N -0.0169 -0.0091 -0.0015 1644 VAL 539 CA -0.0148 -0.0084 -0.0004 1645 VAL 539 C -0.0143 -0.0096 -0.0013 1646 VAL 539 O -0.0133 -0.0088 -0.0004 1647 VAL 539 CB -0.0121 -0.0084 0.0001 1648 VAL 539 CG1 -0.0122 -0.0070 0.0014 1649 VAL 539 CG2 -0.0108 -0.0107 -0.0015 1650 GLU 540 N -0.0150 -0.0116 -0.0032 1651 GLU 540 CA -0.0146 -0.0128 -0.0042 1652 GLU 540 C -0.0169 -0.0122 -0.0041 1653 GLU 540 O -0.0163 -0.0122 -0.0040 1654 GLU 540 CB -0.0146 -0.0152 -0.0062 1655 GLU 540 CG -0.0121 -0.0161 -0.0064 1656 GLU 540 CD -0.0115 -0.0185 -0.0084 1657 GLU 540 OE1 -0.0119 -0.0196 -0.0094 1658 GLU 540 OE2 -0.0101 -0.0192 -0.0087 1659 THR 541 N -0.0150 -0.0106 -0.0028 1660 THR 541 CA -0.0145 -0.0118 -0.0026 1661 THR 541 C -0.0144 -0.0117 -0.0032 1662 THR 541 O -0.0140 -0.0127 -0.0031 1663 THR 541 CB -0.0149 -0.0124 -0.0011 1664 THR 541 CG2 -0.0151 -0.0126 -0.0003 1665 THR 541 OG1 -0.0155 -0.0117 -0.0004 1666 GLU 542 N -0.0147 -0.0104 -0.0037 1667 GLU 542 CA -0.0147 -0.0100 -0.0042 1668 GLU 542 C -0.0149 -0.0105 -0.0032 1669 GLU 542 O -0.0147 -0.0107 -0.0036 1670 GLU 542 CB -0.0139 -0.0104 -0.0057 1671 GLU 542 CG -0.0138 -0.0097 -0.0067 1672 GLU 542 CD -0.0132 -0.0098 -0.0082 1673 GLU 542 OE1 -0.0126 -0.0109 -0.0085 1674 GLU 542 OE2 -0.0132 -0.0089 -0.0091 1675 THR 543 N -0.0132 -0.0050 -0.0043 1676 THR 543 CA -0.0119 -0.0054 -0.0038 1677 THR 543 C -0.0112 -0.0053 -0.0034 1678 THR 543 O -0.0113 -0.0043 -0.0030 1679 THR 543 CB -0.0113 -0.0048 -0.0032 1680 THR 543 CG2 -0.0099 -0.0051 -0.0027 1681 THR 543 OG1 -0.0118 -0.0050 -0.0036 1682 TRP 544 N -0.0103 -0.0063 -0.0035 1683 TRP 544 CA -0.0093 -0.0063 -0.0030 1684 TRP 544 C -0.0082 -0.0059 -0.0022 1685 TRP 544 O -0.0075 -0.0066 -0.0022 1686 TRP 544 CB -0.0090 -0.0075 -0.0034 1687 TRP 544 CG -0.0100 -0.0079 -0.0041 1688 TRP 544 CD1 -0.0108 -0.0086 -0.0048 1689 TRP 544 CD2 -0.0103 -0.0076 -0.0041 1690 TRP 544 CE2 -0.0113 -0.0081 -0.0049 1691 TRP 544 CE3 -0.0097 -0.0069 -0.0035 1692 TRP 544 NE1 -0.0116 -0.0087 -0.0053 1693 TRP 544 CZ2 -0.0118 -0.0080 -0.0050 1694 TRP 544 CZ3 -0.0102 -0.0068 -0.0037 1695 TRP 544 CH2 -0.0112 -0.0073 -0.0044 1696 THR 545 N -0.0044 0.0007 -0.0005 1697 THR 545 CA -0.0019 0.0021 0.0006 1698 THR 545 C -0.0012 0.0014 -0.0004 1699 THR 545 O -0.0033 0.0009 -0.0005 1700 THR 545 CB -0.0027 0.0039 0.0035 1701 THR 545 CG2 -0.0001 0.0054 0.0048 1702 THR 545 OG1 -0.0034 0.0045 0.0044 1703 PHE 546 N 0.0016 0.0015 -0.0011 1704 PHE 546 CA 0.0026 0.0013 -0.0018 1705 PHE 546 C 0.0021 0.0028 0.0004 1706 PHE 546 O 0.0029 0.0044 0.0024 1707 PHE 546 CB 0.0059 0.0011 -0.0030 1708 PHE 546 CG 0.0064 -0.0006 -0.0056 1709 PHE 546 CD1 0.0056 -0.0023 -0.0076 1710 PHE 546 CD2 0.0076 -0.0006 -0.0059 1711 PHE 546 CE1 0.0060 -0.0039 -0.0100 1712 PHE 546 CE2 0.0080 -0.0022 -0.0083 1713 PHE 546 CZ 0.0072 -0.0039 -0.0103 1714 VAL 547 N 0.0059 0.0092 0.0026 1715 VAL 547 CA 0.0059 0.0097 0.0032 1716 VAL 547 C 0.0077 0.0095 0.0011 1717 VAL 547 O 0.0088 0.0090 -0.0008 1718 VAL 547 CB 0.0035 0.0083 0.0041 1719 VAL 547 CG1 0.0018 0.0086 0.0063 1720 VAL 547 CG2 0.0024 0.0060 0.0022 1721 ALA 548 N 0.0079 0.0097 0.0012 1722 ALA 548 CA 0.0094 0.0094 -0.0009 1723 ALA 548 C 0.0090 0.0073 -0.0032 1724 ALA 548 O 0.0070 0.0057 -0.0032 1725 ALA 548 CB 0.0091 0.0096 -0.0003 1726 PRO 549 N 0.0034 0.0092 -0.0035 1727 PRO 549 CA 0.0029 0.0095 -0.0045 1728 PRO 549 C 0.0018 0.0091 -0.0046 1729 PRO 549 O 0.0015 0.0088 -0.0042 1730 PRO 549 CB 0.0035 0.0100 -0.0051 1731 PRO 549 CG 0.0039 0.0098 -0.0045 1732 PRO 549 CD 0.0040 0.0094 -0.0034 1733 MET 550 N 0.0012 0.0092 -0.0054 1734 MET 550 CA 0.0002 0.0090 -0.0058 1735 MET 550 C 0.0003 0.0093 -0.0063 1736 MET 550 O 0.0010 0.0097 -0.0065 1737 MET 550 CB -0.0003 0.0092 -0.0066 1738 MET 550 CG -0.0003 0.0090 -0.0062 1739 MET 550 SD -0.0008 0.0092 -0.0071 1740 MET 550 CE 0.0001 0.0099 -0.0079 1741 LYS 551 N -0.0046 0.0110 -0.0072 1742 LYS 551 CA -0.0058 0.0110 -0.0067 1743 LYS 551 C -0.0060 0.0118 -0.0048 1744 LYS 551 O -0.0075 0.0118 -0.0041 1745 LYS 551 CB -0.0053 0.0108 -0.0074 1746 LYS 551 CG -0.0058 0.0101 -0.0091 1747 LYS 551 CD -0.0050 0.0097 -0.0103 1748 LYS 551 CE -0.0056 0.0089 -0.0120 1749 LYS 551 NZ -0.0051 0.0085 -0.0132 1750 HIS 552 N -0.0046 0.0123 -0.0040 1751 HIS 552 CA -0.0046 0.0130 -0.0022 1752 HIS 552 C -0.0042 0.0133 -0.0015 1753 HIS 552 O -0.0028 0.0134 -0.0017 1754 HIS 552 CB -0.0033 0.0134 -0.0017 1755 HIS 552 CG -0.0037 0.0130 -0.0025 1756 HIS 552 CD2 -0.0027 0.0126 -0.0037 1757 HIS 552 ND1 -0.0051 0.0130 -0.0021 1758 HIS 552 CE1 -0.0050 0.0126 -0.0031 1759 HIS 552 NE2 -0.0035 0.0124 -0.0040 1760 ARG 553 N -0.0096 -0.0016 0.0038 1761 ARG 553 CA -0.0097 -0.0022 0.0015 1762 ARG 553 C -0.0077 0.0024 0.0027 1763 ARG 553 O -0.0071 0.0045 0.0071 1764 ARG 553 CB -0.0121 -0.0069 0.0035 1765 ARG 553 CG -0.0123 -0.0064 0.0092 1766 ARG 553 CD -0.0146 -0.0111 0.0114 1767 ARG 553 NE -0.0146 -0.0101 0.0168 1768 ARG 553 CZ -0.0145 -0.0092 0.0213 1769 ARG 553 NH1 -0.0148 -0.0097 0.0217 1770 ARG 553 NH2 -0.0140 -0.0074 0.0255 1771 ARG 554 N -0.0067 0.0039 -0.0012 1772 ARG 554 CA -0.0047 0.0085 -0.0007 1773 ARG 554 C -0.0043 0.0086 -0.0046 1774 ARG 554 O -0.0045 0.0074 -0.0094 1775 ARG 554 CB -0.0026 0.0129 -0.0013 1776 ARG 554 CG -0.0022 0.0128 -0.0065 1777 ARG 554 CD -0.0003 0.0170 -0.0067 1778 ARG 554 NE -0.0010 0.0160 -0.0034 1779 ARG 554 CZ 0.0005 0.0194 -0.0013 1780 ARG 554 NH1 0.0025 0.0240 -0.0005 1781 ARG 554 NH2 -0.0002 0.0184 0.0003 1782 SER 555 N -0.0051 0.0103 -0.0021 1783 SER 555 CA -0.0053 0.0107 -0.0038 1784 SER 555 C -0.0053 0.0126 -0.0037 1785 SER 555 O -0.0052 0.0133 -0.0021 1786 SER 555 CB -0.0054 0.0092 -0.0045 1787 SER 555 OG -0.0052 0.0091 -0.0033 1788 ALA 556 N -0.0056 0.0135 -0.0052 1789 ALA 556 CA -0.0056 0.0154 -0.0053 1790 ALA 556 C -0.0055 0.0168 -0.0044 1791 ALA 556 O -0.0055 0.0181 -0.0036 1792 ALA 556 CB -0.0055 0.0155 -0.0046 1793 LEU 557 N -0.0035 0.0175 -0.0004 1794 LEU 557 CA -0.0037 0.0166 -0.0005 1795 LEU 557 C -0.0024 0.0167 -0.0008 1796 LEU 557 O -0.0013 0.0171 -0.0011 1797 LEU 557 CB -0.0039 0.0150 -0.0006 1798 LEU 557 CG -0.0028 0.0144 -0.0011 1799 LEU 557 CD1 -0.0028 0.0128 -0.0014 1800 LEU 557 CD2 -0.0029 0.0148 -0.0010 1801 GLY 558 N -0.0026 0.0164 -0.0008 1802 GLY 558 CA -0.0015 0.0159 -0.0012 1803 GLY 558 C -0.0013 0.0143 -0.0016 1804 GLY 558 O -0.0023 0.0135 -0.0014 1805 ILE 559 N 0.0033 0.0086 0.0033 1806 ILE 559 CA 0.0037 0.0064 0.0029 1807 ILE 559 C 0.0054 0.0047 0.0031 1808 ILE 559 O 0.0070 0.0056 0.0037 1809 ILE 559 CB 0.0046 0.0069 0.0033 1810 ILE 559 CG1 0.0045 0.0047 0.0028 1811 ILE 559 CG2 0.0070 0.0078 0.0042 1812 ILE 559 CD1 0.0047 0.0053 0.0030 1813 THR 560 N 0.0052 0.0024 0.0025 1814 THR 560 CA 0.0069 0.0007 0.0026 1815 THR 560 C 0.0068 -0.0017 0.0021 1816 THR 560 O 0.0052 -0.0020 0.0016 1817 THR 560 CB 0.0066 0.0004 0.0025 1818 THR 560 CG2 0.0045 -0.0009 0.0016 1819 THR 560 OG1 0.0086 -0.0008 0.0028 1820 VAL 561 N 0.0146 -0.0085 0.0089 1821 VAL 561 CA 0.0145 -0.0110 0.0072 1822 VAL 561 C 0.0153 -0.0130 0.0062 1823 VAL 561 O 0.0176 -0.0132 0.0069 1824 VAL 561 CB 0.0163 -0.0116 0.0075 1825 VAL 561 CG1 0.0165 -0.0143 0.0058 1826 VAL 561 CG2 0.0151 -0.0098 0.0082 1827 HIS 562 N 0.0136 -0.0146 0.0045 1828 HIS 562 CA 0.0142 -0.0168 0.0032 1829 HIS 562 C 0.0135 -0.0191 0.0015 1830 HIS 562 O 0.0113 -0.0189 0.0008 1831 HIS 562 CB 0.0125 -0.0163 0.0030 1832 HIS 562 CG 0.0130 -0.0185 0.0017 1833 HIS 562 CD2 0.0143 -0.0185 0.0022 1834 HIS 562 ND1 0.0120 -0.0207 -0.0001 1835 HIS 562 CE1 0.0126 -0.0220 -0.0007 1836 HIS 562 NE2 0.0140 -0.0207 0.0006 1837 GLN 563 N 0.0229 -0.0335 0.0081 1838 GLN 563 CA 0.0224 -0.0356 0.0047 1839 GLN 563 C 0.0192 -0.0320 0.0044 1840 GLN 563 O 0.0166 -0.0323 0.0003 1841 GLN 563 CB 0.0217 -0.0390 -0.0006 1842 GLN 563 CG 0.0258 -0.0436 -0.0003 1843 GLN 563 CD 0.0252 -0.0468 -0.0052 1844 GLN 563 NE2 0.0280 -0.0499 -0.0050 1845 GLN 563 OE1 0.0224 -0.0469 -0.0095 1846 GLY 564 N 0.0193 -0.0287 0.0089 1847 GLY 564 CA 0.0165 -0.0252 0.0092 1848 GLY 564 C 0.0119 -0.0211 0.0074 1849 GLY 564 O 0.0093 -0.0183 0.0071 1850 ARG 565 N 0.0119 -0.0241 0.0050 1851 ARG 565 CA 0.0081 -0.0205 0.0042 1852 ARG 565 C 0.0085 -0.0146 0.0046 1853 ARG 565 O 0.0094 -0.0137 0.0049 1854 ARG 565 CB 0.0025 -0.0226 0.0027 1855 ARG 565 CG 0.0019 -0.0283 0.0023 1856 ARG 565 CD -0.0039 -0.0300 0.0007 1857 ARG 565 NE -0.0044 -0.0356 0.0003 1858 ARG 565 CZ -0.0072 -0.0396 -0.0006 1859 ARG 565 NH1 -0.0107 -0.0389 -0.0015 1860 ARG 565 NH2 -0.0074 -0.0440 -0.0009 1861 ILE 566 N 0.0078 -0.0107 0.0046 1862 ILE 566 CA 0.0074 -0.0049 0.0048 1863 ILE 566 C 0.0019 -0.0037 0.0034 1864 ILE 566 O -0.0020 -0.0055 0.0023 1865 ILE 566 CB 0.0090 -0.0012 0.0054 1866 ILE 566 CG1 0.0150 -0.0014 0.0070 1867 ILE 566 CG2 0.0072 0.0047 0.0052 1868 ILE 566 CD1 0.0168 0.0003 0.0075 1869 TYR 567 N 0.0085 -0.0008 0.0037 1870 TYR 567 CA 0.0054 0.0004 0.0015 1871 TYR 567 C 0.0059 0.0046 0.0012 1872 TYR 567 O 0.0079 0.0055 0.0023 1873 TYR 567 CB 0.0039 -0.0021 0.0009 1874 TYR 567 CG 0.0028 -0.0061 0.0008 1875 TYR 567 CD1 0.0052 -0.0087 0.0027 1876 TYR 567 CD2 -0.0005 -0.0073 -0.0012 1877 TYR 567 CE1 0.0042 -0.0124 0.0026 1878 TYR 567 CE2 -0.0014 -0.0111 -0.0012 1879 TYR 567 CZ 0.0010 -0.0136 0.0007 1880 TYR 567 OH 0.0001 -0.0173 0.0007 1881 VAL 568 N 0.0040 0.0070 -0.0004 1882 VAL 568 CA 0.0038 0.0109 -0.0011 1883 VAL 568 C 0.0007 0.0112 -0.0032 1884 VAL 568 O -0.0018 0.0097 -0.0046 1885 VAL 568 CB 0.0043 0.0139 -0.0013 1886 VAL 568 CG1 0.0076 0.0138 0.0009 1887 VAL 568 CG2 0.0017 0.0134 -0.0029 1888 LEU 569 N 0.0027 0.0152 0.0008 1889 LEU 569 CA 0.0027 0.0142 -0.0006 1890 LEU 569 C 0.0019 0.0162 0.0000 1891 LEU 569 O 0.0024 0.0169 0.0024 1892 LEU 569 CB 0.0042 0.0115 0.0003 1893 LEU 569 CG 0.0050 0.0093 -0.0006 1894 LEU 569 CD1 0.0057 0.0092 0.0014 1895 LEU 569 CD2 0.0062 0.0067 -0.0006 1896 GLY 570 N 0.0009 0.0168 -0.0022 1897 GLY 570 CA 0.0002 0.0183 -0.0020 1898 GLY 570 C -0.0004 0.0210 -0.0002 1899 GLY 570 O -0.0011 0.0223 -0.0002 1900 GLY 571 N -0.0008 0.0217 0.0007 1901 GLY 571 CA -0.0014 0.0207 0.0007 1902 GLY 571 C -0.0035 0.0208 0.0039 1903 GLY 571 O -0.0041 0.0224 0.0063 1904 TYR 572 N -0.0045 0.0191 0.0039 1905 TYR 572 CA -0.0066 0.0187 0.0066 1906 TYR 572 C -0.0083 0.0152 0.0060 1907 TYR 572 O -0.0074 0.0138 0.0033 1908 TYR 572 CB -0.0056 0.0209 0.0072 1909 TYR 572 CG -0.0075 0.0209 0.0100 1910 TYR 572 CD1 -0.0087 0.0223 0.0129 1911 TYR 572 CD2 -0.0080 0.0197 0.0096 1912 TYR 572 CE1 -0.0104 0.0223 0.0155 1913 TYR 572 CE2 -0.0097 0.0198 0.0122 1914 TYR 572 CZ -0.0109 0.0211 0.0152 1915 TYR 572 OH -0.0126 0.0212 0.0177 1916 ASP 573 N -0.0100 0.0116 0.0095 1917 ASP 573 CA -0.0125 0.0064 0.0091 1918 ASP 573 C -0.0149 0.0057 0.0121 1919 ASP 573 O -0.0177 0.0019 0.0131 1920 ASP 573 CB -0.0146 0.0036 0.0100 1921 ASP 573 CG -0.0174 0.0048 0.0150 1922 ASP 573 OD1 -0.0172 0.0086 0.0176 1923 ASP 573 OD2 -0.0201 0.0015 0.0164 1924 GLY 574 N -0.0141 0.0096 0.0139 1925 GLY 574 CA -0.0162 0.0099 0.0172 1926 GLY 574 C -0.0186 0.0118 0.0221 1927 GLY 574 O -0.0190 0.0145 0.0248 1928 HIS 575 N -0.0334 0.0194 0.0265 1929 HIS 575 CA -0.0384 0.0209 0.0307 1930 HIS 575 C -0.0319 0.0225 0.0299 1931 HIS 575 O -0.0328 0.0266 0.0354 1932 HIS 575 CB -0.0476 0.0149 0.0271 1933 HIS 575 CG -0.0549 0.0134 0.0284 1934 HIS 575 CD2 -0.0546 0.0095 0.0234 1935 HIS 575 ND1 -0.0624 0.0162 0.0353 1936 HIS 575 CE1 -0.0665 0.0139 0.0342 1937 HIS 575 NE2 -0.0620 0.0099 0.0271 1938 THR 576 N -0.0250 0.0196 0.0231 1939 THR 576 CA -0.0189 0.0198 0.0207 1940 THR 576 C -0.0082 0.0208 0.0171 1941 THR 576 O -0.0057 0.0198 0.0148 1942 THR 576 CB -0.0229 0.0136 0.0145 1943 THR 576 CG2 -0.0336 0.0121 0.0174 1944 THR 576 OG1 -0.0219 0.0079 0.0068 1945 PHE 577 N -0.0018 0.0200 0.0080 1946 PHE 577 CA -0.0009 0.0210 0.0066 1947 PHE 577 C -0.0005 0.0214 0.0056 1948 PHE 577 O 0.0000 0.0219 0.0063 1949 PHE 577 CB 0.0003 0.0220 0.0076 1950 PHE 577 CG -0.0000 0.0216 0.0085 1951 PHE 577 CD1 -0.0005 0.0210 0.0102 1952 PHE 577 CD2 0.0001 0.0218 0.0077 1953 PHE 577 CE1 -0.0008 0.0206 0.0111 1954 PHE 577 CE2 -0.0003 0.0214 0.0085 1955 PHE 577 CZ -0.0007 0.0208 0.0102 1956 LEU 578 N -0.0009 0.0213 0.0038 1957 LEU 578 CA -0.0007 0.0215 0.0027 1958 LEU 578 C 0.0007 0.0229 0.0023 1959 LEU 578 O 0.0014 0.0236 0.0019 1960 LEU 578 CB -0.0016 0.0209 0.0010 1961 LEU 578 CG -0.0031 0.0195 0.0011 1962 LEU 578 CD1 -0.0038 0.0188 0.0020 1963 LEU 578 CD2 -0.0038 0.0191 -0.0007 1964 ASP 579 N 0.0040 0.0220 -0.0019 1965 ASP 579 CA 0.0054 0.0203 -0.0029 1966 ASP 579 C 0.0054 0.0198 -0.0040 1967 ASP 579 O 0.0067 0.0185 -0.0042 1968 ASP 579 CB 0.0054 0.0196 -0.0044 1969 ASP 579 CG 0.0037 0.0204 -0.0062 1970 ASP 579 OD1 0.0025 0.0215 -0.0062 1971 ASP 579 OD2 0.0036 0.0198 -0.0075 1972 SER 580 N 0.0039 0.0210 -0.0044 1973 SER 580 CA 0.0035 0.0208 -0.0055 1974 SER 580 C 0.0049 0.0200 -0.0046 1975 SER 580 O 0.0051 0.0207 -0.0027 1976 SER 580 CB 0.0017 0.0224 -0.0054 1977 SER 580 OG 0.0014 0.0223 -0.0065 1978 VAL 581 N 0.0041 0.0113 -0.0038 1979 VAL 581 CA 0.0056 0.0105 -0.0041 1980 VAL 581 C 0.0044 0.0099 -0.0058 1981 VAL 581 O 0.0040 0.0089 -0.0076 1982 VAL 581 CB 0.0078 0.0094 -0.0046 1983 VAL 581 CG1 0.0094 0.0086 -0.0050 1984 VAL 581 CG2 0.0090 0.0100 -0.0030 1985 GLU 582 N 0.0039 0.0104 -0.0053 1986 GLU 582 CA 0.0030 0.0098 -0.0068 1987 GLU 582 C 0.0048 0.0089 -0.0072 1988 GLU 582 O 0.0063 0.0092 -0.0058 1989 GLU 582 CB 0.0010 0.0109 -0.0062 1990 GLU 582 CG -0.0009 0.0118 -0.0059 1991 GLU 582 CD -0.0028 0.0129 -0.0054 1992 GLU 582 OE1 -0.0037 0.0124 -0.0066 1993 GLU 582 OE2 -0.0036 0.0141 -0.0039 1994 CYS 583 N -0.0016 -0.0004 -0.0106 1995 CYS 583 CA -0.0002 -0.0022 -0.0081 1996 CYS 583 C 0.0012 -0.0009 -0.0068 1997 CYS 583 O 0.0004 -0.0003 -0.0081 1998 CYS 583 CB -0.0015 -0.0055 -0.0085 1999 CYS 583 SG 0.0001 -0.0080 -0.0055 2000 TYR 584 N 0.0032 -0.0003 -0.0044 2001 TYR 584 CA 0.0046 0.0005 -0.0028 2002 TYR 584 C 0.0052 -0.0024 -0.0010 2003 TYR 584 O 0.0060 -0.0038 0.0006 2004 TYR 584 CB 0.0065 0.0029 -0.0013 2005 TYR 584 CG 0.0082 0.0039 0.0005 2006 TYR 584 CD1 0.0080 0.0058 -0.0005 2007 TYR 584 CD2 0.0100 0.0031 0.0032 2008 TYR 584 CE1 0.0096 0.0069 0.0012 2009 TYR 584 CE2 0.0116 0.0042 0.0049 2010 TYR 584 CZ 0.0114 0.0061 0.0039 2011 TYR 584 OH 0.0130 0.0072 0.0055 2012 ASP 585 N 0.0029 -0.0066 -0.0030 2013 ASP 585 CA 0.0036 -0.0105 0.0021 2014 ASP 585 C 0.0082 -0.0074 0.0065 2015 ASP 585 O 0.0096 -0.0044 0.0057 2016 ASP 585 CB 0.0007 -0.0137 0.0007 2017 ASP 585 CG 0.0007 -0.0185 0.0055 2018 ASP 585 OD1 0.0030 -0.0193 0.0100 2019 ASP 585 OD2 -0.0023 -0.0220 0.0042 2020 PRO 586 N 0.0106 -0.0079 0.0109 2021 PRO 586 CA 0.0151 -0.0049 0.0151 2022 PRO 586 C 0.0162 -0.0064 0.0183 2023 PRO 586 O 0.0194 -0.0028 0.0200 2024 PRO 586 CB 0.0165 -0.0066 0.0191 2025 PRO 586 CG 0.0127 -0.0125 0.0189 2026 PRO 586 CD 0.0092 -0.0120 0.0127 2027 ASP 587 N 0.0182 -0.0164 0.0300 2028 ASP 587 CA 0.0193 -0.0213 0.0354 2029 ASP 587 C 0.0182 -0.0171 0.0305 2030 ASP 587 O 0.0206 -0.0188 0.0349 2031 ASP 587 CB 0.0133 -0.0325 0.0375 2032 ASP 587 CG 0.0142 -0.0379 0.0432 2033 ASP 587 OD1 0.0194 -0.0332 0.0455 2034 ASP 587 OD2 0.0100 -0.0471 0.0457 2035 THR 588 N 0.0148 -0.0113 0.0216 2036 THR 588 CA 0.0140 -0.0060 0.0162 2037 THR 588 C 0.0186 0.0052 0.0125 2038 THR 588 O 0.0189 0.0102 0.0087 2039 THR 588 CB 0.0049 -0.0094 0.0082 2040 THR 588 CG2 -0.0004 -0.0204 0.0110 2041 THR 588 OG1 0.0009 -0.0072 0.0016 2042 ASP 589 N 0.0114 0.0057 0.0093 2043 ASP 589 CA 0.0122 0.0103 0.0073 2044 ASP 589 C 0.0103 0.0113 0.0010 2045 ASP 589 O 0.0110 0.0159 -0.0015 2046 ASP 589 CB 0.0149 0.0155 0.0102 2047 ASP 589 CG 0.0161 0.0202 0.0092 2048 ASP 589 OD1 0.0154 0.0188 0.0085 2049 ASP 589 OD2 0.0180 0.0249 0.0103 2050 THR 590 N 0.0079 0.0069 -0.0017 2051 THR 590 CA 0.0060 0.0075 -0.0077 2052 THR 590 C 0.0044 0.0045 -0.0095 2053 THR 590 O 0.0036 -0.0002 -0.0075 2054 THR 590 CB 0.0044 0.0060 -0.0110 2055 THR 590 CG2 0.0058 0.0091 -0.0098 2056 THR 590 OG1 0.0027 0.0003 -0.0104 2057 TRP 591 N 0.0012 0.0073 -0.0106 2058 TRP 591 CA 0.0012 0.0066 -0.0111 2059 TRP 591 C 0.0001 0.0055 -0.0135 2060 TRP 591 O -0.0010 0.0065 -0.0149 2061 TRP 591 CB 0.0009 0.0088 -0.0105 2062 TRP 591 CG 0.0020 0.0097 -0.0081 2063 TRP 591 CD1 0.0022 0.0114 -0.0070 2064 TRP 591 CD2 0.0031 0.0091 -0.0064 2065 TRP 591 CE2 0.0039 0.0104 -0.0044 2066 TRP 591 CE3 0.0036 0.0074 -0.0065 2067 TRP 591 NE1 0.0033 0.0118 -0.0048 2068 TRP 591 CZ2 0.0051 0.0101 -0.0024 2069 TRP 591 CZ3 0.0048 0.0071 -0.0046 2070 TRP 591 CH2 0.0055 0.0084 -0.0026 2071 SER 592 N 0.0002 0.0039 -0.0140 2072 SER 592 CA -0.0009 0.0032 -0.0162 2073 SER 592 C -0.0007 0.0027 -0.0162 2074 SER 592 O 0.0004 0.0020 -0.0146 2075 SER 592 CB -0.0009 0.0010 -0.0174 2076 SER 592 OG 0.0002 -0.0011 -0.0164 2077 GLU 593 N 0.0018 0.0096 -0.0103 2078 GLU 593 CA 0.0023 0.0098 -0.0098 2079 GLU 593 C 0.0030 0.0066 -0.0113 2080 GLU 593 O 0.0013 0.0054 -0.0135 2081 GLU 593 CB -0.0003 0.0120 -0.0103 2082 GLU 593 CG 0.0004 0.0125 -0.0094 2083 GLU 593 CD -0.0019 0.0151 -0.0096 2084 GLU 593 OE1 -0.0041 0.0146 -0.0117 2085 GLU 593 OE2 -0.0014 0.0173 -0.0077 2086 VAL 594 N 0.0057 0.0053 -0.0100 2087 VAL 594 CA 0.0069 0.0021 -0.0112 2088 VAL 594 C 0.0069 0.0018 -0.0114 2089 VAL 594 O 0.0068 -0.0005 -0.0130 2090 VAL 594 CB 0.0098 0.0006 -0.0098 2091 VAL 594 CG1 0.0098 0.0002 -0.0100 2092 VAL 594 CG2 0.0118 0.0022 -0.0071 2093 THR 595 N 0.0112 0.0079 -0.0070 2094 THR 595 CA 0.0105 0.0078 -0.0077 2095 THR 595 C 0.0098 0.0116 -0.0069 2096 THR 595 O 0.0101 0.0141 -0.0057 2097 THR 595 CB 0.0129 0.0054 -0.0065 2098 THR 595 CG2 0.0155 0.0068 -0.0037 2099 THR 595 OG1 0.0119 0.0047 -0.0076 2100 ARG 596 N 0.0091 0.0120 -0.0074 2101 ARG 596 CA 0.0090 0.0153 -0.0063 2102 ARG 596 C 0.0106 0.0143 -0.0052 2103 ARG 596 O 0.0106 0.0115 -0.0062 2104 ARG 596 CB 0.0059 0.0173 -0.0082 2105 ARG 596 CG 0.0045 0.0188 -0.0089 2106 ARG 596 CD 0.0014 0.0208 -0.0108 2107 ARG 596 NE 0.0001 0.0218 -0.0116 2108 ARG 596 CZ -0.0026 0.0225 -0.0137 2109 ARG 596 NH1 -0.0045 0.0227 -0.0153 2110 ARG 596 NH2 -0.0034 0.0229 -0.0143 2111 MET 597 N 0.0141 0.0181 -0.0061 2112 MET 597 CA 0.0151 0.0153 -0.0048 2113 MET 597 C 0.0174 0.0139 -0.0061 2114 MET 597 O 0.0176 0.0148 -0.0072 2115 MET 597 CB 0.0135 0.0144 -0.0022 2116 MET 597 CG 0.0114 0.0155 -0.0007 2117 MET 597 SD 0.0095 0.0142 0.0026 2118 MET 597 CE 0.0087 0.0156 0.0023 2119 THR 598 N 0.0188 0.0115 -0.0057 2120 THR 598 CA 0.0210 0.0099 -0.0068 2121 THR 598 C 0.0208 0.0092 -0.0059 2122 THR 598 O 0.0224 0.0083 -0.0070 2123 THR 598 CB 0.0223 0.0073 -0.0061 2124 THR 598 CG2 0.0229 0.0078 -0.0071 2125 THR 598 OG1 0.0210 0.0061 -0.0035 2126 SER 599 N 0.0185 0.0127 -0.0075 2127 SER 599 CA 0.0180 0.0122 -0.0066 2128 SER 599 C 0.0137 0.0145 -0.0036 2129 SER 599 O 0.0110 0.0143 -0.0007 2130 SER 599 CB 0.0196 0.0068 -0.0051 2131 SER 599 OG 0.0178 0.0040 -0.0016 2132 GLY 600 N 0.0131 0.0165 -0.0041 2133 GLY 600 CA 0.0092 0.0188 -0.0014 2134 GLY 600 C 0.0070 0.0153 0.0028 2135 GLY 600 O 0.0087 0.0115 0.0034 2136 ARG 601 N 0.0047 0.0136 -0.0017 2137 ARG 601 CA 0.0037 0.0120 0.0012 2138 ARG 601 C 0.0013 0.0138 0.0031 2139 ARG 601 O 0.0006 0.0158 0.0025 2140 ARG 601 CB 0.0048 0.0094 0.0018 2141 ARG 601 CG 0.0046 0.0103 0.0013 2142 ARG 601 CD 0.0060 0.0078 0.0013 2143 ARG 601 NE 0.0081 0.0072 -0.0014 2144 ARG 601 CZ 0.0095 0.0061 -0.0023 2145 ARG 601 NH1 0.0090 0.0052 -0.0010 2146 ARG 601 NH2 0.0113 0.0058 -0.0048 2147 SER 602 N 0.0001 0.0130 0.0055 2148 SER 602 CA -0.0022 0.0143 0.0077 2149 SER 602 C -0.0026 0.0122 0.0102 2150 SER 602 O -0.0014 0.0097 0.0106 2151 SER 602 CB -0.0035 0.0156 0.0086 2152 SER 602 OG -0.0032 0.0134 0.0100 2153 GLY 603 N -0.0019 0.0067 0.0057 2154 GLY 603 CA -0.0029 0.0049 0.0084 2155 GLY 603 C -0.0023 0.0027 0.0084 2156 GLY 603 O -0.0023 0.0002 0.0097 2157 VAL 604 N -0.0016 0.0035 0.0068 2158 VAL 604 CA -0.0011 0.0017 0.0068 2159 VAL 604 C -0.0026 0.0019 0.0095 2160 VAL 604 O -0.0038 0.0042 0.0104 2161 VAL 604 CB 0.0000 0.0028 0.0043 2162 VAL 604 CG1 0.0016 0.0027 0.0016 2163 VAL 604 CG2 -0.0008 0.0060 0.0042 2164 GLY 605 N 0.0010 -0.0054 0.0090 2165 GLY 605 CA 0.0002 -0.0046 0.0086 2166 GLY 605 C 0.0010 -0.0033 0.0072 2167 GLY 605 O 0.0025 -0.0033 0.0066 2168 VAL 606 N -0.0001 -0.0022 0.0065 2169 VAL 606 CA 0.0006 -0.0009 0.0052 2170 VAL 606 C -0.0004 -0.0002 0.0048 2171 VAL 606 O -0.0020 -0.0002 0.0054 2172 VAL 606 CB 0.0005 0.0000 0.0043 2173 VAL 606 CG1 -0.0013 0.0005 0.0045 2174 VAL 606 CG2 0.0011 0.0014 0.0029 2175 ALA 607 N 0.0013 -0.0025 0.0022 2176 ALA 607 CA 0.0020 -0.0026 0.0001 2177 ALA 607 C 0.0020 -0.0023 0.0004 2178 ALA 607 O 0.0014 -0.0019 0.0022 2179 ALA 607 CB 0.0030 -0.0008 -0.0012 2180 VAL 608 N 0.0026 -0.0025 -0.0013 2181 VAL 608 CA 0.0026 -0.0023 -0.0013 2182 VAL 608 C 0.0036 -0.0007 -0.0028 2183 VAL 608 O 0.0042 -0.0010 -0.0047 2184 VAL 608 CB 0.0021 -0.0045 -0.0017 2185 VAL 608 CG1 0.0023 -0.0044 -0.0020 2186 VAL 608 CG2 0.0011 -0.0059 0.0001 2187 THR 609 N 0.0011 0.0008 -0.0051 2188 THR 609 CA 0.0001 0.0038 -0.0063 2189 THR 609 C 0.0020 0.0067 -0.0049 2190 THR 609 O 0.0042 0.0061 -0.0029 2191 THR 609 CB -0.0010 0.0031 -0.0073 2192 THR 609 CG2 0.0008 0.0026 -0.0056 2193 THR 609 OG1 -0.0024 0.0057 -0.0088 2194 THR 609 OXT 0.0013 0.0092 -0.0059 2195 LEU 1 N -0.0112 0.0166 0.0035 2196 LEU 1 CA -0.0103 0.0160 0.0017 2197 LEU 1 C -0.0094 0.0173 0.0006 2198 LEU 1 O -0.0090 0.0189 0.0004 2199 LEU 1 CB -0.0105 0.0139 0.0013 2200 LEU 1 CG -0.0112 0.0134 0.0024 2201 LEU 1 CD1 -0.0107 0.0140 0.0017 2202 LEU 1 CD2 -0.0116 0.0112 0.0025 2203 ALA 2 N -0.0091 0.0165 -0.0003 2204 ALA 2 CA -0.0082 0.0175 -0.0015 2205 ALA 2 C -0.0085 0.0174 -0.0010 2206 ALA 2 O -0.0084 0.0189 -0.0008 2207 ALA 2 CB -0.0074 0.0167 -0.0033 2208 GLU 3 N -0.0154 0.0122 -0.0138 2209 GLU 3 CA -0.0146 0.0137 -0.0141 2210 GLU 3 C -0.0131 0.0136 -0.0140 2211 GLU 3 O -0.0128 0.0143 -0.0141 2212 GLU 3 CB -0.0146 0.0144 -0.0143 2213 GLU 3 CG -0.0136 0.0158 -0.0146 2214 GLU 3 CD -0.0119 0.0155 -0.0144 2215 GLU 3 OE1 -0.0115 0.0145 -0.0141 2216 GLU 3 OE2 -0.0110 0.0164 -0.0145 2217 GLU 4 N -0.0121 0.0128 -0.0137 2218 GLU 4 CA -0.0105 0.0126 -0.0135 2219 GLU 4 C -0.0105 0.0119 -0.0133 2220 GLU 4 O -0.0096 0.0122 -0.0133 2221 GLU 4 CB -0.0096 0.0118 -0.0131 2222 GLU 4 CG -0.0093 0.0126 -0.0133 2223 GLU 4 CD -0.0082 0.0119 -0.0130 2224 GLU 4 OE1 -0.0080 0.0105 -0.0126 2225 GLU 4 OE2 -0.0076 0.0126 -0.0132 2226 TYR 5 N -0.0104 0.0148 -0.0157 2227 TYR 5 CA -0.0082 0.0093 -0.0124 2228 TYR 5 C -0.0066 0.0056 -0.0115 2229 TYR 5 O -0.0041 0.0004 -0.0112 2230 TYR 5 CB -0.0094 0.0099 -0.0067 2231 TYR 5 CG -0.0087 0.0091 -0.0090 2232 TYR 5 CD1 -0.0107 0.0138 -0.0109 2233 TYR 5 CD2 -0.0058 0.0038 -0.0106 2234 TYR 5 CE1 -0.0097 0.0130 -0.0144 2235 TYR 5 CE2 -0.0049 0.0030 -0.0142 2236 TYR 5 CZ -0.0068 0.0076 -0.0162 2237 TYR 5 OH -0.0058 0.0067 -0.0198 2238 GLY 6 N -0.0081 0.0084 -0.0106 2239 GLY 6 CA -0.0067 0.0054 -0.0097 2240 GLY 6 C -0.0044 0.0024 -0.0157 2241 GLY 6 O -0.0018 -0.0028 -0.0157 2242 GLU 7 N -0.0035 -0.0024 -0.0282 2243 GLU 7 CA -0.0011 -0.0040 -0.0334 2244 GLU 7 C 0.0021 -0.0067 -0.0324 2245 GLU 7 O 0.0057 -0.0095 -0.0348 2246 GLU 7 CB -0.0042 -0.0013 -0.0378 2247 GLU 7 CG -0.0048 -0.0005 -0.0422 2248 GLU 7 CD -0.0031 -0.0016 -0.0479 2249 GLU 7 OE1 -0.0031 -0.0016 -0.0490 2250 GLU 7 OE2 -0.0018 -0.0025 -0.0512 2251 PHE 8 N 0.0008 -0.0058 -0.0290 2252 PHE 8 CA 0.0036 -0.0082 -0.0276 2253 PHE 8 C 0.0076 -0.0116 -0.0248 2254 PHE 8 O 0.0107 -0.0142 -0.0246 2255 PHE 8 CB 0.0012 -0.0065 -0.0236 2256 PHE 8 CG -0.0017 -0.0040 -0.0264 2257 PHE 8 CD1 -0.0030 -0.0030 -0.0236 2258 PHE 8 CD2 -0.0031 -0.0025 -0.0316 2259 PHE 8 CE1 -0.0058 -0.0007 -0.0260 2260 PHE 8 CE2 -0.0059 -0.0001 -0.0342 2261 PHE 8 CZ -0.0071 0.0008 -0.0313 2262 LEU 9 N 0.0026 -0.0140 -0.0276 2263 LEU 9 CA 0.0061 -0.0217 -0.0215 2264 LEU 9 C 0.0093 -0.0275 -0.0260 2265 LEU 9 O 0.0133 -0.0355 -0.0243 2266 LEU 9 CB 0.0039 -0.0189 -0.0114 2267 LEU 9 CG 0.0007 -0.0133 -0.0057 2268 LEU 9 CD1 -0.0015 -0.0102 0.0031 2269 LEU 9 CD2 0.0030 -0.0183 -0.0028 2270 LEU 9 OXT 0.0079 -0.0239 -0.0311