1 GLY 325 N -0.0170 0.0110 0.0178 2 GLY 325 CA -0.0133 0.0100 0.0143 3 GLY 325 C -0.0121 0.0112 0.0069 4 GLY 325 O -0.0158 0.0136 0.0047 5 ARG 326 N -0.0069 0.0095 0.0034 6 ARG 326 CA -0.0049 0.0102 -0.0035 7 ARG 326 C -0.0036 0.0097 -0.0038 8 ARG 326 O -0.0018 0.0076 0.0011 9 ARG 326 CB 0.0009 0.0081 -0.0064 10 ARG 326 CG -0.0002 0.0085 -0.0059 11 ARG 326 CD 0.0039 0.0078 -0.0114 12 ARG 326 NE 0.0024 0.0086 -0.0114 13 ARG 326 CZ -0.0021 0.0115 -0.0145 14 ARG 326 NH1 -0.0028 0.0118 -0.0143 15 ARG 326 NH2 -0.0060 0.0142 -0.0177 16 LEU 327 N 0.0007 0.0043 -0.0060 17 LEU 327 CA 0.0014 0.0041 -0.0067 18 LEU 327 C 0.0027 0.0037 -0.0081 19 LEU 327 O 0.0025 0.0037 -0.0089 20 LEU 327 CB -0.0000 0.0043 -0.0074 21 LEU 327 CG -0.0014 0.0047 -0.0062 22 LEU 327 CD1 -0.0027 0.0050 -0.0071 23 LEU 327 CD2 -0.0007 0.0047 -0.0048 24 ILE 328 N 0.0039 0.0034 -0.0083 25 ILE 328 CA 0.0050 0.0031 -0.0098 26 ILE 328 C 0.0042 0.0032 -0.0113 27 ILE 328 O 0.0041 0.0032 -0.0112 28 ILE 328 CB 0.0067 0.0027 -0.0093 29 ILE 328 CG1 0.0076 0.0026 -0.0080 30 ILE 328 CG2 0.0078 0.0024 -0.0109 31 ILE 328 CD1 0.0092 0.0024 -0.0072 32 TYR 329 N 0.0034 0.0026 -0.0100 33 TYR 329 CA 0.0035 0.0027 -0.0097 34 TYR 329 C 0.0037 0.0005 -0.0097 35 TYR 329 O 0.0033 -0.0006 -0.0112 36 TYR 329 CB 0.0028 0.0039 -0.0113 37 TYR 329 CG 0.0026 0.0062 -0.0113 38 TYR 329 CD1 0.0023 0.0068 -0.0121 39 TYR 329 CD2 0.0029 0.0077 -0.0103 40 TYR 329 CE1 0.0021 0.0088 -0.0119 41 TYR 329 CE2 0.0027 0.0097 -0.0102 42 TYR 329 CZ 0.0024 0.0103 -0.0110 43 TYR 329 OH 0.0023 0.0123 -0.0108 44 THR 330 N 0.0043 -0.0000 -0.0083 45 THR 330 CA 0.0045 -0.0019 -0.0083 46 THR 330 C 0.0045 -0.0013 -0.0082 47 THR 330 O 0.0048 -0.0000 -0.0070 48 THR 330 CB 0.0052 -0.0034 -0.0068 49 THR 330 CG2 0.0059 -0.0026 -0.0047 50 THR 330 OG1 0.0053 -0.0052 -0.0069 51 ALA 331 N 0.0057 -0.0011 -0.0014 52 ALA 331 CA 0.0061 -0.0003 -0.0009 53 ALA 331 C 0.0057 -0.0020 0.0002 54 ALA 331 O 0.0050 -0.0037 -0.0007 55 ALA 331 CB 0.0061 0.0007 -0.0029 56 GLY 332 N 0.0061 -0.0015 0.0019 57 GLY 332 CA 0.0059 -0.0029 0.0030 58 GLY 332 C 0.0054 -0.0049 0.0040 59 GLY 332 O 0.0056 -0.0049 0.0051 60 GLY 333 N 0.0081 -0.0094 0.0061 61 GLY 333 CA 0.0061 -0.0099 0.0066 62 GLY 333 C 0.0033 -0.0058 0.0071 63 GLY 333 O 0.0034 -0.0023 0.0069 64 TYR 334 N 0.0011 -0.0061 0.0075 65 TYR 334 CA -0.0014 -0.0023 0.0080 66 TYR 334 C -0.0059 -0.0039 0.0090 67 TYR 334 O -0.0062 -0.0068 0.0091 68 TYR 334 CB 0.0013 -0.0003 0.0073 69 TYR 334 CG -0.0008 0.0038 0.0077 70 TYR 334 CD1 -0.0039 0.0032 0.0083 71 TYR 334 CD2 0.0006 0.0081 0.0073 72 TYR 334 CE1 -0.0054 0.0071 0.0086 73 TYR 334 CE2 -0.0011 0.0120 0.0075 74 TYR 334 CZ -0.0040 0.0114 0.0082 75 TYR 334 OH -0.0057 0.0150 0.0084 76 PHE 335 N -0.0087 -0.0097 0.0177 77 PHE 335 CA -0.0222 -0.0038 0.0080 78 PHE 335 C -0.0263 0.0034 0.0069 79 PHE 335 O -0.0251 -0.0046 0.0053 80 PHE 335 CB -0.0291 -0.0170 -0.0021 81 PHE 335 CG -0.0431 -0.0116 -0.0124 82 PHE 335 CD1 -0.0480 -0.0032 -0.0138 83 PHE 335 CD2 -0.0514 -0.0155 -0.0207 84 PHE 335 CE1 -0.0609 0.0010 -0.0236 85 PHE 335 CE2 -0.0644 -0.0112 -0.0305 86 PHE 335 CZ -0.0691 -0.0031 -0.0320 87 ARG 336 N -0.0305 0.0190 0.0083 88 ARG 336 CA -0.0330 0.0292 0.0094 89 ARG 336 C -0.0213 0.0308 0.0200 90 ARG 336 O -0.0199 0.0438 0.0253 91 ARG 336 CB -0.0431 0.0245 -0.0008 92 ARG 336 CG -0.0546 0.0206 -0.0119 93 ARG 336 CD -0.0603 0.0329 -0.0128 94 ARG 336 NE -0.0723 0.0301 -0.0240 95 ARG 336 CZ -0.0772 0.0341 -0.0269 96 ARG 336 NH1 -0.0712 0.0402 -0.0198 97 ARG 336 NH2 -0.0884 0.0323 -0.0371 98 GLN 337 N -0.0008 0.0049 0.0236 99 GLN 337 CA 0.0017 0.0071 0.0218 100 GLN 337 C 0.0031 0.0070 0.0167 101 GLN 337 O 0.0023 0.0056 0.0149 102 GLN 337 CB 0.0044 0.0108 0.0246 103 GLN 337 CG 0.0061 0.0125 0.0244 104 GLN 337 CD 0.0084 0.0159 0.0278 105 GLN 337 NE2 0.0100 0.0176 0.0280 106 GLN 337 OE1 0.0085 0.0169 0.0306 107 SER 338 N 0.0051 0.0084 0.0144 108 SER 338 CA 0.0071 0.0091 0.0098 109 SER 338 C 0.0096 0.0117 0.0099 110 SER 338 O 0.0109 0.0141 0.0132 111 SER 338 CB 0.0089 0.0104 0.0079 112 SER 338 OG 0.0066 0.0079 0.0074 113 LEU 339 N 0.0031 0.0018 0.0090 114 LEU 339 CA 0.0031 0.0021 0.0093 115 LEU 339 C 0.0059 0.0034 0.0073 116 LEU 339 O 0.0077 0.0029 0.0052 117 LEU 339 CB 0.0014 -0.0011 0.0090 118 LEU 339 CG -0.0015 -0.0026 0.0108 119 LEU 339 CD1 -0.0028 -0.0059 0.0101 120 LEU 339 CD2 -0.0031 -0.0007 0.0137 121 SER 340 N 0.0061 0.0048 0.0080 122 SER 340 CA 0.0086 0.0060 0.0062 123 SER 340 C 0.0087 0.0039 0.0049 124 SER 340 O 0.0107 0.0046 0.0033 125 SER 340 CB 0.0091 0.0093 0.0078 126 SER 340 OG 0.0091 0.0113 0.0092 127 TYR 341 N 0.0058 0.0016 0.0052 128 TYR 341 CA 0.0065 0.0025 0.0026 129 TYR 341 C 0.0061 0.0031 -0.0012 130 TYR 341 O 0.0038 0.0017 -0.0023 131 TYR 341 CB 0.0045 0.0012 0.0027 132 TYR 341 CG 0.0044 0.0004 0.0062 133 TYR 341 CD1 0.0070 0.0018 0.0085 134 TYR 341 CD2 0.0017 -0.0016 0.0072 135 TYR 341 CE1 0.0070 0.0011 0.0117 136 TYR 341 CE2 0.0016 -0.0022 0.0104 137 TYR 341 CZ 0.0043 -0.0009 0.0126 138 TYR 341 OH 0.0042 -0.0015 0.0156 139 LEU 342 N 0.0082 0.0049 -0.0032 140 LEU 342 CA 0.0078 0.0053 -0.0070 141 LEU 342 C 0.0083 0.0059 -0.0081 142 LEU 342 O 0.0107 0.0073 -0.0072 143 LEU 342 CB 0.0097 0.0069 -0.0086 144 LEU 342 CG 0.0095 0.0076 -0.0127 145 LEU 342 CD1 0.0066 0.0060 -0.0144 146 LEU 342 CD2 0.0120 0.0095 -0.0139 147 GLU 343 N 0.0049 -0.0014 -0.0144 148 GLU 343 CA 0.0049 -0.0013 -0.0156 149 GLU 343 C 0.0041 -0.0015 -0.0187 150 GLU 343 O 0.0025 -0.0025 -0.0196 151 GLU 343 CB 0.0033 -0.0025 -0.0138 152 GLU 343 CG 0.0043 -0.0022 -0.0106 153 GLU 343 CD 0.0026 -0.0034 -0.0089 154 GLU 343 OE1 0.0005 -0.0049 -0.0086 155 GLU 343 OE2 0.0035 -0.0030 -0.0073 156 ALA 344 N 0.0053 -0.0006 -0.0205 157 ALA 344 CA 0.0047 -0.0007 -0.0235 158 ALA 344 C 0.0037 -0.0013 -0.0242 159 ALA 344 O 0.0049 -0.0005 -0.0235 160 ALA 344 CB 0.0068 0.0009 -0.0253 161 TYR 345 N -0.0060 -0.0004 -0.0257 162 TYR 345 CA -0.0040 -0.0011 -0.0212 163 TYR 345 C -0.0050 -0.0017 -0.0165 164 TYR 345 O -0.0040 -0.0018 -0.0165 165 TYR 345 CB 0.0016 -0.0016 -0.0220 166 TYR 345 CG 0.0042 -0.0023 -0.0176 167 TYR 345 CD1 0.0029 -0.0024 -0.0162 168 TYR 345 CD2 0.0080 -0.0030 -0.0149 169 TYR 345 CE1 0.0054 -0.0031 -0.0123 170 TYR 345 CE2 0.0105 -0.0038 -0.0110 171 TYR 345 CZ 0.0092 -0.0038 -0.0096 172 TYR 345 OH 0.0116 -0.0045 -0.0059 173 ASN 346 N -0.0066 -0.0020 -0.0125 174 ASN 346 CA -0.0070 -0.0027 -0.0075 175 ASN 346 C -0.0026 -0.0035 -0.0042 176 ASN 346 O -0.0028 -0.0037 -0.0022 177 ASN 346 CB -0.0122 -0.0025 -0.0052 178 ASN 346 CG -0.0132 -0.0030 -0.0001 179 ASN 346 ND2 -0.0178 -0.0029 0.0017 180 ASN 346 OD1 -0.0100 -0.0036 0.0020 181 PRO 347 N 0.0023 0.0006 0.0019 182 PRO 347 CA 0.0123 0.0015 0.0085 183 PRO 347 C 0.0103 0.0027 0.0202 184 PRO 347 O 0.0182 0.0034 0.0255 185 PRO 347 CB 0.0184 0.0016 0.0090 186 PRO 347 CG 0.0142 0.0004 -0.0013 187 PRO 347 CD 0.0021 0.0002 -0.0020 188 SER 348 N 0.0000 0.0031 0.0245 189 SER 348 CA -0.0027 0.0043 0.0358 190 SER 348 C -0.0046 0.0044 0.0372 191 SER 348 O -0.0034 0.0054 0.0464 192 SER 348 CB -0.0125 0.0047 0.0405 193 SER 348 OG -0.0227 0.0039 0.0349 194 ASP 349 N -0.0064 -0.0011 0.0246 195 ASP 349 CA -0.0085 -0.0022 0.0205 196 ASP 349 C -0.0021 -0.0009 0.0084 197 ASP 349 O -0.0020 -0.0011 0.0046 198 ASP 349 CB -0.0216 -0.0070 0.0200 199 ASP 349 CG -0.0279 -0.0100 0.0109 200 ASP 349 OD1 -0.0222 -0.0086 0.0025 201 ASP 349 OD2 -0.0383 -0.0136 0.0130 202 GLY 350 N 0.0040 0.0009 0.0028 203 GLY 350 CA 0.0108 0.0025 -0.0085 204 GLY 350 C 0.0038 -0.0010 -0.0201 205 GLY 350 O 0.0085 -0.0001 -0.0298 206 THR 351 N -0.0058 -0.0137 -0.0255 207 THR 351 CA -0.0059 -0.0143 -0.0258 208 THR 351 C -0.0053 -0.0133 -0.0243 209 THR 351 O -0.0046 -0.0130 -0.0227 210 THR 351 CB -0.0056 -0.0166 -0.0261 211 THR 351 CG2 -0.0062 -0.0176 -0.0277 212 THR 351 OG1 -0.0046 -0.0176 -0.0245 213 TRP 352 N -0.0057 -0.0129 -0.0249 214 TRP 352 CA -0.0052 -0.0124 -0.0237 215 TRP 352 C -0.0049 -0.0142 -0.0237 216 TRP 352 O -0.0054 -0.0151 -0.0252 217 TRP 352 CB -0.0059 -0.0105 -0.0243 218 TRP 352 CG -0.0060 -0.0085 -0.0239 219 TRP 352 CD1 -0.0067 -0.0076 -0.0250 220 TRP 352 CD2 -0.0054 -0.0072 -0.0221 221 TRP 352 CE2 -0.0058 -0.0055 -0.0223 222 TRP 352 CE3 -0.0045 -0.0073 -0.0204 223 TRP 352 NE1 -0.0066 -0.0058 -0.0240 224 TRP 352 CZ2 -0.0054 -0.0040 -0.0209 225 TRP 352 CZ3 -0.0041 -0.0058 -0.0190 226 TRP 352 CH2 -0.0045 -0.0041 -0.0192 227 LEU 353 N 0.0110 0.0009 -0.0252 228 LEU 353 CA 0.0151 0.0051 -0.0236 229 LEU 353 C 0.0148 0.0051 -0.0203 230 LEU 353 O 0.0133 0.0034 -0.0225 231 LEU 353 CB 0.0180 0.0074 -0.0290 232 LEU 353 CG 0.0223 0.0116 -0.0288 233 LEU 353 CD1 0.0251 0.0139 -0.0336 234 LEU 353 CD2 0.0243 0.0142 -0.0232 235 ARG 354 N 0.0165 0.0073 -0.0153 236 ARG 354 CA 0.0171 0.0082 -0.0125 237 ARG 354 C 0.0212 0.0120 -0.0147 238 ARG 354 O 0.0243 0.0151 -0.0149 239 ARG 354 CB 0.0168 0.0086 -0.0059 240 ARG 354 CG 0.0174 0.0095 -0.0030 241 ARG 354 CD 0.0141 0.0068 0.0019 242 ARG 354 NE 0.0152 0.0081 0.0048 243 ARG 354 CZ 0.0156 0.0091 0.0103 244 ARG 354 NH1 0.0149 0.0089 0.0141 245 ARG 354 NH2 0.0165 0.0103 0.0122 246 LEU 355 N 0.0195 0.0126 -0.0163 247 LEU 355 CA 0.0197 0.0128 -0.0164 248 LEU 355 C 0.0199 0.0117 -0.0149 249 LEU 355 O 0.0202 0.0109 -0.0139 250 LEU 355 CB 0.0181 0.0131 -0.0174 251 LEU 355 CG 0.0181 0.0143 -0.0189 252 LEU 355 CD1 0.0163 0.0145 -0.0198 253 LEU 355 CD2 0.0195 0.0153 -0.0196 254 ALA 356 N 0.0199 0.0116 -0.0149 255 ALA 356 CA 0.0201 0.0106 -0.0135 256 ALA 356 C 0.0186 0.0095 -0.0127 257 ALA 356 O 0.0171 0.0095 -0.0132 258 ALA 356 CB 0.0201 0.0108 -0.0138 259 ASP 357 N 0.0152 0.0134 0.0007 260 ASP 357 CA 0.0139 0.0113 0.0016 261 ASP 357 C 0.0122 0.0106 0.0010 262 ASP 357 O 0.0126 0.0113 0.0007 263 ASP 357 CB 0.0153 0.0100 0.0036 264 ASP 357 CG 0.0163 0.0100 0.0043 265 ASP 357 OD1 0.0159 0.0108 0.0034 266 ASP 357 OD2 0.0176 0.0091 0.0059 267 LEU 358 N 0.0104 0.0092 0.0009 268 LEU 358 CA 0.0088 0.0081 0.0007 269 LEU 358 C 0.0098 0.0071 0.0022 270 LEU 358 O 0.0107 0.0060 0.0038 271 LEU 358 CB 0.0070 0.0065 0.0009 272 LEU 358 CG 0.0055 0.0072 -0.0007 273 LEU 358 CD1 0.0045 0.0056 -0.0001 274 LEU 358 CD2 0.0038 0.0075 -0.0022 275 GLN 359 N 0.0044 0.0083 0.0025 276 GLN 359 CA 0.0040 0.0075 0.0018 277 GLN 359 C 0.0045 0.0073 0.0011 278 GLN 359 O 0.0044 0.0067 0.0004 279 GLN 359 CB 0.0030 0.0072 0.0023 280 GLN 359 CG 0.0025 0.0073 0.0030 281 GLN 359 CD 0.0015 0.0068 0.0032 282 GLN 359 NE2 0.0010 0.0065 0.0034 283 GLN 359 OE1 0.0012 0.0066 0.0032 284 VAL 360 N 0.0050 0.0078 0.0013 285 VAL 360 CA 0.0056 0.0078 0.0007 286 VAL 360 C 0.0065 0.0086 0.0009 287 VAL 360 O 0.0064 0.0091 0.0016 288 VAL 360 CB 0.0052 0.0076 0.0008 289 VAL 360 CG1 0.0058 0.0076 0.0002 290 VAL 360 CG2 0.0043 0.0069 0.0007 291 PRO 361 N 0.0023 0.0088 0.0042 292 PRO 361 CA 0.0038 0.0072 0.0056 293 PRO 361 C 0.0045 0.0057 0.0041 294 PRO 361 O 0.0043 0.0050 0.0019 295 PRO 361 CB 0.0048 0.0062 0.0064 296 PRO 361 CG 0.0037 0.0076 0.0061 297 PRO 361 CD 0.0023 0.0088 0.0042 298 ARG 362 N 0.0053 0.0050 0.0052 299 ARG 362 CA 0.0060 0.0035 0.0039 300 ARG 362 C 0.0076 0.0018 0.0054 301 ARG 362 O 0.0079 0.0023 0.0074 302 ARG 362 CB 0.0051 0.0046 0.0034 303 ARG 362 CG 0.0034 0.0067 0.0025 304 ARG 362 CD 0.0026 0.0066 -0.0001 305 ARG 362 NE 0.0025 0.0062 -0.0016 306 ARG 362 CZ 0.0014 0.0076 -0.0019 307 ARG 362 NH1 0.0004 0.0095 -0.0009 308 ARG 362 NH2 0.0014 0.0071 -0.0032 309 SER 363 N 0.0099 0.0013 0.0032 310 SER 363 CA 0.0110 -0.0014 0.0041 311 SER 363 C 0.0135 -0.0024 0.0021 312 SER 363 O 0.0143 -0.0010 0.0000 313 SER 363 CB 0.0102 -0.0018 0.0052 314 SER 363 OG 0.0110 -0.0007 0.0036 315 GLY 364 N 0.0147 -0.0050 0.0027 316 GLY 364 CA 0.0171 -0.0062 0.0010 317 GLY 364 C 0.0178 -0.0055 -0.0004 318 GLY 364 O 0.0196 -0.0057 -0.0023 319 LEU 365 N 0.0121 -0.0059 0.0008 320 LEU 365 CA 0.0103 -0.0049 0.0010 321 LEU 365 C 0.0112 -0.0049 0.0031 322 LEU 365 O 0.0128 -0.0053 0.0047 323 LEU 365 CB 0.0079 -0.0036 0.0016 324 LEU 365 CG 0.0078 -0.0029 0.0044 325 LEU 365 CD1 0.0052 -0.0015 0.0049 326 LEU 365 CD2 0.0092 -0.0035 0.0049 327 ALA 366 N 0.0098 -0.0041 0.0033 328 ALA 366 CA 0.0099 -0.0037 0.0056 329 ALA 366 C 0.0075 -0.0022 0.0068 330 ALA 366 O 0.0056 -0.0016 0.0056 331 ALA 366 CB 0.0107 -0.0042 0.0049 332 GLY 367 N 0.0012 -0.0063 0.0041 333 GLY 367 CA 0.0001 -0.0049 0.0048 334 GLY 367 C -0.0012 -0.0039 0.0052 335 GLY 367 O -0.0006 -0.0037 0.0054 336 CYS 368 N -0.0029 -0.0031 0.0053 337 CYS 368 CA -0.0039 -0.0018 0.0060 338 CYS 368 C -0.0052 -0.0006 0.0065 339 CYS 368 O -0.0052 -0.0009 0.0063 340 CYS 368 CB -0.0051 -0.0024 0.0052 341 CYS 368 SG -0.0070 -0.0035 0.0040 342 VAL 369 N -0.0076 -0.0030 0.0016 343 VAL 369 CA -0.0065 -0.0019 0.0008 344 VAL 369 C -0.0081 -0.0015 0.0002 345 VAL 369 O -0.0099 -0.0009 -0.0005 346 VAL 369 CB -0.0054 -0.0002 -0.0004 347 VAL 369 CG1 -0.0045 0.0012 -0.0014 348 VAL 369 CG2 -0.0033 -0.0006 0.0003 349 VAL 370 N -0.0074 -0.0016 0.0004 350 VAL 370 CA -0.0085 -0.0009 -0.0003 351 VAL 370 C -0.0067 0.0002 -0.0009 352 VAL 370 O -0.0049 -0.0003 -0.0002 353 VAL 370 CB -0.0097 -0.0024 0.0007 354 VAL 370 CG1 -0.0110 -0.0016 -0.0002 355 VAL 370 CG2 -0.0113 -0.0036 0.0014 356 GLY 371 N -0.0045 0.0046 -0.0084 357 GLY 371 CA -0.0065 0.0079 -0.0074 358 GLY 371 C -0.0057 0.0094 -0.0044 359 GLY 371 O -0.0073 0.0118 -0.0040 360 GLY 372 N -0.0032 0.0080 -0.0022 361 GLY 372 CA -0.0021 0.0090 0.0006 362 GLY 372 C -0.0013 0.0077 0.0002 363 GLY 372 O 0.0001 0.0079 0.0026 364 LEU 373 N -0.0048 0.0091 0.0002 365 LEU 373 CA -0.0042 0.0079 0.0003 366 LEU 373 C -0.0043 0.0080 0.0003 367 LEU 373 O -0.0052 0.0085 0.0006 368 LEU 373 CB -0.0049 0.0067 0.0010 369 LEU 373 CG -0.0049 0.0065 0.0011 370 LEU 373 CD1 -0.0056 0.0054 0.0018 371 LEU 373 CD2 -0.0036 0.0062 0.0005 372 LEU 374 N -0.0033 0.0076 -0.0001 373 LEU 374 CA -0.0032 0.0075 -0.0001 374 LEU 374 C -0.0036 0.0062 0.0005 375 LEU 374 O -0.0031 0.0051 0.0006 376 LEU 374 CB -0.0019 0.0075 -0.0008 377 LEU 374 CG -0.0015 0.0072 -0.0008 378 LEU 374 CD1 -0.0021 0.0083 -0.0009 379 LEU 374 CD2 -0.0001 0.0071 -0.0015 380 TYR 375 N -0.0082 0.0045 0.0033 381 TYR 375 CA -0.0084 0.0040 0.0035 382 TYR 375 C -0.0080 0.0044 0.0030 383 TYR 375 O -0.0079 0.0053 0.0029 384 TYR 375 CB -0.0090 0.0042 0.0044 385 TYR 375 CG -0.0094 0.0036 0.0050 386 TYR 375 CD1 -0.0095 0.0041 0.0052 387 TYR 375 CD2 -0.0096 0.0027 0.0053 388 TYR 375 CE1 -0.0099 0.0036 0.0058 389 TYR 375 CE2 -0.0100 0.0022 0.0058 390 TYR 375 CZ -0.0101 0.0027 0.0061 391 TYR 375 OH -0.0105 0.0022 0.0066 392 ALA 376 N -0.0078 0.0037 0.0027 393 ALA 376 CA -0.0075 0.0039 0.0023 394 ALA 376 C -0.0079 0.0036 0.0028 395 ALA 376 O -0.0080 0.0027 0.0030 396 ALA 376 CB -0.0070 0.0033 0.0015 397 VAL 377 N -0.0015 0.0014 0.0059 398 VAL 377 CA -0.0015 0.0006 0.0038 399 VAL 377 C 0.0008 -0.0006 0.0018 400 VAL 377 O 0.0033 -0.0007 0.0026 401 VAL 377 CB -0.0010 0.0010 0.0050 402 VAL 377 CG1 -0.0020 0.0003 0.0030 403 VAL 377 CG2 -0.0026 0.0023 0.0076 404 GLY 378 N 0.0000 -0.0016 -0.0009 405 GLY 378 CA 0.0021 -0.0027 -0.0030 406 GLY 378 C 0.0038 -0.0030 -0.0030 407 GLY 378 O 0.0026 -0.0027 -0.0027 408 GLY 379 N 0.0143 -0.0022 -0.0042 409 GLY 379 CA 0.0145 -0.0023 -0.0040 410 GLY 379 C 0.0139 -0.0011 -0.0076 411 GLY 379 O 0.0146 -0.0005 -0.0106 412 ARG 380 N 0.0126 -0.0007 -0.0075 413 ARG 380 CA 0.0114 0.0006 -0.0106 414 ARG 380 C 0.0085 0.0011 -0.0093 415 ARG 380 O 0.0086 0.0003 -0.0062 416 ARG 380 CB 0.0147 0.0001 -0.0128 417 ARG 380 CG 0.0165 -0.0010 -0.0108 418 ARG 380 CD 0.0200 -0.0015 -0.0132 419 ARG 380 NE 0.0218 -0.0024 -0.0120 420 ARG 380 CZ 0.0247 -0.0029 -0.0138 421 ARG 380 NH1 0.0262 -0.0037 -0.0126 422 ARG 380 NH2 0.0263 -0.0026 -0.0167 423 ASN 381 N 0.0068 0.0132 -0.0080 424 ASN 381 CA 0.0055 0.0146 -0.0046 425 ASN 381 C 0.0064 0.0125 -0.0043 426 ASN 381 O 0.0065 0.0133 -0.0069 427 ASN 381 CB 0.0036 0.0190 -0.0055 428 ASN 381 CG 0.0021 0.0208 -0.0019 429 ASN 381 ND2 0.0005 0.0243 -0.0024 430 ASN 381 OD1 0.0024 0.0190 0.0014 431 ASN 382 N 0.0073 0.0096 -0.0014 432 ASN 382 CA 0.0082 0.0074 -0.0004 433 ASN 382 C 0.0069 0.0087 0.0036 434 ASN 382 O 0.0068 0.0078 0.0070 435 ASN 382 CB 0.0102 0.0032 -0.0001 436 ASN 382 CG 0.0114 0.0005 0.0005 437 ASN 382 ND2 0.0127 -0.0029 0.0023 438 ASN 382 OD1 0.0113 0.0012 -0.0011 439 SER 383 N 0.0096 0.0117 0.0135 440 SER 383 CA 0.0113 0.0116 0.0140 441 SER 383 C 0.0163 0.0057 0.0078 442 SER 383 O 0.0170 0.0018 0.0029 443 SER 383 CB 0.0024 0.0136 0.0137 444 SER 383 OG -0.0021 0.0094 0.0066 445 PRO 384 N 0.0200 0.0049 0.0079 446 PRO 384 CA 0.0241 -0.0007 0.0019 447 PRO 384 C 0.0179 -0.0046 -0.0053 448 PRO 384 O 0.0208 -0.0095 -0.0109 449 PRO 384 CB 0.0281 0.0002 0.0043 450 PRO 384 CG 0.0227 0.0059 0.0101 451 PRO 384 CD 0.0210 0.0090 0.0137 452 ASP 385 N 0.0120 -0.0155 -0.0171 453 ASP 385 CA 0.0149 -0.0213 -0.0063 454 ASP 385 C 0.0152 -0.0146 0.0086 455 ASP 385 O 0.0174 -0.0177 0.0184 456 ASP 385 CB 0.0190 -0.0369 -0.0063 457 ASP 385 CG 0.0188 -0.0438 -0.0204 458 ASP 385 OD1 0.0178 -0.0420 -0.0247 459 ASP 385 OD2 0.0193 -0.0492 -0.0276 460 GLY 386 N 0.0130 -0.0052 0.0102 461 GLY 386 CA 0.0128 0.0023 0.0234 462 GLY 386 C 0.0134 0.0021 0.0272 463 GLY 386 O 0.0141 -0.0043 0.0200 464 ASN 387 N 0.0095 -0.0051 -0.0385 465 ASN 387 CA 0.0098 -0.0051 -0.0360 466 ASN 387 C 0.0044 -0.0014 -0.0442 467 ASN 387 O 0.0057 -0.0034 -0.0537 468 ASN 387 CB 0.0188 -0.0124 -0.0355 469 ASN 387 CG 0.0192 -0.0125 -0.0327 470 ASN 387 ND2 0.0212 -0.0148 -0.0401 471 ASN 387 OD1 0.0180 -0.0107 -0.0237 472 THR 388 N -0.0001 0.0027 -0.0401 473 THR 388 CA -0.0043 0.0055 -0.0465 474 THR 388 C -0.0023 0.0044 -0.0414 475 THR 388 O -0.0045 0.0070 -0.0324 476 THR 388 CB -0.0137 0.0131 -0.0478 477 THR 388 CG2 -0.0181 0.0160 -0.0560 478 THR 388 OG1 -0.0153 0.0141 -0.0514 479 ASP 389 N 0.0113 -0.0059 -0.0357 480 ASP 389 CA 0.0126 -0.0056 -0.0304 481 ASP 389 C 0.0066 -0.0051 -0.0285 482 ASP 389 O 0.0029 -0.0052 -0.0324 483 ASP 389 CB 0.0180 -0.0060 -0.0318 484 ASP 389 CG 0.0241 -0.0064 -0.0335 485 ASP 389 OD1 0.0254 -0.0063 -0.0314 486 ASP 389 OD2 0.0279 -0.0069 -0.0367 487 SER 390 N 0.0055 -0.0046 -0.0225 488 SER 390 CA -0.0002 -0.0041 -0.0198 489 SER 390 C 0.0002 -0.0040 -0.0180 490 SER 390 O 0.0044 -0.0039 -0.0146 491 SER 390 CB -0.0019 -0.0035 -0.0142 492 SER 390 OG -0.0074 -0.0030 -0.0114 493 SER 391 N -0.0035 -0.0080 -0.0103 494 SER 391 CA -0.0069 -0.0066 -0.0089 495 SER 391 C -0.0101 -0.0039 -0.0057 496 SER 391 O -0.0131 -0.0025 -0.0042 497 SER 391 CB -0.0101 -0.0085 -0.0125 498 SER 391 OG -0.0126 -0.0096 -0.0146 499 ALA 392 N -0.0096 -0.0033 -0.0045 500 ALA 392 CA -0.0127 -0.0010 -0.0018 501 ALA 392 C -0.0124 0.0019 0.0024 502 ALA 392 O -0.0085 0.0026 0.0042 503 ALA 392 CB -0.0116 -0.0011 -0.0017 504 LEU 393 N -0.0144 0.0046 0.0051 505 LEU 393 CA -0.0144 0.0060 0.0052 506 LEU 393 C -0.0138 0.0064 0.0053 507 LEU 393 O -0.0142 0.0058 0.0052 508 LEU 393 CB -0.0159 0.0065 0.0052 509 LEU 393 CG -0.0160 0.0079 0.0053 510 LEU 393 CD1 -0.0155 0.0087 0.0054 511 LEU 393 CD2 -0.0175 0.0083 0.0053 512 ASP 394 N -0.0129 0.0073 0.0054 513 ASP 394 CA -0.0122 0.0077 0.0055 514 ASP 394 C -0.0122 0.0092 0.0056 515 ASP 394 O -0.0119 0.0098 0.0057 516 ASP 394 CB -0.0109 0.0072 0.0055 517 ASP 394 CG -0.0109 0.0057 0.0053 518 ASP 394 OD1 -0.0105 0.0051 0.0053 519 ASP 394 OD2 -0.0108 0.0052 0.0053 520 CYS 395 N -0.0071 0.0079 0.0034 521 CYS 395 CA -0.0071 0.0096 0.0033 522 CYS 395 C -0.0051 0.0089 0.0007 523 CYS 395 O -0.0046 0.0060 0.0003 524 CYS 395 CB -0.0090 0.0085 0.0058 525 CYS 395 SG -0.0090 0.0102 0.0056 526 TYR 396 N -0.0042 0.0115 -0.0007 527 TYR 396 CA -0.0025 0.0114 -0.0029 528 TYR 396 C -0.0032 0.0125 -0.0021 529 TYR 396 O -0.0040 0.0154 -0.0013 530 TYR 396 CB -0.0008 0.0135 -0.0053 531 TYR 396 CG 0.0010 0.0136 -0.0077 532 TYR 396 CD1 0.0026 0.0110 -0.0094 533 TYR 396 CD2 0.0012 0.0164 -0.0082 534 TYR 396 CE1 0.0043 0.0111 -0.0117 535 TYR 396 CE2 0.0029 0.0165 -0.0104 536 TYR 396 CZ 0.0045 0.0139 -0.0122 537 TYR 396 OH 0.0061 0.0140 -0.0143 538 ASN 397 N 0.0011 0.0123 -0.0010 539 ASN 397 CA 0.0009 0.0104 0.0002 540 ASN 397 C 0.0002 0.0096 -0.0027 541 ASN 397 O -0.0006 0.0074 -0.0046 542 ASN 397 CB 0.0006 0.0072 0.0020 543 ASN 397 CG 0.0005 0.0052 0.0035 544 ASN 397 ND2 0.0004 0.0028 0.0056 545 ASN 397 OD1 0.0005 0.0057 0.0029 546 PRO 398 N 0.0005 0.0110 -0.0028 547 PRO 398 CA -0.0001 0.0104 -0.0054 548 PRO 398 C -0.0009 0.0067 -0.0057 549 PRO 398 O -0.0016 0.0057 -0.0084 550 PRO 398 CB 0.0005 0.0124 -0.0044 551 PRO 398 CG 0.0014 0.0151 -0.0023 552 PRO 398 CD 0.0014 0.0135 -0.0006 553 MET 399 N -0.0037 -0.0095 0.0042 554 MET 399 CA -0.0073 -0.0179 0.0049 555 MET 399 C -0.0128 -0.0150 0.0009 556 MET 399 O -0.0174 -0.0215 0.0004 557 MET 399 CB 0.0006 -0.0229 0.0110 558 MET 399 CG 0.0055 -0.0277 0.0153 559 MET 399 SD -0.0010 -0.0386 0.0152 560 MET 399 CE -0.0015 -0.0472 0.0178 561 THR 400 N -0.0120 -0.0055 -0.0018 562 THR 400 CA -0.0169 -0.0018 -0.0057 563 THR 400 C -0.0236 0.0050 -0.0117 564 THR 400 O -0.0296 0.0065 -0.0156 565 THR 400 CB -0.0103 0.0038 -0.0039 566 THR 400 CG2 -0.0033 -0.0021 0.0020 567 THR 400 OG1 -0.0057 0.0126 -0.0042 568 ASN 401 N -0.0029 0.0075 -0.0040 569 ASN 401 CA 0.0012 0.0086 -0.0104 570 ASN 401 C 0.0000 0.0051 -0.0143 571 ASN 401 O 0.0012 0.0031 -0.0204 572 ASN 401 CB 0.0030 0.0086 -0.0143 573 ASN 401 CG 0.0077 0.0105 -0.0205 574 ASN 401 ND2 0.0079 0.0077 -0.0259 575 ASN 401 OD1 0.0114 0.0148 -0.0205 576 GLN 402 N -0.0023 0.0044 -0.0108 577 GLN 402 CA -0.0034 0.0015 -0.0137 578 GLN 402 C -0.0009 0.0054 -0.0118 579 GLN 402 O -0.0008 0.0087 -0.0062 580 GLN 402 CB -0.0091 -0.0038 -0.0116 581 GLN 402 CG -0.0117 -0.0080 -0.0136 582 GLN 402 CD -0.0173 -0.0134 -0.0119 583 GLN 402 NE2 -0.0202 -0.0160 -0.0106 584 GLN 402 OE1 -0.0192 -0.0157 -0.0121 585 TRP 403 N 0.0003 0.0109 -0.0033 586 TRP 403 CA -0.0013 0.0098 -0.0031 587 TRP 403 C -0.0027 0.0086 -0.0029 588 TRP 403 O -0.0019 0.0074 -0.0029 589 TRP 403 CB -0.0003 0.0084 -0.0031 590 TRP 403 CG 0.0008 0.0095 -0.0033 591 TRP 403 CD1 0.0029 0.0098 -0.0035 592 TRP 403 CD2 -0.0001 0.0104 -0.0033 593 TRP 403 CE2 0.0015 0.0113 -0.0035 594 TRP 403 CE3 -0.0021 0.0105 -0.0031 595 TRP 403 NE1 0.0033 0.0109 -0.0036 596 TRP 403 CZ2 0.0012 0.0123 -0.0035 597 TRP 403 CZ3 -0.0025 0.0116 -0.0032 598 TRP 403 CH2 -0.0009 0.0124 -0.0034 599 SER 404 N -0.0047 0.0086 -0.0028 600 SER 404 CA -0.0063 0.0073 -0.0025 601 SER 404 C -0.0075 0.0062 -0.0024 602 SER 404 O -0.0082 0.0072 -0.0024 603 SER 404 CB -0.0079 0.0086 -0.0025 604 SER 404 OG -0.0069 0.0096 -0.0027 605 PRO 405 N -0.0114 0.0125 0.0047 606 PRO 405 CA -0.0130 0.0126 0.0061 607 PRO 405 C -0.0134 0.0127 0.0060 608 PRO 405 O -0.0120 0.0124 0.0058 609 PRO 405 CB -0.0123 0.0119 0.0082 610 PRO 405 CG -0.0106 0.0116 0.0078 611 PRO 405 CD -0.0097 0.0118 0.0058 612 CYS 406 N -0.0153 0.0131 0.0062 613 CYS 406 CA -0.0160 0.0133 0.0065 614 CYS 406 C -0.0169 0.0130 0.0087 615 CYS 406 O -0.0172 0.0128 0.0098 616 CYS 406 CB -0.0176 0.0140 0.0050 617 CYS 406 SG -0.0167 0.0144 0.0024 618 ALA 407 N -0.0233 0.0171 0.0074 619 ALA 407 CA -0.0232 0.0139 0.0041 620 ALA 407 C -0.0201 0.0104 0.0049 621 ALA 407 O -0.0185 0.0101 0.0068 622 ALA 407 CB -0.0254 0.0143 0.0013 623 PRO 408 N -0.0191 0.0077 0.0033 624 PRO 408 CA -0.0162 0.0042 0.0037 625 PRO 408 C -0.0163 0.0021 0.0013 626 PRO 408 O -0.0185 0.0023 -0.0017 627 PRO 408 CB -0.0157 0.0023 0.0024 628 PRO 408 CG -0.0188 0.0039 -0.0005 629 PRO 408 CD -0.0207 0.0077 0.0010 630 MET 409 N -0.0179 -0.0066 -0.0024 631 MET 409 CA -0.0161 -0.0067 -0.0027 632 MET 409 C -0.0164 -0.0091 -0.0067 633 MET 409 O -0.0159 -0.0107 -0.0095 634 MET 409 CB -0.0112 -0.0058 -0.0015 635 MET 409 CG -0.0106 -0.0033 0.0027 636 MET 409 SD -0.0050 -0.0022 0.0043 637 MET 409 CE -0.0027 -0.0040 0.0012 638 SER 410 N -0.0162 -0.0092 -0.0070 639 SER 410 CA -0.0161 -0.0114 -0.0105 640 SER 410 C -0.0123 -0.0129 -0.0133 641 SER 410 O -0.0127 -0.0149 -0.0168 642 SER 410 CB -0.0157 -0.0108 -0.0095 643 SER 410 OG -0.0115 -0.0097 -0.0080 644 VAL 411 N -0.0091 -0.0127 -0.0117 645 VAL 411 CA -0.0036 -0.0128 -0.0163 646 VAL 411 C -0.0017 -0.0119 -0.0149 647 VAL 411 O -0.0023 -0.0102 -0.0092 648 VAL 411 CB 0.0027 -0.0112 -0.0162 649 VAL 411 CG1 0.0015 -0.0124 -0.0192 650 VAL 411 CG2 0.0052 -0.0083 -0.0093 651 PRO 412 N 0.0013 -0.0127 -0.0198 652 PRO 412 CA 0.0045 -0.0114 -0.0185 653 PRO 412 C 0.0106 -0.0086 -0.0145 654 PRO 412 O 0.0145 -0.0080 -0.0156 655 PRO 412 CB 0.0064 -0.0132 -0.0253 656 PRO 412 CG 0.0015 -0.0158 -0.0298 657 PRO 412 CD 0.0010 -0.0151 -0.0269 658 ARG 413 N 0.0118 -0.0097 -0.0100 659 ARG 413 CA 0.0149 -0.0077 -0.0076 660 ARG 413 C 0.0170 -0.0070 -0.0074 661 ARG 413 O 0.0164 -0.0061 -0.0047 662 ARG 413 CB 0.0134 -0.0066 -0.0037 663 ARG 413 CG 0.0114 -0.0071 -0.0036 664 ARG 413 CD 0.0100 -0.0059 0.0004 665 ARG 413 NE 0.0081 -0.0064 0.0005 666 ARG 413 CZ 0.0097 -0.0059 0.0006 667 ARG 413 NH1 0.0135 -0.0048 0.0006 668 ARG 413 NH2 0.0077 -0.0064 0.0008 669 ASN 414 N 0.0197 -0.0073 -0.0102 670 ASN 414 CA 0.0226 -0.0064 -0.0101 671 ASN 414 C 0.0256 -0.0044 -0.0074 672 ASN 414 O 0.0271 -0.0040 -0.0075 673 ASN 414 CB 0.0245 -0.0075 -0.0140 674 ASN 414 CG 0.0279 -0.0065 -0.0141 675 ASN 414 ND2 0.0312 -0.0063 -0.0160 676 ASN 414 OD1 0.0277 -0.0058 -0.0124 677 ARG 415 N 0.0204 -0.0063 -0.0027 678 ARG 415 CA 0.0201 -0.0051 -0.0028 679 ARG 415 C 0.0195 -0.0048 -0.0019 680 ARG 415 O 0.0190 -0.0039 -0.0015 681 ARG 415 CB 0.0200 -0.0042 -0.0031 682 ARG 415 CG 0.0206 -0.0044 -0.0041 683 ARG 415 CD 0.0204 -0.0035 -0.0044 684 ARG 415 NE 0.0203 -0.0024 -0.0048 685 ARG 415 CZ 0.0200 -0.0013 -0.0047 686 ARG 415 NH1 0.0197 -0.0012 -0.0043 687 ARG 415 NH2 0.0199 -0.0004 -0.0050 688 ILE 416 N 0.0195 -0.0056 -0.0015 689 ILE 416 CA 0.0191 -0.0055 -0.0007 690 ILE 416 C 0.0191 -0.0046 -0.0012 691 ILE 416 O 0.0195 -0.0043 -0.0021 692 ILE 416 CB 0.0194 -0.0067 -0.0006 693 ILE 416 CG1 0.0189 -0.0069 0.0004 694 ILE 416 CG2 0.0200 -0.0070 -0.0016 695 ILE 416 CD1 0.0192 -0.0081 0.0006 696 GLY 417 N 0.0145 -0.0089 -0.0034 697 GLY 417 CA 0.0144 -0.0088 -0.0008 698 GLY 417 C 0.0125 -0.0085 -0.0004 699 GLY 417 O 0.0120 -0.0084 -0.0021 700 VAL 418 N 0.0115 -0.0083 0.0017 701 VAL 418 CA 0.0097 -0.0080 0.0023 702 VAL 418 C 0.0102 -0.0080 0.0047 703 VAL 418 O 0.0112 -0.0082 0.0063 704 VAL 418 CB 0.0072 -0.0075 0.0022 705 VAL 418 CG1 0.0066 -0.0075 -0.0003 706 VAL 418 CG2 0.0066 -0.0074 0.0041 707 GLY 419 N -0.0032 -0.0106 0.0005 708 GLY 419 CA -0.0033 -0.0104 0.0025 709 GLY 419 C -0.0052 -0.0103 0.0028 710 GLY 419 O -0.0062 -0.0103 0.0014 711 VAL 420 N -0.0059 -0.0101 0.0046 712 VAL 420 CA -0.0078 -0.0099 0.0051 713 VAL 420 C -0.0074 -0.0098 0.0064 714 VAL 420 O -0.0064 -0.0097 0.0079 715 VAL 420 CB -0.0092 -0.0097 0.0062 716 VAL 420 CG1 -0.0111 -0.0096 0.0068 717 VAL 420 CG2 -0.0098 -0.0098 0.0049 718 ILE 421 N -0.0078 -0.0132 0.0051 719 ILE 421 CA -0.0118 -0.0103 0.0068 720 ILE 421 C -0.0149 -0.0115 0.0075 721 ILE 421 O -0.0158 -0.0156 0.0071 722 ILE 421 CB -0.0144 -0.0111 0.0074 723 ILE 421 CG1 -0.0113 -0.0106 0.0066 724 ILE 421 CG2 -0.0182 -0.0075 0.0090 725 ILE 421 CD1 -0.0134 -0.0116 0.0070 726 ASP 422 N -0.0164 -0.0080 0.0085 727 ASP 422 CA -0.0197 -0.0085 0.0093 728 ASP 422 C -0.0183 -0.0117 0.0084 729 ASP 422 O -0.0212 -0.0132 0.0090 730 ASP 422 CB -0.0245 -0.0094 0.0106 731 ASP 422 CG -0.0259 -0.0057 0.0116 732 ASP 422 OD1 -0.0235 -0.0020 0.0115 733 ASP 422 OD2 -0.0293 -0.0064 0.0125 734 GLY 423 N -0.0132 -0.0148 -0.0059 735 GLY 423 CA -0.0125 -0.0144 -0.0052 736 GLY 423 C -0.0127 -0.0139 -0.0037 737 GLY 423 O -0.0126 -0.0136 -0.0030 738 HIS 424 N -0.0134 -0.0138 -0.0032 739 HIS 424 CA -0.0137 -0.0133 -0.0018 740 HIS 424 C -0.0151 -0.0134 -0.0012 741 HIS 424 O -0.0161 -0.0138 -0.0018 742 HIS 424 CB -0.0135 -0.0132 -0.0015 743 HIS 424 CG -0.0122 -0.0132 -0.0021 744 HIS 424 CD2 -0.0119 -0.0132 -0.0023 745 HIS 424 ND1 -0.0110 -0.0130 -0.0023 746 HIS 424 CE1 -0.0100 -0.0130 -0.0027 747 HIS 424 NE2 -0.0105 -0.0131 -0.0027 748 ILE 425 N -0.0142 -0.0079 0.0044 749 ILE 425 CA -0.0127 -0.0081 0.0038 750 ILE 425 C -0.0115 -0.0085 0.0023 751 ILE 425 O -0.0121 -0.0086 0.0006 752 ILE 425 CB -0.0136 -0.0081 0.0031 753 ILE 425 CG1 -0.0150 -0.0078 0.0046 754 ILE 425 CG2 -0.0120 -0.0083 0.0027 755 ILE 425 CD1 -0.0162 -0.0077 0.0038 756 TYR 426 N -0.0096 -0.0086 0.0027 757 TYR 426 CA -0.0081 -0.0090 0.0012 758 TYR 426 C -0.0074 -0.0092 0.0004 759 TYR 426 O -0.0064 -0.0092 0.0013 760 TYR 426 CB -0.0065 -0.0091 0.0021 761 TYR 426 CG -0.0071 -0.0089 0.0026 762 TYR 426 CD1 -0.0083 -0.0086 0.0042 763 TYR 426 CD2 -0.0067 -0.0091 0.0013 764 TYR 426 CE1 -0.0090 -0.0085 0.0046 765 TYR 426 CE2 -0.0074 -0.0090 0.0017 766 TYR 426 CZ -0.0085 -0.0087 0.0033 767 TYR 426 OH -0.0091 -0.0086 0.0037 768 ALA 427 N -0.0007 -0.0073 0.0073 769 ALA 427 CA 0.0015 -0.0078 0.0043 770 ALA 427 C 0.0043 -0.0072 0.0034 771 ALA 427 O 0.0035 -0.0078 0.0026 772 ALA 427 CB -0.0007 -0.0098 0.0014 773 VAL 428 N 0.0076 -0.0061 0.0032 774 VAL 428 CA 0.0105 -0.0053 0.0028 775 VAL 428 C 0.0129 -0.0059 -0.0005 776 VAL 428 O 0.0142 -0.0056 -0.0011 777 VAL 428 CB 0.0126 -0.0033 0.0058 778 VAL 428 CG1 0.0157 -0.0023 0.0056 779 VAL 428 CG2 0.0104 -0.0027 0.0092 780 GLY 429 N 0.0216 -0.0011 0.0035 781 GLY 429 CA 0.0228 -0.0010 0.0021 782 GLY 429 C 0.0232 -0.0023 0.0006 783 GLY 429 O 0.0224 -0.0037 0.0004 784 GLY 430 N 0.0246 -0.0017 -0.0006 785 GLY 430 CA 0.0252 -0.0027 -0.0022 786 GLY 430 C 0.0252 -0.0037 -0.0031 787 GLY 430 O 0.0248 -0.0035 -0.0024 788 SER 431 N 0.0276 -0.0025 -0.0076 789 SER 431 CA 0.0282 -0.0035 -0.0136 790 SER 431 C 0.0229 -0.0072 -0.0170 791 SER 431 O 0.0195 -0.0090 -0.0167 792 SER 431 CB 0.0332 -0.0017 -0.0182 793 SER 431 OG 0.0333 -0.0019 -0.0195 794 HIS 432 N 0.0228 -0.0081 -0.0211 795 HIS 432 CA 0.0192 -0.0113 -0.0262 796 HIS 432 C 0.0229 -0.0106 -0.0323 797 HIS 432 O 0.0254 -0.0093 -0.0328 798 HIS 432 CB 0.0146 -0.0135 -0.0245 799 HIS 432 CG 0.0109 -0.0167 -0.0295 800 HIS 432 CD2 0.0094 -0.0184 -0.0340 801 HIS 432 ND1 0.0080 -0.0184 -0.0302 802 HIS 432 CE1 0.0050 -0.0212 -0.0351 803 HIS 432 NE2 0.0058 -0.0213 -0.0375 804 GLY 433 N 0.0262 -0.0198 -0.0448 805 GLY 433 CA 0.0281 -0.0108 -0.0531 806 GLY 433 C 0.0300 0.0059 -0.0506 807 GLY 433 O 0.0311 0.0120 -0.0543 808 CYS 434 N 0.0304 0.0133 -0.0444 809 CYS 434 CA 0.0320 0.0290 -0.0399 810 CYS 434 C 0.0308 0.0318 -0.0239 811 CYS 434 O 0.0321 0.0445 -0.0198 812 CYS 434 CB 0.0330 0.0357 -0.0421 813 CYS 434 SG 0.0308 0.0271 -0.0297 814 ILE 435 N 0.0247 0.0167 -0.0041 815 ILE 435 CA 0.0262 0.0160 -0.0031 816 ILE 435 C 0.0261 0.0144 0.0000 817 ILE 435 O 0.0237 0.0140 0.0014 818 ILE 435 CB 0.0247 0.0167 -0.0040 819 ILE 435 CG1 0.0248 0.0183 -0.0071 820 ILE 435 CG2 0.0263 0.0158 -0.0028 821 ILE 435 CD1 0.0279 0.0186 -0.0087 822 HIS 436 N 0.0288 0.0134 0.0011 823 HIS 436 CA 0.0292 0.0118 0.0040 824 HIS 436 C 0.0300 0.0113 0.0047 825 HIS 436 O 0.0323 0.0116 0.0035 826 HIS 436 CB 0.0317 0.0111 0.0047 827 HIS 436 CG 0.0309 0.0114 0.0043 828 HIS 436 CD2 0.0306 0.0104 0.0063 829 HIS 436 ND1 0.0302 0.0127 0.0019 830 HIS 436 CE1 0.0294 0.0126 0.0025 831 HIS 436 NE2 0.0296 0.0112 0.0051 832 HIS 437 N 0.0257 0.0006 -0.0014 833 HIS 437 CA 0.0238 0.0001 0.0015 834 HIS 437 C 0.0236 0.0031 0.0034 835 HIS 437 O 0.0246 0.0051 0.0027 836 HIS 437 CB 0.0230 -0.0022 0.0015 837 HIS 437 CG 0.0231 -0.0054 -0.0002 838 HIS 437 CD2 0.0238 -0.0069 -0.0021 839 HIS 437 ND1 0.0224 -0.0073 -0.0000 840 HIS 437 CE1 0.0226 -0.0099 -0.0018 841 HIS 437 NE2 0.0235 -0.0097 -0.0031 842 ASN 438 N 0.0221 0.0034 0.0060 843 ASN 438 CA 0.0212 0.0053 0.0084 844 ASN 438 C 0.0196 0.0034 0.0102 845 ASN 438 O 0.0188 0.0048 0.0121 846 ASN 438 CB 0.0207 0.0070 0.0102 847 ASN 438 CG 0.0194 0.0049 0.0112 848 ASN 438 ND2 0.0187 0.0062 0.0131 849 ASN 438 OD1 0.0192 0.0021 0.0101 850 SER 439 N 0.0112 -0.0042 0.0036 851 SER 439 CA 0.0094 -0.0048 0.0044 852 SER 439 C 0.0091 -0.0043 0.0053 853 SER 439 O 0.0102 -0.0040 0.0048 854 SER 439 CB 0.0083 -0.0064 0.0032 855 SER 439 OG 0.0089 -0.0070 0.0019 856 VAL 440 N 0.0077 -0.0044 0.0067 857 VAL 440 CA 0.0071 -0.0040 0.0078 858 VAL 440 C 0.0052 -0.0050 0.0082 859 VAL 440 O 0.0042 -0.0055 0.0086 860 VAL 440 CB 0.0076 -0.0025 0.0095 861 VAL 440 CG1 0.0072 -0.0019 0.0107 862 VAL 440 CG2 0.0095 -0.0014 0.0091 863 GLU 441 N -0.0087 -0.0089 0.0028 864 GLU 441 CA -0.0093 -0.0080 0.0025 865 GLU 441 C -0.0097 -0.0078 0.0035 866 GLU 441 O -0.0096 -0.0082 0.0044 867 GLU 441 CB -0.0098 -0.0072 0.0022 868 GLU 441 CG -0.0101 -0.0072 0.0031 869 GLU 441 CD -0.0103 -0.0066 0.0025 870 GLU 441 OE1 -0.0107 -0.0059 0.0018 871 GLU 441 OE2 -0.0100 -0.0070 0.0026 872 ARG 442 N -0.0100 -0.0072 0.0031 873 ARG 442 CA -0.0104 -0.0070 0.0038 874 ARG 442 C -0.0112 -0.0060 0.0038 875 ARG 442 O -0.0114 -0.0055 0.0029 876 ARG 442 CB -0.0100 -0.0073 0.0033 877 ARG 442 CG -0.0103 -0.0072 0.0040 878 ARG 442 CD -0.0100 -0.0073 0.0034 879 ARG 442 NE -0.0104 -0.0066 0.0025 880 ARG 442 CZ -0.0100 -0.0067 0.0014 881 ARG 442 NH1 -0.0093 -0.0074 0.0010 882 ARG 442 NH2 -0.0104 -0.0059 0.0006 883 TYR 443 N -0.0174 -0.0082 -0.0008 884 TYR 443 CA -0.0152 -0.0059 -0.0004 885 TYR 443 C -0.0122 -0.0083 -0.0039 886 TYR 443 O -0.0139 -0.0123 -0.0058 887 TYR 443 CB -0.0190 -0.0053 0.0022 888 TYR 443 CG -0.0173 -0.0029 0.0029 889 TYR 443 CD1 -0.0153 0.0017 0.0050 890 TYR 443 CD2 -0.0180 -0.0053 0.0016 891 TYR 443 CE1 -0.0140 0.0040 0.0060 892 TYR 443 CE2 -0.0168 -0.0030 0.0026 893 TYR 443 CZ -0.0149 0.0016 0.0048 894 TYR 443 OH -0.0140 0.0037 0.0057 895 GLU 444 N -0.0080 -0.0059 -0.0046 896 GLU 444 CA -0.0047 -0.0076 -0.0077 897 GLU 444 C -0.0043 -0.0057 -0.0066 898 GLU 444 O -0.0018 -0.0019 -0.0053 899 GLU 444 CB 0.0001 -0.0065 -0.0097 900 GLU 444 CG -0.0006 -0.0092 -0.0112 901 GLU 444 CD 0.0038 -0.0082 -0.0130 902 GLU 444 OE1 0.0077 -0.0078 -0.0150 903 GLU 444 OE2 0.0029 -0.0094 -0.0133 904 PRO 445 N -0.0004 -0.0096 -0.0098 905 PRO 445 CA -0.0056 -0.0102 -0.0100 906 PRO 445 C 0.0038 -0.0112 -0.0102 907 PRO 445 O 0.0016 -0.0071 -0.0090 908 PRO 445 CB -0.0139 -0.0210 -0.0133 909 PRO 445 CG -0.0180 -0.0221 -0.0136 910 PRO 445 CD -0.0066 -0.0181 -0.0124 911 GLU 446 N 0.0145 -0.0166 -0.0117 912 GLU 446 CA 0.0244 -0.0182 -0.0121 913 GLU 446 C 0.0314 -0.0067 -0.0086 914 GLU 446 O 0.0391 -0.0063 -0.0085 915 GLU 446 CB 0.0335 -0.0276 -0.0149 916 GLU 446 CG 0.0279 -0.0399 -0.0186 917 GLU 446 CD 0.0208 -0.0414 -0.0191 918 GLU 446 OE1 0.0205 -0.0329 -0.0165 919 GLU 446 OE2 0.0150 -0.0508 -0.0219 920 ARG 447 N 0.0295 -0.0025 -0.0349 921 ARG 447 CA 0.0356 0.0077 -0.0261 922 ARG 447 C 0.0278 0.0154 -0.0135 923 ARG 447 O 0.0348 0.0247 -0.0061 924 ARG 447 CB 0.0361 0.0062 -0.0280 925 ARG 447 CG 0.0460 0.0002 -0.0396 926 ARG 447 CD 0.0620 0.0058 -0.0408 927 ARG 447 NE 0.0658 0.0054 -0.0431 928 ARG 447 CZ 0.0766 0.0117 -0.0409 929 ARG 447 NH1 0.0868 0.0190 -0.0375 930 ARG 447 NH2 0.0769 0.0107 -0.0422 931 ASP 448 N 0.0147 0.0117 -0.0115 932 ASP 448 CA 0.0049 0.0178 0.0001 933 ASP 448 C 0.0019 0.0228 0.0073 934 ASP 448 O 0.0023 0.0319 0.0176 935 ASP 448 CB 0.0091 0.0250 0.0064 936 ASP 448 CG -0.0028 0.0294 0.0171 937 ASP 448 OD1 -0.0156 0.0237 0.0166 938 ASP 448 OD2 0.0004 0.0370 0.0243 939 GLU 449 N 0.0031 0.0052 -0.0005 940 GLU 449 CA 0.0017 0.0055 0.0014 941 GLU 449 C -0.0029 0.0036 0.0011 942 GLU 449 O -0.0042 0.0015 -0.0021 943 GLU 449 CB 0.0044 0.0056 -0.0007 944 GLU 449 CG 0.0087 0.0079 0.0008 945 GLU 449 CD 0.0113 0.0080 -0.0012 946 GLU 449 OE1 0.0150 0.0097 -0.0008 947 GLU 449 OE2 0.0095 0.0064 -0.0030 948 TRP 450 N -0.0052 0.0043 0.0044 949 TRP 450 CA -0.0092 0.0028 0.0046 950 TRP 450 C -0.0088 0.0029 0.0045 951 TRP 450 O -0.0073 0.0048 0.0071 952 TRP 450 CB -0.0122 0.0035 0.0084 953 TRP 450 CG -0.0138 0.0029 0.0085 954 TRP 450 CD1 -0.0122 0.0043 0.0102 955 TRP 450 CD2 -0.0173 0.0007 0.0067 956 TRP 450 CE2 -0.0177 0.0010 0.0076 957 TRP 450 CE3 -0.0201 -0.0015 0.0044 958 TRP 450 NE1 -0.0144 0.0032 0.0097 959 TRP 450 CZ2 -0.0208 -0.0009 0.0064 960 TRP 450 CZ3 -0.0232 -0.0034 0.0030 961 TRP 450 CH2 -0.0236 -0.0031 0.0040 962 HIS 451 N -0.0109 -0.0033 0.0037 963 HIS 451 CA -0.0114 -0.0041 0.0028 964 HIS 451 C -0.0115 -0.0054 0.0030 965 HIS 451 O -0.0113 -0.0055 0.0033 966 HIS 451 CB -0.0119 -0.0034 0.0017 967 HIS 451 CG -0.0119 -0.0022 0.0013 968 HIS 451 CD2 -0.0116 -0.0011 0.0017 969 HIS 451 ND1 -0.0123 -0.0022 0.0006 970 HIS 451 CE1 -0.0121 -0.0010 0.0005 971 HIS 451 NE2 -0.0117 -0.0003 0.0012 972 LEU 452 N -0.0117 -0.0064 0.0028 973 LEU 452 CA -0.0118 -0.0077 0.0029 974 LEU 452 C -0.0123 -0.0078 0.0020 975 LEU 452 O -0.0128 -0.0074 0.0010 976 LEU 452 CB -0.0120 -0.0087 0.0028 977 LEU 452 CG -0.0115 -0.0091 0.0039 978 LEU 452 CD1 -0.0112 -0.0098 0.0047 979 LEU 452 CD2 -0.0111 -0.0080 0.0044 980 VAL 453 N -0.0034 -0.0060 0.0093 981 VAL 453 CA -0.0033 -0.0049 0.0105 982 VAL 453 C -0.0022 -0.0044 0.0101 983 VAL 453 O -0.0017 -0.0050 0.0089 984 VAL 453 CB -0.0030 -0.0039 0.0114 985 VAL 453 CG1 -0.0041 -0.0044 0.0119 986 VAL 453 CG2 -0.0015 -0.0034 0.0107 987 ALA 454 N -0.0019 -0.0033 0.0111 988 ALA 454 CA -0.0008 -0.0028 0.0107 989 ALA 454 C 0.0006 -0.0026 0.0096 990 ALA 454 O 0.0011 -0.0020 0.0097 991 ALA 454 CB -0.0007 -0.0015 0.0120 992 PRO 455 N 0.0052 -0.0028 0.0121 993 PRO 455 CA 0.0071 -0.0024 0.0107 994 PRO 455 C 0.0074 0.0003 0.0106 995 PRO 455 O 0.0061 0.0015 0.0117 996 PRO 455 CB 0.0072 -0.0041 0.0106 997 PRO 455 CG 0.0050 -0.0042 0.0122 998 PRO 455 CD 0.0039 -0.0041 0.0130 999 MET 456 N 0.0093 0.0012 0.0093 1000 MET 456 CA 0.0099 0.0034 0.0089 1001 MET 456 C 0.0092 0.0034 0.0094 1002 MET 456 O 0.0092 0.0015 0.0094 1003 MET 456 CB 0.0121 0.0038 0.0073 1004 MET 456 CG 0.0129 0.0043 0.0068 1005 MET 456 SD 0.0155 0.0047 0.0048 1006 MET 456 CE 0.0163 0.0017 0.0040 1007 LEU 457 N 0.0068 0.0075 0.0061 1008 LEU 457 CA 0.0034 0.0074 0.0078 1009 LEU 457 C 0.0048 0.0063 0.0084 1010 LEU 457 O 0.0030 0.0048 0.0109 1011 LEU 457 CB 0.0004 0.0107 0.0057 1012 LEU 457 CG -0.0010 0.0121 0.0048 1013 LEU 457 CD1 -0.0039 0.0153 0.0026 1014 LEU 457 CD2 -0.0031 0.0103 0.0077 1015 THR 458 N 0.0081 0.0068 0.0063 1016 THR 458 CA 0.0098 0.0059 0.0064 1017 THR 458 C 0.0140 0.0035 0.0071 1018 THR 458 O 0.0165 0.0037 0.0057 1019 THR 458 CB 0.0100 0.0087 0.0033 1020 THR 458 CG2 0.0100 0.0083 0.0038 1021 THR 458 OG1 0.0067 0.0113 0.0020 1022 ARG 459 N 0.0184 0.0126 0.0077 1023 ARG 459 CA 0.0188 0.0122 0.0075 1024 ARG 459 C 0.0171 0.0112 0.0048 1025 ARG 459 O 0.0147 0.0119 0.0039 1026 ARG 459 CB 0.0179 0.0142 0.0097 1027 ARG 459 CG 0.0197 0.0152 0.0125 1028 ARG 459 CD 0.0186 0.0173 0.0146 1029 ARG 459 NE 0.0204 0.0181 0.0173 1030 ARG 459 CZ 0.0228 0.0177 0.0186 1031 ARG 459 NH1 0.0239 0.0164 0.0176 1032 ARG 459 NH2 0.0242 0.0185 0.0209 1033 ARG 460 N 0.0184 0.0095 0.0034 1034 ARG 460 CA 0.0169 0.0084 0.0007 1035 ARG 460 C 0.0177 0.0076 0.0001 1036 ARG 460 O 0.0200 0.0062 -0.0001 1037 ARG 460 CB 0.0175 0.0067 -0.0014 1038 ARG 460 CG 0.0167 0.0073 -0.0011 1039 ARG 460 CD 0.0174 0.0054 -0.0033 1040 ARG 460 NE 0.0169 0.0059 -0.0031 1041 ARG 460 CZ 0.0146 0.0063 -0.0042 1042 ARG 460 NH1 0.0123 0.0065 -0.0058 1043 ARG 460 NH2 0.0144 0.0068 -0.0037 1044 ILE 461 N 0.0225 0.0032 -0.0001 1045 ILE 461 CA 0.0227 0.0027 -0.0007 1046 ILE 461 C 0.0222 0.0027 -0.0018 1047 ILE 461 O 0.0215 0.0033 -0.0020 1048 ILE 461 CB 0.0228 0.0029 -0.0003 1049 ILE 461 CG1 0.0219 0.0035 -0.0006 1050 ILE 461 CG2 0.0231 0.0031 0.0009 1051 ILE 461 CD1 0.0220 0.0036 -0.0004 1052 GLY 462 N 0.0225 0.0020 -0.0025 1053 GLY 462 CA 0.0222 0.0019 -0.0036 1054 GLY 462 C 0.0221 0.0018 -0.0038 1055 GLY 462 O 0.0215 0.0022 -0.0043 1056 VAL 463 N 0.0144 0.0025 -0.0041 1057 VAL 463 CA 0.0141 0.0028 -0.0039 1058 VAL 463 C 0.0145 0.0025 -0.0049 1059 VAL 463 O 0.0152 0.0016 -0.0052 1060 VAL 463 CB 0.0142 0.0025 -0.0026 1061 VAL 463 CG1 0.0150 0.0014 -0.0022 1062 VAL 463 CG2 0.0138 0.0029 -0.0023 1063 GLY 464 N 0.0141 0.0032 -0.0055 1064 GLY 464 CA 0.0144 0.0029 -0.0063 1065 GLY 464 C 0.0146 0.0026 -0.0055 1066 GLY 464 O 0.0140 0.0030 -0.0047 1067 VAL 465 N 0.0086 -0.0035 -0.0022 1068 VAL 465 CA 0.0082 -0.0042 -0.0005 1069 VAL 465 C 0.0080 -0.0047 0.0001 1070 VAL 465 O 0.0077 -0.0053 -0.0009 1071 VAL 465 CB 0.0076 -0.0056 -0.0004 1072 VAL 465 CG1 0.0072 -0.0063 0.0014 1073 VAL 465 CG2 0.0078 -0.0050 -0.0008 1074 ALA 466 N 0.0080 -0.0043 0.0017 1075 ALA 466 CA 0.0077 -0.0049 0.0026 1076 ALA 466 C 0.0075 -0.0052 0.0045 1077 ALA 466 O 0.0077 -0.0047 0.0051 1078 ALA 466 CB 0.0082 -0.0038 0.0022 1079 VAL 467 N -0.0002 -0.0109 0.0066 1080 VAL 467 CA 0.0001 -0.0117 0.0097 1081 VAL 467 C 0.0002 -0.0109 0.0102 1082 VAL 467 O -0.0001 -0.0117 0.0083 1083 VAL 467 CB -0.0000 -0.0152 0.0104 1084 VAL 467 CG1 0.0002 -0.0162 0.0135 1085 VAL 467 CG2 -0.0001 -0.0158 0.0103 1086 LEU 468 N 0.0006 -0.0095 0.0128 1087 LEU 468 CA 0.0008 -0.0087 0.0136 1088 LEU 468 C 0.0012 -0.0090 0.0171 1089 LEU 468 O 0.0014 -0.0080 0.0188 1090 LEU 468 CB 0.0008 -0.0055 0.0124 1091 LEU 468 CG 0.0011 -0.0040 0.0135 1092 LEU 468 CD1 0.0008 -0.0059 0.0124 1093 LEU 468 CD2 0.0011 -0.0008 0.0121 1094 ASN 469 N -0.0035 -0.0157 0.0377 1095 ASN 469 CA -0.0042 -0.0154 0.0370 1096 ASN 469 C -0.0070 -0.0139 0.0311 1097 ASN 469 O -0.0055 -0.0143 0.0285 1098 ASN 469 CB 0.0016 -0.0177 0.0383 1099 ASN 469 CG 0.0039 -0.0191 0.0444 1100 ASN 469 ND2 0.0093 -0.0212 0.0448 1101 ASN 469 OD1 0.0007 -0.0182 0.0486 1102 ARG 470 N -0.0112 -0.0121 0.0290 1103 ARG 470 CA -0.0140 -0.0105 0.0231 1104 ARG 470 C -0.0101 -0.0116 0.0174 1105 ARG 470 O -0.0121 -0.0105 0.0124 1106 ARG 470 CB -0.0177 -0.0091 0.0229 1107 ARG 470 CG -0.0228 -0.0074 0.0273 1108 ARG 470 CD -0.0259 -0.0063 0.0277 1109 ARG 470 NE -0.0281 -0.0050 0.0218 1110 ARG 470 CZ -0.0256 -0.0057 0.0178 1111 ARG 470 NH1 -0.0206 -0.0076 0.0185 1112 ARG 470 NH2 -0.0278 -0.0044 0.0126 1113 LEU 471 N 0.0004 -0.0094 0.0144 1114 LEU 471 CA 0.0015 -0.0085 0.0128 1115 LEU 471 C 0.0011 -0.0085 0.0109 1116 LEU 471 O 0.0009 -0.0086 0.0111 1117 LEU 471 CB 0.0036 -0.0076 0.0135 1118 LEU 471 CG 0.0041 -0.0076 0.0154 1119 LEU 471 CD1 0.0061 -0.0067 0.0162 1120 LEU 471 CD2 0.0038 -0.0077 0.0150 1121 LEU 472 N 0.0011 -0.0082 0.0091 1122 LEU 472 CA 0.0008 -0.0081 0.0071 1123 LEU 472 C 0.0028 -0.0070 0.0064 1124 LEU 472 O 0.0039 -0.0064 0.0063 1125 LEU 472 CB -0.0003 -0.0084 0.0056 1126 LEU 472 CG -0.0008 -0.0084 0.0034 1127 LEU 472 CD1 -0.0024 -0.0092 0.0035 1128 LEU 472 CD2 -0.0015 -0.0085 0.0020 1129 TYR 473 N 0.0042 -0.0040 0.0037 1130 TYR 473 CA 0.0047 -0.0013 0.0025 1131 TYR 473 C 0.0050 -0.0018 0.0001 1132 TYR 473 O 0.0050 -0.0035 -0.0018 1133 TYR 473 CB 0.0051 0.0005 0.0015 1134 TYR 473 CG 0.0049 0.0017 0.0039 1135 TYR 473 CD1 0.0045 -0.0001 0.0052 1136 TYR 473 CD2 0.0051 0.0045 0.0049 1137 TYR 473 CE1 0.0043 0.0009 0.0076 1138 TYR 473 CE2 0.0050 0.0056 0.0073 1139 TYR 473 CZ 0.0045 0.0037 0.0087 1140 TYR 473 OH 0.0043 0.0046 0.0112 1141 ALA 474 N 0.0052 -0.0003 0.0002 1142 ALA 474 CA 0.0055 -0.0002 -0.0021 1143 ALA 474 C 0.0060 0.0029 -0.0033 1144 ALA 474 O 0.0061 0.0050 -0.0018 1145 ALA 474 CB 0.0052 -0.0012 -0.0010 1146 VAL 475 N 0.0043 0.0039 -0.0047 1147 VAL 475 CA 0.0039 0.0048 -0.0053 1148 VAL 475 C 0.0036 0.0053 -0.0060 1149 VAL 475 O 0.0036 0.0048 -0.0066 1150 VAL 475 CB 0.0038 0.0044 -0.0060 1151 VAL 475 CG1 0.0034 0.0052 -0.0067 1152 VAL 475 CG2 0.0041 0.0039 -0.0054 1153 GLY 476 N 0.0034 0.0064 -0.0059 1154 GLY 476 CA 0.0031 0.0071 -0.0065 1155 GLY 476 C 0.0032 0.0068 -0.0063 1156 GLY 476 O 0.0035 0.0065 -0.0054 1157 GLY 477 N 0.0076 0.0067 -0.0100 1158 GLY 477 CA 0.0097 0.0064 -0.0063 1159 GLY 477 C 0.0070 0.0053 -0.0028 1160 GLY 477 O 0.0040 0.0047 -0.0030 1161 PHE 478 N 0.0085 0.0050 0.0005 1162 PHE 478 CA 0.0066 0.0039 0.0042 1163 PHE 478 C 0.0072 0.0037 0.0063 1164 PHE 478 O 0.0105 0.0043 0.0065 1165 PHE 478 CB 0.0082 0.0038 0.0067 1166 PHE 478 CG 0.0066 0.0028 0.0107 1167 PHE 478 CD1 0.0029 0.0020 0.0110 1168 PHE 478 CD2 0.0088 0.0027 0.0140 1169 PHE 478 CE1 0.0014 0.0010 0.0147 1170 PHE 478 CE2 0.0073 0.0017 0.0177 1171 PHE 478 CZ 0.0035 0.0009 0.0180 1172 ASP 479 N 0.0102 0.0115 0.0063 1173 ASP 479 CA 0.0121 0.0119 0.0103 1174 ASP 479 C 0.0136 0.0127 0.0191 1175 ASP 479 O 0.0168 0.0133 0.0228 1176 ASP 479 CB 0.0057 0.0112 0.0085 1177 ASP 479 CG -0.0025 0.0106 0.0118 1178 ASP 479 OD1 -0.0031 0.0109 0.0170 1179 ASP 479 OD2 -0.0083 0.0099 0.0090 1180 GLY 480 N 0.0120 0.0128 0.0224 1181 GLY 480 CA 0.0120 0.0133 0.0308 1182 GLY 480 C 0.0039 0.0128 0.0341 1183 GLY 480 O 0.0035 0.0131 0.0399 1184 THR 481 N -0.0078 0.0083 0.0554 1185 THR 481 CA -0.0237 0.0109 0.0576 1186 THR 481 C -0.0317 0.0102 0.0427 1187 THR 481 O -0.0380 0.0109 0.0410 1188 THR 481 CB -0.0316 0.0131 0.0651 1189 THR 481 CG2 -0.0480 0.0160 0.0686 1190 THR 481 OG1 -0.0244 0.0138 0.0788 1191 ASN 482 N -0.0304 0.0086 0.0314 1192 ASN 482 CA -0.0384 0.0079 0.0170 1193 ASN 482 C -0.0280 0.0047 0.0041 1194 ASN 482 O -0.0150 0.0027 0.0039 1195 ASN 482 CB -0.0468 0.0088 0.0142 1196 ASN 482 CG -0.0580 0.0121 0.0264 1197 ASN 482 ND2 -0.0561 0.0129 0.0347 1198 ASN 482 OD1 -0.0677 0.0139 0.0294 1199 ARG 483 N -0.0133 0.0045 0.0021 1200 ARG 483 CA -0.0113 0.0052 -0.0018 1201 ARG 483 C -0.0142 0.0069 -0.0032 1202 ARG 483 O -0.0179 0.0081 -0.0023 1203 ARG 483 CB -0.0102 0.0061 -0.0052 1204 ARG 483 CG -0.0066 0.0044 -0.0046 1205 ARG 483 CD -0.0076 0.0036 -0.0015 1206 ARG 483 NE -0.0039 0.0019 -0.0010 1207 ARG 483 CZ -0.0037 0.0009 0.0014 1208 ARG 483 NH1 -0.0069 0.0014 0.0035 1209 ARG 483 NH2 -0.0001 -0.0007 0.0017 1210 LEU 484 N -0.0124 0.0070 -0.0054 1211 LEU 484 CA -0.0146 0.0082 -0.0063 1212 LEU 484 C -0.0149 0.0101 -0.0109 1213 LEU 484 O -0.0118 0.0099 -0.0134 1214 LEU 484 CB -0.0124 0.0067 -0.0046 1215 LEU 484 CG -0.0118 0.0047 0.0000 1216 LEU 484 CD1 -0.0089 0.0031 0.0010 1217 LEU 484 CD2 -0.0158 0.0052 0.0029 1218 ASN 485 N -0.0175 0.0132 -0.0039 1219 ASN 485 CA -0.0175 0.0114 -0.0077 1220 ASN 485 C -0.0143 0.0109 -0.0089 1221 ASN 485 O -0.0137 0.0095 -0.0120 1222 ASN 485 CB -0.0215 0.0109 -0.0090 1223 ASN 485 CG -0.0231 0.0115 -0.0077 1224 ASN 485 ND2 -0.0211 0.0123 -0.0057 1225 ASN 485 OD1 -0.0266 0.0114 -0.0079 1226 SER 486 N -0.0125 0.0120 -0.0064 1227 SER 486 CA -0.0098 0.0116 -0.0072 1228 SER 486 C -0.0061 0.0109 -0.0089 1229 SER 486 O -0.0048 0.0113 -0.0079 1230 SER 486 CB -0.0090 0.0131 -0.0040 1231 SER 486 OG -0.0069 0.0143 -0.0014 1232 ALA 487 N 0.0003 0.0109 -0.0059 1233 ALA 487 CA 0.0019 0.0088 -0.0061 1234 ALA 487 C 0.0026 0.0084 -0.0038 1235 ALA 487 O 0.0017 0.0098 -0.0026 1236 ALA 487 CB 0.0019 0.0083 -0.0086 1237 GLU 488 N 0.0041 0.0066 -0.0032 1238 GLU 488 CA 0.0049 0.0059 -0.0011 1239 GLU 488 C 0.0064 0.0039 -0.0017 1240 GLU 488 O 0.0071 0.0027 -0.0033 1241 GLU 488 CB 0.0052 0.0061 0.0012 1242 GLU 488 CG 0.0059 0.0051 0.0010 1243 GLU 488 CD 0.0058 0.0057 0.0032 1244 GLU 488 OE1 0.0065 0.0053 0.0053 1245 GLU 488 OE2 0.0050 0.0067 0.0029 1246 CYS 489 N 0.0009 0.0021 0.0009 1247 CYS 489 CA 0.0007 0.0008 0.0016 1248 CYS 489 C 0.0007 0.0001 0.0026 1249 CYS 489 O 0.0011 0.0009 0.0034 1250 CYS 489 CB 0.0010 0.0012 0.0025 1251 CYS 489 SG 0.0008 -0.0003 0.0036 1252 TYR 490 N 0.0003 -0.0012 0.0025 1253 TYR 490 CA 0.0002 -0.0021 0.0034 1254 TYR 490 C 0.0002 -0.0031 0.0045 1255 TYR 490 O -0.0002 -0.0038 0.0041 1256 TYR 490 CB -0.0003 -0.0031 0.0025 1257 TYR 490 CG -0.0005 -0.0042 0.0032 1258 TYR 490 CD1 -0.0002 -0.0037 0.0038 1259 TYR 490 CD2 -0.0009 -0.0056 0.0032 1260 TYR 490 CE1 -0.0004 -0.0048 0.0044 1261 TYR 490 CE2 -0.0011 -0.0066 0.0038 1262 TYR 490 CZ -0.0008 -0.0062 0.0044 1263 TYR 490 OH -0.0010 -0.0072 0.0050 1264 TYR 491 N -0.0112 -0.0133 0.0015 1265 TYR 491 CA -0.0098 -0.0123 -0.0020 1266 TYR 491 C -0.0080 -0.0082 -0.0030 1267 TYR 491 O -0.0074 -0.0078 -0.0046 1268 TYR 491 CB -0.0101 -0.0155 -0.0054 1269 TYR 491 CG -0.0088 -0.0151 -0.0095 1270 TYR 491 CD1 -0.0079 -0.0132 -0.0098 1271 TYR 491 CD2 -0.0084 -0.0169 -0.0129 1272 TYR 491 CE1 -0.0067 -0.0128 -0.0136 1273 TYR 491 CE2 -0.0072 -0.0165 -0.0168 1274 TYR 491 CZ -0.0063 -0.0144 -0.0171 1275 TYR 491 OH -0.0051 -0.0139 -0.0208 1276 PRO 492 N -0.0072 -0.0051 -0.0020 1277 PRO 492 CA -0.0056 -0.0010 -0.0023 1278 PRO 492 C -0.0041 -0.0001 -0.0065 1279 PRO 492 O -0.0033 0.0014 -0.0070 1280 PRO 492 CB -0.0050 0.0015 -0.0009 1281 PRO 492 CG -0.0068 -0.0010 0.0020 1282 PRO 492 CD -0.0077 -0.0051 0.0000 1283 GLU 493 N -0.0069 0.0005 -0.0095 1284 GLU 493 CA -0.0033 0.0011 -0.0170 1285 GLU 493 C -0.0023 -0.0015 -0.0205 1286 GLU 493 O 0.0008 0.0004 -0.0263 1287 GLU 493 CB -0.0027 -0.0032 -0.0207 1288 GLU 493 CG -0.0029 -0.0002 -0.0186 1289 GLU 493 CD -0.0065 -0.0032 -0.0121 1290 GLU 493 OE1 -0.0092 -0.0063 -0.0080 1291 GLU 493 OE2 -0.0067 -0.0019 -0.0111 1292 ARG 494 N -0.0049 -0.0057 -0.0171 1293 ARG 494 CA -0.0043 -0.0075 -0.0193 1294 ARG 494 C -0.0054 -0.0032 -0.0147 1295 ARG 494 O -0.0044 -0.0029 -0.0168 1296 ARG 494 CB -0.0062 -0.0160 -0.0195 1297 ARG 494 CG -0.0051 -0.0188 -0.0235 1298 ARG 494 CD -0.0072 -0.0271 -0.0232 1299 ARG 494 NE -0.0063 -0.0319 -0.0275 1300 ARG 494 CZ -0.0076 -0.0392 -0.0285 1301 ARG 494 NH1 -0.0100 -0.0429 -0.0251 1302 ARG 494 NH2 -0.0065 -0.0430 -0.0329 1303 ASN 495 N -0.0065 0.0012 -0.0030 1304 ASN 495 CA -0.0042 -0.0019 0.0024 1305 ASN 495 C -0.0085 -0.0053 0.0049 1306 ASN 495 O -0.0098 -0.0087 0.0088 1307 ASN 495 CB -0.0021 -0.0029 0.0049 1308 ASN 495 CG 0.0010 -0.0057 0.0104 1309 ASN 495 ND2 -0.0000 -0.0085 0.0136 1310 ASN 495 OD1 0.0047 -0.0054 0.0118 1311 GLU 496 N -0.0109 -0.0045 0.0025 1312 GLU 496 CA -0.0157 -0.0074 0.0038 1313 GLU 496 C -0.0144 -0.0070 0.0041 1314 GLU 496 O -0.0130 -0.0039 0.0004 1315 GLU 496 CB -0.0215 -0.0068 0.0001 1316 GLU 496 CG -0.0269 -0.0095 0.0009 1317 GLU 496 CD -0.0326 -0.0091 -0.0026 1318 GLU 496 OE1 -0.0347 -0.0102 -0.0021 1319 GLU 496 OE2 -0.0348 -0.0072 -0.0063 1320 TRP 497 N -0.0132 -0.0027 0.0011 1321 TRP 497 CA -0.0106 -0.0026 0.0019 1322 TRP 497 C -0.0152 -0.0033 0.0008 1323 TRP 497 O -0.0195 -0.0067 0.0013 1324 TRP 497 CB -0.0067 -0.0070 0.0056 1325 TRP 497 CG -0.0011 -0.0061 0.0069 1326 TRP 497 CD1 -0.0004 -0.0078 0.0080 1327 TRP 497 CD2 0.0045 -0.0032 0.0071 1328 TRP 497 CE2 0.0085 -0.0032 0.0083 1329 TRP 497 CE3 0.0067 -0.0005 0.0063 1330 TRP 497 NE1 0.0052 -0.0061 0.0089 1331 TRP 497 CZ2 0.0141 -0.0005 0.0086 1332 TRP 497 CZ3 0.0124 0.0022 0.0066 1333 TRP 497 CH2 0.0162 0.0022 0.0078 1334 ARG 498 N -0.0140 -0.0005 -0.0003 1335 ARG 498 CA -0.0174 -0.0012 -0.0010 1336 ARG 498 C -0.0134 -0.0011 0.0002 1337 ARG 498 O -0.0090 0.0022 -0.0002 1338 ARG 498 CB -0.0213 0.0031 -0.0047 1339 ARG 498 CG -0.0264 0.0022 -0.0058 1340 ARG 498 CD -0.0304 0.0065 -0.0094 1341 ARG 498 NE -0.0352 0.0054 -0.0103 1342 ARG 498 CZ -0.0409 0.0047 -0.0117 1343 ARG 498 NH1 -0.0432 0.0058 -0.0131 1344 ARG 498 NH2 -0.0442 0.0030 -0.0119 1345 MET 499 N -0.0000 0.0097 -0.0005 1346 MET 499 CA -0.0001 0.0106 -0.0019 1347 MET 499 C -0.0002 0.0111 -0.0024 1348 MET 499 O -0.0005 0.0116 -0.0015 1349 MET 499 CB -0.0006 0.0120 -0.0017 1350 MET 499 CG -0.0006 0.0116 -0.0010 1351 MET 499 SD 0.0000 0.0102 -0.0021 1352 MET 499 CE -0.0000 0.0112 -0.0039 1353 ILE 500 N -0.0000 0.0112 -0.0039 1354 ILE 500 CA -0.0002 0.0120 -0.0047 1355 ILE 500 C -0.0005 0.0133 -0.0056 1356 ILE 500 O -0.0006 0.0136 -0.0057 1357 ILE 500 CB 0.0003 0.0109 -0.0057 1358 ILE 500 CG1 0.0007 0.0103 -0.0070 1359 ILE 500 CG2 0.0006 0.0096 -0.0047 1360 ILE 500 CD1 0.0011 0.0097 -0.0083 1361 THR 501 N 0.0001 0.0079 -0.0124 1362 THR 501 CA -0.0028 0.0073 -0.0120 1363 THR 501 C -0.0065 0.0096 -0.0115 1364 THR 501 O -0.0082 0.0096 -0.0112 1365 THR 501 CB -0.0037 0.0028 -0.0117 1366 THR 501 CG2 -0.0061 0.0017 -0.0114 1367 THR 501 OG1 -0.0002 0.0007 -0.0122 1368 ALA 502 N -0.0079 0.0118 -0.0113 1369 ALA 502 CA -0.0117 0.0139 -0.0108 1370 ALA 502 C -0.0151 0.0109 -0.0102 1371 ALA 502 O -0.0149 0.0078 -0.0102 1372 ALA 502 CB -0.0119 0.0167 -0.0108 1373 MET 503 N -0.0165 0.0076 -0.0086 1374 MET 503 CA -0.0183 0.0067 -0.0095 1375 MET 503 C -0.0212 0.0066 -0.0093 1376 MET 503 O -0.0221 0.0078 -0.0076 1377 MET 503 CB -0.0180 0.0076 -0.0085 1378 MET 503 CG -0.0152 0.0075 -0.0089 1379 MET 503 SD -0.0148 0.0085 -0.0077 1380 MET 503 CE -0.0150 0.0106 -0.0049 1381 ASN 504 N -0.0229 0.0054 -0.0107 1382 ASN 504 CA -0.0258 0.0053 -0.0104 1383 ASN 504 C -0.0270 0.0067 -0.0084 1384 ASN 504 O -0.0292 0.0071 -0.0075 1385 ASN 504 CB -0.0271 0.0037 -0.0124 1386 ASN 504 CG -0.0262 0.0021 -0.0145 1387 ASN 504 ND2 -0.0243 0.0015 -0.0156 1388 ASN 504 OD1 -0.0274 0.0015 -0.0152 1389 THR 505 N -0.0207 0.0071 -0.0072 1390 THR 505 CA -0.0198 0.0066 -0.0046 1391 THR 505 C -0.0194 0.0069 -0.0041 1392 THR 505 O -0.0187 0.0084 -0.0052 1393 THR 505 CB -0.0182 0.0080 -0.0035 1394 THR 505 CG2 -0.0177 0.0070 -0.0008 1395 THR 505 OG1 -0.0183 0.0085 -0.0046 1396 ILE 506 N -0.0195 0.0056 -0.0022 1397 ILE 506 CA -0.0185 0.0060 -0.0011 1398 ILE 506 C -0.0166 0.0079 -0.0001 1399 ILE 506 O -0.0159 0.0079 0.0014 1400 ILE 506 CB -0.0191 0.0041 0.0009 1401 ILE 506 CG1 -0.0210 0.0024 -0.0003 1402 ILE 506 CG2 -0.0179 0.0047 0.0023 1403 ILE 506 CD1 -0.0218 0.0004 0.0014 1404 ARG 507 N -0.0079 0.0038 -0.0015 1405 ARG 507 CA -0.0069 0.0043 -0.0013 1406 ARG 507 C -0.0066 0.0042 -0.0009 1407 ARG 507 O -0.0068 0.0046 -0.0014 1408 ARG 507 CB -0.0067 0.0053 -0.0020 1409 ARG 507 CG -0.0070 0.0055 -0.0025 1410 ARG 507 CD -0.0068 0.0065 -0.0032 1411 ARG 507 NE -0.0071 0.0067 -0.0036 1412 ARG 507 CZ -0.0067 0.0069 -0.0035 1413 ARG 507 NH1 -0.0058 0.0070 -0.0029 1414 ARG 507 NH2 -0.0071 0.0071 -0.0039 1415 SER 508 N -0.0060 0.0038 -0.0002 1416 SER 508 CA -0.0055 0.0039 0.0002 1417 SER 508 C -0.0045 0.0045 0.0004 1418 SER 508 O -0.0040 0.0044 0.0008 1419 SER 508 CB -0.0056 0.0030 0.0010 1420 SER 508 OG -0.0050 0.0030 0.0014 1421 GLY 509 N 0.0039 0.0003 0.0013 1422 GLY 509 CA 0.0035 0.0004 0.0016 1423 GLY 509 C 0.0036 0.0006 0.0023 1424 GLY 509 O 0.0036 0.0006 0.0024 1425 ALA 510 N 0.0038 0.0006 0.0026 1426 ALA 510 CA 0.0038 0.0008 0.0033 1427 ALA 510 C 0.0031 0.0009 0.0035 1428 ALA 510 O 0.0027 0.0009 0.0031 1429 ALA 510 CB 0.0041 0.0008 0.0035 1430 GLY 511 N 0.0021 0.0004 0.0081 1431 GLY 511 CA 0.0039 0.0004 0.0067 1432 GLY 511 C 0.0042 -0.0004 0.0050 1433 GLY 511 O 0.0027 -0.0014 0.0042 1434 VAL 512 N 0.0059 0.0001 0.0045 1435 VAL 512 CA 0.0064 -0.0007 0.0028 1436 VAL 512 C 0.0083 -0.0005 0.0015 1437 VAL 512 O 0.0097 0.0004 0.0023 1438 VAL 512 CB 0.0065 -0.0004 0.0032 1439 VAL 512 CG1 0.0073 -0.0009 0.0016 1440 VAL 512 CG2 0.0044 -0.0007 0.0041 1441 CYS 513 N 0.0092 -0.0024 0.0022 1442 CYS 513 CA 0.0109 -0.0031 0.0011 1443 CYS 513 C 0.0098 -0.0025 -0.0001 1444 CYS 513 O 0.0078 -0.0014 -0.0005 1445 CYS 513 CB 0.0124 -0.0037 -0.0009 1446 CYS 513 SG 0.0109 -0.0027 -0.0036 1447 VAL 514 N 0.0112 -0.0031 -0.0007 1448 VAL 514 CA 0.0105 -0.0026 -0.0023 1449 VAL 514 C 0.0112 -0.0027 -0.0050 1450 VAL 514 O 0.0131 -0.0036 -0.0056 1451 VAL 514 CB 0.0114 -0.0031 -0.0012 1452 VAL 514 CG1 0.0139 -0.0044 -0.0016 1453 VAL 514 CG2 0.0102 -0.0024 -0.0024 1454 LEU 515 N 0.0140 0.0011 -0.0086 1455 LEU 515 CA 0.0149 0.0024 -0.0095 1456 LEU 515 C 0.0129 0.0006 -0.0148 1457 LEU 515 O 0.0100 -0.0032 -0.0155 1458 LEU 515 CB 0.0143 0.0008 -0.0047 1459 LEU 515 CG 0.0147 0.0014 -0.0055 1460 LEU 515 CD1 0.0182 0.0062 -0.0050 1461 LEU 515 CD2 0.0131 -0.0014 -0.0014 1462 HIS 516 N 0.0144 0.0034 -0.0184 1463 HIS 516 CA 0.0128 0.0022 -0.0236 1464 HIS 516 C 0.0104 -0.0005 -0.0268 1465 HIS 516 O 0.0079 -0.0037 -0.0291 1466 HIS 516 CB 0.0113 -0.0000 -0.0228 1467 HIS 516 CG 0.0135 0.0025 -0.0201 1468 HIS 516 CD2 0.0167 0.0069 -0.0201 1469 HIS 516 ND1 0.0123 0.0005 -0.0182 1470 HIS 516 CE1 0.0148 0.0038 -0.0171 1471 HIS 516 NE2 0.0175 0.0077 -0.0181 1472 ASN 517 N 0.0049 -0.0048 -0.0107 1473 ASN 517 CA 0.0026 -0.0041 -0.0072 1474 ASN 517 C -0.0013 -0.0024 -0.0051 1475 ASN 517 O -0.0032 -0.0018 -0.0020 1476 ASN 517 CB 0.0022 -0.0038 -0.0085 1477 ASN 517 CG 0.0063 -0.0056 -0.0099 1478 ASN 517 ND2 0.0066 -0.0053 -0.0137 1479 ASN 517 OD1 0.0094 -0.0073 -0.0080 1480 CYS 518 N -0.0021 -0.0019 -0.0060 1481 CYS 518 CA -0.0052 -0.0006 -0.0036 1482 CYS 518 C -0.0034 -0.0018 -0.0004 1483 CYS 518 O -0.0004 -0.0032 -0.0016 1484 CYS 518 CB -0.0078 0.0010 -0.0071 1485 CYS 518 SG -0.0108 0.0028 -0.0098 1486 ILE 519 N -0.0022 0.0008 -0.0026 1487 ILE 519 CA -0.0017 0.0002 -0.0014 1488 ILE 519 C -0.0021 0.0004 -0.0015 1489 ILE 519 O -0.0033 0.0006 -0.0013 1490 ILE 519 CB -0.0024 -0.0001 0.0000 1491 ILE 519 CG1 -0.0022 -0.0003 0.0002 1492 ILE 519 CG2 -0.0018 -0.0007 0.0012 1493 ILE 519 CD1 -0.0007 -0.0007 0.0006 1494 TYR 520 N -0.0010 0.0002 -0.0018 1495 TYR 520 CA -0.0012 0.0003 -0.0018 1496 TYR 520 C -0.0011 -0.0003 -0.0003 1497 TYR 520 O -0.0001 -0.0008 0.0004 1498 TYR 520 CB -0.0000 0.0004 -0.0028 1499 TYR 520 CG -0.0003 0.0010 -0.0043 1500 TYR 520 CD1 -0.0001 0.0012 -0.0050 1501 TYR 520 CD2 -0.0008 0.0014 -0.0051 1502 TYR 520 CE1 -0.0004 0.0018 -0.0064 1503 TYR 520 CE2 -0.0011 0.0020 -0.0065 1504 TYR 520 CZ -0.0009 0.0022 -0.0072 1505 TYR 520 OH -0.0012 0.0028 -0.0085 1506 ALA 521 N -0.0066 0.0065 -0.0019 1507 ALA 521 CA -0.0064 0.0055 0.0002 1508 ALA 521 C -0.0061 0.0050 0.0019 1509 ALA 521 O -0.0073 0.0038 0.0018 1510 ALA 521 CB -0.0080 0.0039 0.0001 1511 ALA 522 N -0.0045 0.0059 0.0033 1512 ALA 522 CA -0.0039 0.0057 0.0049 1513 ALA 522 C -0.0037 0.0047 0.0072 1514 ALA 522 O -0.0028 0.0051 0.0081 1515 ALA 522 CB -0.0023 0.0075 0.0047 1516 GLY 523 N -0.0036 0.0069 0.0083 1517 GLY 523 CA -0.0032 0.0061 0.0087 1518 GLY 523 C -0.0036 0.0053 0.0077 1519 GLY 523 O -0.0040 0.0048 0.0068 1520 GLY 524 N -0.0035 0.0053 0.0079 1521 GLY 524 CA -0.0037 0.0044 0.0071 1522 GLY 524 C -0.0032 0.0031 0.0076 1523 GLY 524 O -0.0025 0.0029 0.0087 1524 TYR 525 N -0.0015 0.0061 0.0052 1525 TYR 525 CA 0.0001 0.0035 0.0050 1526 TYR 525 C -0.0014 0.0022 0.0042 1527 TYR 525 O -0.0039 0.0017 0.0032 1528 TYR 525 CB 0.0004 0.0013 0.0045 1529 TYR 525 CG 0.0022 -0.0014 0.0044 1530 TYR 525 CD1 0.0051 -0.0013 0.0054 1531 TYR 525 CD2 0.0010 -0.0040 0.0032 1532 TYR 525 CE1 0.0069 -0.0038 0.0053 1533 TYR 525 CE2 0.0028 -0.0066 0.0031 1534 TYR 525 CZ 0.0058 -0.0064 0.0042 1535 TYR 525 OH 0.0075 -0.0088 0.0041 1536 ASP 526 N 0.0000 0.0017 0.0045 1537 ASP 526 CA -0.0012 0.0008 0.0039 1538 ASP 526 C -0.0013 -0.0024 0.0029 1539 ASP 526 O -0.0028 -0.0035 0.0021 1540 ASP 526 CB 0.0003 0.0021 0.0047 1541 ASP 526 CG 0.0034 0.0010 0.0054 1542 ASP 526 OD1 0.0044 -0.0012 0.0052 1543 ASP 526 OD2 0.0048 0.0020 0.0062 1544 GLY 527 N 0.0011 -0.0038 0.0021 1545 GLY 527 CA 0.0022 -0.0078 -0.0007 1546 GLY 527 C 0.0064 -0.0098 0.0010 1547 GLY 527 O 0.0070 -0.0124 -0.0009 1548 GLN 528 N 0.0090 -0.0082 0.0046 1549 GLN 528 CA 0.0131 -0.0096 0.0068 1550 GLN 528 C 0.0137 -0.0064 0.0103 1551 GLN 528 O 0.0142 -0.0066 0.0105 1552 GLN 528 CB 0.0161 -0.0112 0.0079 1553 GLN 528 CG 0.0157 -0.0145 0.0045 1554 GLN 528 CD 0.0120 -0.0133 0.0024 1555 GLN 528 NE2 0.0103 -0.0099 0.0042 1556 GLN 528 OE1 0.0102 -0.0154 -0.0010 1557 ASP 529 N 0.0094 -0.0058 0.0068 1558 ASP 529 CA 0.0096 -0.0042 0.0086 1559 ASP 529 C 0.0067 -0.0028 0.0096 1560 ASP 529 O 0.0047 -0.0026 0.0094 1561 ASP 529 CB 0.0120 -0.0031 0.0104 1562 ASP 529 CG 0.0150 -0.0044 0.0096 1563 ASP 529 OD1 0.0159 -0.0049 0.0092 1564 ASP 529 OD2 0.0163 -0.0048 0.0093 1565 GLN 530 N 0.0065 -0.0018 0.0107 1566 GLN 530 CA 0.0044 -0.0000 0.0122 1567 GLN 530 C 0.0052 0.0018 0.0144 1568 GLN 530 O 0.0077 0.0022 0.0155 1569 GLN 530 CB 0.0039 0.0005 0.0127 1570 GLN 530 CG 0.0015 -0.0007 0.0109 1571 GLN 530 CD 0.0026 -0.0028 0.0087 1572 GLN 530 NE2 0.0007 -0.0039 0.0071 1573 GLN 530 OE1 0.0052 -0.0035 0.0085 1574 LEU 531 N -0.0028 0.0043 0.0122 1575 LEU 531 CA -0.0028 0.0050 0.0124 1576 LEU 531 C -0.0027 0.0061 0.0129 1577 LEU 531 O -0.0030 0.0065 0.0129 1578 LEU 531 CB -0.0038 0.0051 0.0118 1579 LEU 531 CG -0.0040 0.0040 0.0113 1580 LEU 531 CD1 -0.0051 0.0041 0.0107 1581 LEU 531 CD2 -0.0035 0.0036 0.0114 1582 ASN 532 N -0.0023 0.0066 0.0134 1583 ASN 532 CA -0.0023 0.0077 0.0138 1584 ASN 532 C -0.0030 0.0082 0.0136 1585 ASN 532 O -0.0032 0.0091 0.0139 1586 ASN 532 CB -0.0013 0.0079 0.0145 1587 ASN 532 CG -0.0007 0.0074 0.0146 1588 ASN 532 ND2 -0.0010 0.0073 0.0144 1589 ASN 532 OD1 0.0001 0.0070 0.0149 1590 SER 533 N -0.0093 0.0041 0.0116 1591 SER 533 CA -0.0102 0.0040 0.0093 1592 SER 533 C -0.0090 0.0052 0.0081 1593 SER 533 O -0.0079 0.0057 0.0091 1594 SER 533 CB -0.0121 0.0026 0.0092 1595 SER 533 OG -0.0121 0.0024 0.0102 1596 VAL 534 N -0.0091 0.0056 0.0059 1597 VAL 534 CA -0.0081 0.0067 0.0045 1598 VAL 534 C -0.0094 0.0062 0.0025 1599 VAL 534 O -0.0105 0.0056 0.0015 1600 VAL 534 CB -0.0066 0.0081 0.0037 1601 VAL 534 CG1 -0.0054 0.0093 0.0024 1602 VAL 534 CG2 -0.0053 0.0085 0.0057 1603 GLU 535 N -0.0178 0.0028 -0.0061 1604 GLU 535 CA -0.0180 0.0028 -0.0065 1605 GLU 535 C -0.0166 0.0025 -0.0066 1606 GLU 535 O -0.0155 0.0025 -0.0059 1607 GLU 535 CB -0.0190 0.0032 -0.0054 1608 GLU 535 CG -0.0185 0.0035 -0.0038 1609 GLU 535 CD -0.0197 0.0039 -0.0029 1610 GLU 535 OE1 -0.0204 0.0040 -0.0031 1611 GLU 535 OE2 -0.0202 0.0042 -0.0020 1612 ARG 536 N -0.0165 0.0023 -0.0076 1613 ARG 536 CA -0.0152 0.0020 -0.0078 1614 ARG 536 C -0.0155 0.0021 -0.0076 1615 ARG 536 O -0.0167 0.0022 -0.0080 1616 ARG 536 CB -0.0146 0.0015 -0.0093 1617 ARG 536 CG -0.0155 0.0014 -0.0106 1618 ARG 536 CD -0.0148 0.0009 -0.0120 1619 ARG 536 NE -0.0157 0.0007 -0.0133 1620 ARG 536 CZ -0.0158 0.0004 -0.0145 1621 ARG 536 NH1 -0.0150 0.0002 -0.0149 1622 ARG 536 NH2 -0.0167 0.0003 -0.0155 1623 TYR 537 N -0.0195 -0.0026 -0.0030 1624 TYR 537 CA -0.0168 -0.0026 -0.0027 1625 TYR 537 C -0.0181 -0.0040 0.0011 1626 TYR 537 O -0.0220 -0.0043 0.0017 1627 TYR 537 CB -0.0176 -0.0013 -0.0066 1628 TYR 537 CG -0.0146 -0.0011 -0.0070 1629 TYR 537 CD1 -0.0101 -0.0007 -0.0077 1630 TYR 537 CD2 -0.0164 -0.0011 -0.0071 1631 TYR 537 CE1 -0.0075 -0.0003 -0.0086 1632 TYR 537 CE2 -0.0137 -0.0007 -0.0080 1633 TYR 537 CZ -0.0092 -0.0003 -0.0087 1634 TYR 537 OH -0.0063 0.0000 -0.0094 1635 ASP 538 N -0.0148 -0.0047 0.0034 1636 ASP 538 CA -0.0151 -0.0058 0.0065 1637 ASP 538 C -0.0129 -0.0052 0.0050 1638 ASP 538 O -0.0091 -0.0046 0.0037 1639 ASP 538 CB -0.0131 -0.0071 0.0106 1640 ASP 538 CG -0.0135 -0.0084 0.0143 1641 ASP 538 OD1 -0.0121 -0.0096 0.0176 1642 ASP 538 OD2 -0.0143 -0.0082 0.0135 1643 VAL 539 N -0.0163 -0.0081 0.0185 1644 VAL 539 CA -0.0196 -0.0095 0.0080 1645 VAL 539 C -0.0163 -0.0107 0.0108 1646 VAL 539 O -0.0154 -0.0141 0.0021 1647 VAL 539 CB -0.0321 -0.0032 0.0032 1648 VAL 539 CG1 -0.0359 -0.0025 -0.0018 1649 VAL 539 CG2 -0.0392 0.0044 0.0128 1650 GLU 540 N -0.0145 -0.0079 0.0224 1651 GLU 540 CA -0.0111 -0.0089 0.0260 1652 GLU 540 C 0.0012 -0.0167 0.0256 1653 GLU 540 O 0.0043 -0.0197 0.0225 1654 GLU 540 CB -0.0137 -0.0029 0.0389 1655 GLU 540 CG -0.0262 0.0050 0.0391 1656 GLU 540 CD -0.0295 0.0110 0.0507 1657 GLU 540 OE1 -0.0243 0.0093 0.0554 1658 GLU 540 OE2 -0.0388 0.0176 0.0531 1659 THR 541 N 0.0035 -0.0256 0.0187 1660 THR 541 CA 0.0137 -0.0348 0.0189 1661 THR 541 C 0.0170 -0.0321 0.0073 1662 THR 541 O 0.0250 -0.0390 0.0070 1663 THR 541 CB 0.0116 -0.0401 0.0333 1664 THR 541 CG2 0.0075 -0.0427 0.0459 1665 THR 541 OG1 0.0030 -0.0335 0.0353 1666 GLU 542 N 0.0100 -0.0217 -0.0009 1667 GLU 542 CA 0.0110 -0.0173 -0.0116 1668 GLU 542 C 0.0115 -0.0205 -0.0062 1669 GLU 542 O 0.0160 -0.0204 -0.0143 1670 GLU 542 CB 0.0207 -0.0192 -0.0254 1671 GLU 542 CG 0.0186 -0.0141 -0.0317 1672 GLU 542 CD 0.0273 -0.0146 -0.0463 1673 GLU 542 OE1 0.0374 -0.0220 -0.0496 1674 GLU 542 OE2 0.0235 -0.0072 -0.0547 1675 THR 543 N -0.0009 -0.0102 -0.0040 1676 THR 543 CA -0.0054 -0.0089 -0.0051 1677 THR 543 C -0.0094 -0.0088 -0.0062 1678 THR 543 O -0.0101 -0.0122 -0.0068 1679 THR 543 CB -0.0064 -0.0123 -0.0058 1680 THR 543 CG2 -0.0110 -0.0113 -0.0070 1681 THR 543 OG1 -0.0031 -0.0119 -0.0048 1682 TRP 544 N -0.0124 -0.0050 -0.0067 1683 TRP 544 CA -0.0169 -0.0049 -0.0080 1684 TRP 544 C -0.0207 -0.0070 -0.0093 1685 TRP 544 O -0.0218 -0.0050 -0.0094 1686 TRP 544 CB -0.0183 0.0003 -0.0078 1687 TRP 544 CG -0.0155 0.0024 -0.0068 1688 TRP 544 CD1 -0.0117 0.0050 -0.0054 1689 TRP 544 CD2 -0.0162 0.0021 -0.0070 1690 TRP 544 CE2 -0.0127 0.0047 -0.0057 1691 TRP 544 CE3 -0.0195 -0.0001 -0.0082 1692 TRP 544 NE1 -0.0100 0.0063 -0.0048 1693 TRP 544 CZ2 -0.0124 0.0052 -0.0056 1694 TRP 544 CZ3 -0.0192 0.0004 -0.0081 1695 TRP 544 CH2 -0.0158 0.0030 -0.0068 1696 THR 545 N -0.0242 -0.0043 -0.0130 1697 THR 545 CA -0.0256 -0.0051 -0.0134 1698 THR 545 C -0.0252 -0.0045 -0.0117 1699 THR 545 O -0.0234 -0.0034 -0.0116 1700 THR 545 CB -0.0252 -0.0056 -0.0159 1701 THR 545 CG2 -0.0267 -0.0066 -0.0165 1702 THR 545 OG1 -0.0255 -0.0062 -0.0174 1703 PHE 546 N -0.0269 -0.0052 -0.0106 1704 PHE 546 CA -0.0267 -0.0047 -0.0093 1705 PHE 546 C -0.0260 -0.0047 -0.0109 1706 PHE 546 O -0.0268 -0.0057 -0.0126 1707 PHE 546 CB -0.0288 -0.0056 -0.0078 1708 PHE 546 CG -0.0293 -0.0053 -0.0058 1709 PHE 546 CD1 -0.0283 -0.0042 -0.0038 1710 PHE 546 CD2 -0.0308 -0.0062 -0.0058 1711 PHE 546 CE1 -0.0288 -0.0040 -0.0019 1712 PHE 546 CE2 -0.0313 -0.0060 -0.0040 1713 PHE 546 CZ -0.0303 -0.0049 -0.0020 1714 VAL 547 N -0.0116 0.0041 -0.0003 1715 VAL 547 CA -0.0098 0.0069 0.0002 1716 VAL 547 C -0.0082 0.0062 0.0047 1717 VAL 547 O -0.0087 0.0034 0.0070 1718 VAL 547 CB -0.0082 0.0111 -0.0013 1719 VAL 547 CG1 -0.0098 0.0118 -0.0057 1720 VAL 547 CG2 -0.0066 0.0121 0.0011 1721 ALA 548 N -0.0064 0.0086 0.0059 1722 ALA 548 CA -0.0047 0.0081 0.0101 1723 ALA 548 C -0.0036 0.0078 0.0129 1724 ALA 548 O -0.0027 0.0101 0.0122 1725 ALA 548 CB -0.0026 0.0115 0.0106 1726 PRO 549 N -0.0047 0.0138 0.0125 1727 PRO 549 CA -0.0042 0.0127 0.0129 1728 PRO 549 C -0.0030 0.0131 0.0131 1729 PRO 549 O -0.0023 0.0140 0.0131 1730 PRO 549 CB -0.0039 0.0119 0.0133 1731 PRO 549 CG -0.0035 0.0128 0.0131 1732 PRO 549 CD -0.0044 0.0138 0.0126 1733 MET 550 N -0.0028 0.0123 0.0134 1734 MET 550 CA -0.0016 0.0123 0.0137 1735 MET 550 C -0.0005 0.0121 0.0140 1736 MET 550 O -0.0008 0.0115 0.0141 1737 MET 550 CB -0.0017 0.0114 0.0139 1738 MET 550 CG -0.0028 0.0116 0.0136 1739 MET 550 SD -0.0030 0.0104 0.0139 1740 MET 550 CE -0.0034 0.0090 0.0141 1741 LYS 551 N -0.0015 0.0138 0.0118 1742 LYS 551 CA -0.0011 0.0152 0.0080 1743 LYS 551 C -0.0011 0.0149 0.0072 1744 LYS 551 O -0.0009 0.0175 0.0056 1745 LYS 551 CB -0.0008 0.0129 0.0051 1746 LYS 551 CG -0.0008 0.0143 0.0046 1747 LYS 551 CD -0.0011 0.0140 0.0081 1748 LYS 551 CE -0.0011 0.0155 0.0072 1749 LYS 551 NZ -0.0014 0.0158 0.0106 1750 HIS 552 N -0.0012 0.0119 0.0085 1751 HIS 552 CA -0.0011 0.0112 0.0079 1752 HIS 552 C -0.0015 0.0116 0.0115 1753 HIS 552 O -0.0017 0.0094 0.0142 1754 HIS 552 CB -0.0009 0.0074 0.0060 1755 HIS 552 CG -0.0006 0.0071 0.0025 1756 HIS 552 CD2 -0.0005 0.0049 0.0020 1757 HIS 552 ND1 -0.0003 0.0090 -0.0009 1758 HIS 552 CE1 -0.0000 0.0080 -0.0033 1759 HIS 552 NE2 -0.0002 0.0055 -0.0016 1760 ARG 553 N -0.0004 0.0016 0.0122 1761 ARG 553 CA -0.0010 0.0009 0.0120 1762 ARG 553 C -0.0013 0.0003 0.0119 1763 ARG 553 O -0.0007 0.0001 0.0118 1764 ARG 553 CB -0.0007 0.0005 0.0119 1765 ARG 553 CG -0.0000 -0.0002 0.0117 1766 ARG 553 CD 0.0004 -0.0006 0.0116 1767 ARG 553 NE 0.0009 -0.0013 0.0115 1768 ARG 553 CZ 0.0017 -0.0012 0.0115 1769 ARG 553 NH1 0.0021 -0.0005 0.0116 1770 ARG 553 NH2 0.0021 -0.0019 0.0113 1771 ARG 554 N -0.0021 0.0001 0.0118 1772 ARG 554 CA -0.0024 -0.0004 0.0117 1773 ARG 554 C -0.0033 -0.0009 0.0116 1774 ARG 554 O -0.0039 -0.0004 0.0117 1775 ARG 554 CB -0.0025 0.0001 0.0118 1776 ARG 554 CG -0.0030 0.0009 0.0121 1777 ARG 554 CD -0.0029 0.0014 0.0122 1778 ARG 554 NE -0.0021 0.0019 0.0123 1779 ARG 554 CZ -0.0018 0.0022 0.0123 1780 ARG 554 NH1 -0.0020 0.0019 0.0123 1781 ARG 554 NH2 -0.0012 0.0028 0.0125 1782 SER 555 N 0.0011 -0.0021 0.0076 1783 SER 555 CA 0.0015 -0.0022 0.0083 1784 SER 555 C 0.0016 -0.0028 0.0083 1785 SER 555 O 0.0013 -0.0030 0.0077 1786 SER 555 CB 0.0016 -0.0013 0.0086 1787 SER 555 OG 0.0013 -0.0010 0.0083 1788 ALA 556 N 0.0020 -0.0030 0.0089 1789 ALA 556 CA 0.0021 -0.0037 0.0089 1790 ALA 556 C 0.0020 -0.0045 0.0085 1791 ALA 556 O 0.0018 -0.0049 0.0082 1792 ALA 556 CB 0.0020 -0.0034 0.0088 1793 LEU 557 N 0.0014 -0.0021 0.0091 1794 LEU 557 CA 0.0021 -0.0020 0.0080 1795 LEU 557 C 0.0026 -0.0025 0.0084 1796 LEU 557 O 0.0020 -0.0026 0.0092 1797 LEU 557 CB 0.0015 -0.0011 0.0070 1798 LEU 557 CG 0.0004 -0.0006 0.0074 1799 LEU 557 CD1 0.0001 0.0002 0.0062 1800 LEU 557 CD2 -0.0007 -0.0002 0.0080 1801 GLY 558 N 0.0035 -0.0027 0.0077 1802 GLY 558 CA 0.0038 -0.0028 0.0076 1803 GLY 558 C 0.0032 -0.0020 0.0067 1804 GLY 558 O 0.0030 -0.0015 0.0058 1805 ILE 559 N 0.0097 -0.0001 0.0043 1806 ILE 559 CA 0.0093 0.0008 0.0034 1807 ILE 559 C 0.0093 0.0019 0.0027 1808 ILE 559 O 0.0090 0.0018 0.0026 1809 ILE 559 CB 0.0080 0.0002 0.0030 1810 ILE 559 CG1 0.0076 0.0011 0.0022 1811 ILE 559 CG2 0.0069 -0.0002 0.0025 1812 ILE 559 CD1 0.0065 0.0004 0.0019 1813 THR 560 N 0.0095 0.0031 0.0021 1814 THR 560 CA 0.0094 0.0042 0.0013 1815 THR 560 C 0.0092 0.0052 0.0005 1816 THR 560 O 0.0093 0.0051 0.0007 1817 THR 560 CB 0.0105 0.0047 0.0017 1818 THR 560 CG2 0.0117 0.0054 0.0020 1819 THR 560 OG1 0.0102 0.0055 0.0009 1820 VAL 561 N 0.0154 0.0065 -0.0006 1821 VAL 561 CA 0.0156 0.0063 0.0012 1822 VAL 561 C 0.0139 0.0056 0.0018 1823 VAL 561 O 0.0128 0.0053 0.0017 1824 VAL 561 CB 0.0164 0.0064 0.0023 1825 VAL 561 CG1 0.0164 0.0061 0.0042 1826 VAL 561 CG2 0.0181 0.0070 0.0019 1827 HIS 562 N 0.0139 0.0055 0.0025 1828 HIS 562 CA 0.0125 0.0049 0.0034 1829 HIS 562 C 0.0130 0.0048 0.0051 1830 HIS 562 O 0.0141 0.0052 0.0052 1831 HIS 562 CB 0.0115 0.0048 0.0022 1832 HIS 562 CG 0.0101 0.0042 0.0030 1833 HIS 562 CD2 0.0085 0.0037 0.0024 1834 HIS 562 ND1 0.0101 0.0040 0.0043 1835 HIS 562 CE1 0.0085 0.0034 0.0044 1836 HIS 562 NE2 0.0076 0.0033 0.0033 1837 GLN 563 N 0.0130 0.0105 0.0063 1838 GLN 563 CA 0.0133 0.0090 0.0080 1839 GLN 563 C 0.0153 0.0084 0.0084 1840 GLN 563 O 0.0152 0.0074 0.0095 1841 GLN 563 CB 0.0113 0.0082 0.0089 1842 GLN 563 CG 0.0097 0.0083 0.0090 1843 GLN 563 CD 0.0076 0.0078 0.0097 1844 GLN 563 NE2 0.0059 0.0083 0.0094 1845 GLN 563 OE1 0.0073 0.0069 0.0107 1846 GLY 564 N 0.0171 0.0091 0.0075 1847 GLY 564 CA 0.0191 0.0086 0.0078 1848 GLY 564 C 0.0192 0.0091 0.0073 1849 GLY 564 O 0.0207 0.0086 0.0077 1850 ARG 565 N 0.0126 0.0076 0.0064 1851 ARG 565 CA 0.0122 0.0066 0.0076 1852 ARG 565 C 0.0123 0.0073 0.0075 1853 ARG 565 O 0.0123 0.0090 0.0073 1854 ARG 565 CB 0.0117 0.0067 0.0096 1855 ARG 565 CG 0.0117 0.0058 0.0097 1856 ARG 565 CD 0.0111 0.0058 0.0118 1857 ARG 565 NE 0.0111 0.0051 0.0119 1858 ARG 565 CZ 0.0108 0.0056 0.0129 1859 ARG 565 NH1 0.0105 0.0069 0.0142 1860 ARG 565 NH2 0.0108 0.0046 0.0130 1861 ILE 566 N 0.0122 0.0060 0.0076 1862 ILE 566 CA 0.0122 0.0065 0.0078 1863 ILE 566 C 0.0117 0.0072 0.0097 1864 ILE 566 O 0.0113 0.0063 0.0110 1865 ILE 566 CB 0.0123 0.0049 0.0072 1866 ILE 566 CG1 0.0129 0.0047 0.0051 1867 ILE 566 CG2 0.0122 0.0051 0.0078 1868 ILE 566 CD1 0.0131 0.0028 0.0043 1869 TYR 567 N 0.0068 0.0021 0.0065 1870 TYR 567 CA 0.0071 0.0020 0.0071 1871 TYR 567 C 0.0066 0.0020 0.0087 1872 TYR 567 O 0.0071 0.0019 0.0096 1873 TYR 567 CB 0.0087 0.0018 0.0069 1874 TYR 567 CG 0.0092 0.0018 0.0053 1875 TYR 567 CD1 0.0094 0.0018 0.0044 1876 TYR 567 CD2 0.0096 0.0018 0.0047 1877 TYR 567 CE1 0.0099 0.0018 0.0029 1878 TYR 567 CE2 0.0101 0.0018 0.0032 1879 TYR 567 CZ 0.0103 0.0018 0.0024 1880 TYR 567 OH 0.0108 0.0018 0.0009 1881 VAL 568 N 0.0057 0.0022 0.0091 1882 VAL 568 CA 0.0054 0.0021 0.0106 1883 VAL 568 C 0.0062 0.0020 0.0110 1884 VAL 568 O 0.0062 0.0020 0.0102 1885 VAL 568 CB 0.0037 0.0024 0.0109 1886 VAL 568 CG1 0.0029 0.0025 0.0106 1887 VAL 568 CG2 0.0030 0.0025 0.0100 1888 LEU 569 N -0.0025 -0.0053 0.0014 1889 LEU 569 CA -0.0012 -0.0050 0.0029 1890 LEU 569 C -0.0021 -0.0054 0.0051 1891 LEU 569 O -0.0023 -0.0056 0.0059 1892 LEU 569 CB 0.0009 -0.0042 0.0029 1893 LEU 569 CG 0.0020 -0.0037 0.0008 1894 LEU 569 CD1 0.0015 -0.0037 -0.0009 1895 LEU 569 CD2 0.0042 -0.0029 0.0013 1896 GLY 570 N -0.0023 -0.0056 0.0061 1897 GLY 570 CA -0.0028 -0.0059 0.0083 1898 GLY 570 C -0.0046 -0.0067 0.0089 1899 GLY 570 O -0.0061 -0.0071 0.0077 1900 GLY 571 N -0.0055 -0.0076 0.0099 1901 GLY 571 CA -0.0042 -0.0071 0.0091 1902 GLY 571 C -0.0042 -0.0065 0.0081 1903 GLY 571 O -0.0053 -0.0064 0.0077 1904 TYR 572 N -0.0028 -0.0061 0.0076 1905 TYR 572 CA -0.0025 -0.0055 0.0066 1906 TYR 572 C -0.0011 -0.0056 0.0071 1907 TYR 572 O -0.0001 -0.0058 0.0077 1908 TYR 572 CB -0.0024 -0.0048 0.0053 1909 TYR 572 CG -0.0020 -0.0041 0.0042 1910 TYR 572 CD1 -0.0031 -0.0040 0.0037 1911 TYR 572 CD2 -0.0007 -0.0037 0.0036 1912 TYR 572 CE1 -0.0029 -0.0034 0.0026 1913 TYR 572 CE2 -0.0004 -0.0031 0.0025 1914 TYR 572 CZ -0.0015 -0.0029 0.0020 1915 TYR 572 OH -0.0012 -0.0023 0.0010 1916 ASP 573 N -0.0022 -0.0067 0.0083 1917 ASP 573 CA 0.0000 -0.0067 0.0091 1918 ASP 573 C 0.0013 -0.0056 0.0072 1919 ASP 573 O 0.0028 -0.0056 0.0075 1920 ASP 573 CB -0.0004 -0.0075 0.0108 1921 ASP 573 CG -0.0018 -0.0073 0.0099 1922 ASP 573 OD1 -0.0028 -0.0066 0.0080 1923 ASP 573 OD2 -0.0013 -0.0076 0.0107 1924 GLY 574 N 0.0007 -0.0049 0.0052 1925 GLY 574 CA 0.0015 -0.0039 0.0032 1926 GLY 574 C -0.0000 -0.0037 0.0021 1927 GLY 574 O -0.0003 -0.0028 0.0001 1928 HIS 575 N -0.0028 -0.0014 -0.0002 1929 HIS 575 CA -0.0098 -0.0004 -0.0006 1930 HIS 575 C -0.0160 -0.0013 0.0004 1931 HIS 575 O -0.0214 0.0016 -0.0014 1932 HIS 575 CB -0.0103 -0.0044 0.0024 1933 HIS 575 CG -0.0048 -0.0034 0.0014 1934 HIS 575 CD2 0.0019 -0.0057 0.0027 1935 HIS 575 ND1 -0.0054 0.0005 -0.0014 1936 HIS 575 CE1 0.0009 0.0004 -0.0016 1937 HIS 575 NE2 0.0054 -0.0033 0.0008 1938 THR 576 N -0.0151 -0.0052 0.0031 1939 THR 576 CA -0.0206 -0.0072 0.0048 1940 THR 576 C -0.0180 -0.0078 0.0051 1941 THR 576 O -0.0117 -0.0079 0.0049 1942 THR 576 CB -0.0236 -0.0130 0.0091 1943 THR 576 CG2 -0.0263 -0.0129 0.0091 1944 THR 576 OG1 -0.0186 -0.0175 0.0121 1945 PHE 577 N -0.0159 -0.0030 0.0021 1946 PHE 577 CA -0.0149 -0.0048 0.0034 1947 PHE 577 C -0.0155 -0.0074 0.0036 1948 PHE 577 O -0.0173 -0.0084 0.0024 1949 PHE 577 CB -0.0154 -0.0050 0.0031 1950 PHE 577 CG -0.0146 -0.0025 0.0031 1951 PHE 577 CD1 -0.0157 -0.0004 0.0017 1952 PHE 577 CD2 -0.0127 -0.0023 0.0045 1953 PHE 577 CE1 -0.0149 0.0019 0.0017 1954 PHE 577 CE2 -0.0119 0.0000 0.0045 1955 PHE 577 CZ -0.0130 0.0021 0.0031 1956 LEU 578 N -0.0140 -0.0085 0.0050 1957 LEU 578 CA -0.0145 -0.0108 0.0053 1958 LEU 578 C -0.0150 -0.0131 0.0055 1959 LEU 578 O -0.0140 -0.0134 0.0063 1960 LEU 578 CB -0.0126 -0.0110 0.0069 1961 LEU 578 CG -0.0122 -0.0092 0.0067 1962 LEU 578 CD1 -0.0113 -0.0065 0.0067 1963 LEU 578 CD2 -0.0107 -0.0101 0.0081 1964 ASP 579 N -0.0120 -0.0051 -0.0044 1965 ASP 579 CA -0.0122 -0.0086 -0.0042 1966 ASP 579 C -0.0119 -0.0085 -0.0026 1967 ASP 579 O -0.0118 -0.0111 -0.0011 1968 ASP 579 CB -0.0129 -0.0102 -0.0078 1969 ASP 579 CG -0.0133 -0.0080 -0.0106 1970 ASP 579 OD1 -0.0129 -0.0050 -0.0097 1971 ASP 579 OD2 -0.0138 -0.0092 -0.0136 1972 SER 580 N -0.0117 -0.0054 -0.0025 1973 SER 580 CA -0.0115 -0.0046 -0.0012 1974 SER 580 C -0.0109 -0.0061 0.0024 1975 SER 580 O -0.0105 -0.0052 0.0050 1976 SER 580 CB -0.0112 -0.0006 -0.0011 1977 SER 580 OG -0.0110 0.0000 0.0000 1978 VAL 581 N -0.0039 -0.0002 -0.0006 1979 VAL 581 CA -0.0033 -0.0013 0.0024 1980 VAL 581 C -0.0029 -0.0000 0.0031 1981 VAL 581 O -0.0034 -0.0010 0.0019 1982 VAL 581 CB -0.0039 -0.0047 0.0028 1983 VAL 581 CG1 -0.0033 -0.0057 0.0059 1984 VAL 581 CG2 -0.0044 -0.0059 0.0021 1985 GLU 582 N -0.0020 0.0020 0.0051 1986 GLU 582 CA -0.0014 0.0031 0.0062 1987 GLU 582 C -0.0010 0.0016 0.0092 1988 GLU 582 O -0.0006 0.0011 0.0110 1989 GLU 582 CB -0.0007 0.0065 0.0063 1990 GLU 582 CG -0.0012 0.0082 0.0034 1991 GLU 582 CD -0.0004 0.0115 0.0038 1992 GLU 582 OE1 0.0000 0.0126 0.0047 1993 GLU 582 OE2 -0.0004 0.0131 0.0029 1994 CYS 583 N 0.0038 0.0086 0.0090 1995 CYS 583 CA 0.0053 0.0074 0.0087 1996 CYS 583 C 0.0048 0.0072 0.0083 1997 CYS 583 O 0.0032 0.0069 0.0075 1998 CYS 583 CB 0.0056 0.0058 0.0076 1999 CYS 583 SG 0.0075 0.0043 0.0072 2000 TYR 584 N 0.0060 0.0074 0.0090 2001 TYR 584 CA 0.0058 0.0070 0.0086 2002 TYR 584 C 0.0071 0.0053 0.0078 2003 TYR 584 O 0.0088 0.0050 0.0083 2004 TYR 584 CB 0.0065 0.0082 0.0098 2005 TYR 584 CG 0.0064 0.0079 0.0096 2006 TYR 584 CD1 0.0047 0.0082 0.0090 2007 TYR 584 CD2 0.0081 0.0075 0.0099 2008 TYR 584 CE1 0.0046 0.0080 0.0089 2009 TYR 584 CE2 0.0080 0.0073 0.0097 2010 TYR 584 CZ 0.0063 0.0076 0.0092 2011 TYR 584 OH 0.0062 0.0075 0.0091 2012 ASP 585 N 0.0074 0.0068 0.0116 2013 ASP 585 CA 0.0084 0.0050 0.0109 2014 ASP 585 C 0.0103 0.0027 0.0095 2015 ASP 585 O 0.0096 0.0005 0.0102 2016 ASP 585 CB 0.0065 0.0036 0.0125 2017 ASP 585 CG 0.0075 0.0022 0.0119 2018 ASP 585 OD1 0.0096 0.0024 0.0101 2019 ASP 585 OD2 0.0059 0.0017 0.0132 2020 PRO 586 N 0.0125 0.0032 0.0075 2021 PRO 586 CA 0.0144 0.0013 0.0061 2022 PRO 586 C 0.0145 -0.0019 0.0063 2023 PRO 586 O 0.0152 -0.0040 0.0059 2024 PRO 586 CB 0.0166 0.0029 0.0041 2025 PRO 586 CG 0.0159 0.0043 0.0046 2026 PRO 586 CD 0.0135 0.0055 0.0066 2027 ASP 587 N 0.0198 -0.0058 0.0128 2028 ASP 587 CA 0.0198 -0.0128 0.0136 2029 ASP 587 C 0.0151 -0.0148 0.0142 2030 ASP 587 O 0.0156 -0.0202 0.0148 2031 ASP 587 CB 0.0181 -0.0162 0.0141 2032 ASP 587 CG 0.0228 -0.0152 0.0136 2033 ASP 587 OD1 0.0275 -0.0115 0.0128 2034 ASP 587 OD2 0.0218 -0.0185 0.0141 2035 THR 588 N 0.0108 -0.0105 0.0140 2036 THR 588 CA 0.0064 -0.0115 0.0145 2037 THR 588 C 0.0073 -0.0068 0.0139 2038 THR 588 O 0.0043 -0.0077 0.0142 2039 THR 588 CB -0.0007 -0.0112 0.0150 2040 THR 588 CG2 -0.0024 -0.0160 0.0157 2041 THR 588 OG1 -0.0026 -0.0051 0.0145 2042 ASP 589 N 0.0031 0.0059 0.0086 2043 ASP 589 CA 0.0023 0.0078 0.0098 2044 ASP 589 C 0.0005 0.0085 0.0097 2045 ASP 589 O -0.0011 0.0094 0.0099 2046 ASP 589 CB 0.0018 0.0082 0.0100 2047 ASP 589 CG 0.0013 0.0102 0.0114 2048 ASP 589 OD1 0.0022 0.0110 0.0124 2049 ASP 589 OD2 0.0005 0.0107 0.0115 2050 THR 590 N 0.0008 0.0081 0.0095 2051 THR 590 CA -0.0007 0.0087 0.0095 2052 THR 590 C 0.0003 0.0095 0.0104 2053 THR 590 O 0.0019 0.0087 0.0104 2054 THR 590 CB -0.0020 0.0075 0.0080 2055 THR 590 CG2 -0.0031 0.0069 0.0071 2056 THR 590 OG1 -0.0009 0.0062 0.0073 2057 TRP 591 N 0.0002 0.0122 0.0103 2058 TRP 591 CA -0.0001 0.0116 0.0096 2059 TRP 591 C -0.0006 0.0111 0.0084 2060 TRP 591 O -0.0007 0.0118 0.0077 2061 TRP 591 CB -0.0000 0.0125 0.0093 2062 TRP 591 CG 0.0004 0.0129 0.0104 2063 TRP 591 CD1 0.0008 0.0139 0.0111 2064 TRP 591 CD2 0.0004 0.0123 0.0110 2065 TRP 591 CE2 0.0009 0.0130 0.0120 2066 TRP 591 CE3 0.0001 0.0112 0.0107 2067 TRP 591 NE1 0.0011 0.0140 0.0120 2068 TRP 591 CZ2 0.0010 0.0126 0.0128 2069 TRP 591 CZ3 0.0003 0.0109 0.0115 2070 TRP 591 CH2 0.0007 0.0116 0.0125 2071 SER 592 N -0.0010 0.0101 0.0080 2072 SER 592 CA -0.0014 0.0097 0.0067 2073 SER 592 C -0.0017 0.0091 0.0062 2074 SER 592 O -0.0016 0.0086 0.0069 2075 SER 592 CB -0.0017 0.0088 0.0066 2076 SER 592 OG -0.0017 0.0076 0.0073 2077 GLU 593 N -0.0071 0.0063 -0.0039 2078 GLU 593 CA -0.0066 0.0038 -0.0045 2079 GLU 593 C -0.0061 0.0007 -0.0058 2080 GLU 593 O -0.0061 0.0007 -0.0085 2081 GLU 593 CB -0.0069 0.0050 -0.0068 2082 GLU 593 CG -0.0065 0.0027 -0.0069 2083 GLU 593 CD -0.0068 0.0042 -0.0089 2084 GLU 593 OE1 -0.0069 0.0042 -0.0120 2085 GLU 593 OE2 -0.0068 0.0044 -0.0074 2086 VAL 594 N -0.0056 -0.0019 -0.0037 2087 VAL 594 CA -0.0050 -0.0049 -0.0045 2088 VAL 594 C -0.0045 -0.0075 -0.0060 2089 VAL 594 O -0.0042 -0.0096 -0.0078 2090 VAL 594 CB -0.0047 -0.0062 -0.0014 2091 VAL 594 CG1 -0.0051 -0.0039 -0.0002 2092 VAL 594 CG2 -0.0045 -0.0068 0.0016 2093 THR 595 N -0.0095 -0.0137 -0.0128 2094 THR 595 CA -0.0095 -0.0154 -0.0141 2095 THR 595 C -0.0101 -0.0124 -0.0134 2096 THR 595 O -0.0103 -0.0092 -0.0116 2097 THR 595 CB -0.0077 -0.0192 -0.0122 2098 THR 595 CG2 -0.0062 -0.0186 -0.0081 2099 THR 595 OG1 -0.0079 -0.0213 -0.0141 2100 ARG 596 N -0.0102 -0.0135 -0.0145 2101 ARG 596 CA -0.0103 -0.0114 -0.0133 2102 ARG 596 C -0.0089 -0.0143 -0.0119 2103 ARG 596 O -0.0085 -0.0177 -0.0133 2104 ARG 596 CB -0.0122 -0.0093 -0.0166 2105 ARG 596 CG -0.0134 -0.0059 -0.0174 2106 ARG 596 CD -0.0153 -0.0037 -0.0206 2107 ARG 596 NE -0.0165 -0.0008 -0.0216 2108 ARG 596 CZ -0.0182 0.0007 -0.0248 2109 ARG 596 NH1 -0.0191 0.0001 -0.0276 2110 ARG 596 NH2 -0.0191 0.0029 -0.0254 2111 MET 597 N -0.0152 -0.0192 -0.0102 2112 MET 597 CA -0.0130 -0.0189 -0.0086 2113 MET 597 C -0.0138 -0.0185 -0.0085 2114 MET 597 O -0.0163 -0.0177 -0.0087 2115 MET 597 CB -0.0125 -0.0173 -0.0060 2116 MET 597 CG -0.0113 -0.0177 -0.0059 2117 MET 597 SD -0.0103 -0.0159 -0.0028 2118 MET 597 CE -0.0138 -0.0141 -0.0021 2119 THR 598 N -0.0117 -0.0188 -0.0077 2120 THR 598 CA -0.0122 -0.0184 -0.0074 2121 THR 598 C -0.0139 -0.0164 -0.0054 2122 THR 598 O -0.0148 -0.0159 -0.0053 2123 THR 598 CB -0.0093 -0.0190 -0.0067 2124 THR 598 CG2 -0.0075 -0.0211 -0.0087 2125 THR 598 OG1 -0.0078 -0.0180 -0.0044 2126 SER 599 N -0.0245 -0.0263 -0.0048 2127 SER 599 CA -0.0258 -0.0245 -0.0037 2128 SER 599 C -0.0254 -0.0239 -0.0032 2129 SER 599 O -0.0235 -0.0242 -0.0030 2130 SER 599 CB -0.0252 -0.0229 -0.0025 2131 SER 599 OG -0.0229 -0.0228 -0.0018 2132 GLY 600 N -0.0272 -0.0230 -0.0029 2133 GLY 600 CA -0.0272 -0.0222 -0.0024 2134 GLY 600 C -0.0256 -0.0207 -0.0009 2135 GLY 600 O -0.0257 -0.0193 0.0000 2136 ARG 601 N -0.0156 -0.0150 0.0051 2137 ARG 601 CA -0.0120 -0.0121 0.0057 2138 ARG 601 C -0.0092 -0.0131 0.0050 2139 ARG 601 O -0.0086 -0.0166 0.0038 2140 ARG 601 CB -0.0094 -0.0119 0.0055 2141 ARG 601 CG -0.0074 -0.0159 0.0040 2142 ARG 601 CD -0.0056 -0.0159 0.0037 2143 ARG 601 NE -0.0088 -0.0169 0.0038 2144 ARG 601 CZ -0.0082 -0.0187 0.0031 2145 ARG 601 NH1 -0.0045 -0.0196 0.0024 2146 ARG 601 NH2 -0.0113 -0.0196 0.0031 2147 SER 602 N -0.0071 -0.0101 0.0058 2148 SER 602 CA -0.0039 -0.0105 0.0054 2149 SER 602 C 0.0005 -0.0091 0.0054 2150 SER 602 O 0.0009 -0.0067 0.0061 2151 SER 602 CB -0.0052 -0.0083 0.0062 2152 SER 602 OG -0.0049 -0.0041 0.0076 2153 GLY 603 N 0.0033 -0.0099 0.0064 2154 GLY 603 CA 0.0046 -0.0093 0.0062 2155 GLY 603 C 0.0054 -0.0091 0.0058 2156 GLY 603 O 0.0061 -0.0082 0.0060 2157 VAL 604 N 0.0052 -0.0099 0.0055 2158 VAL 604 CA 0.0059 -0.0099 0.0050 2159 VAL 604 C 0.0071 -0.0102 0.0043 2160 VAL 604 O 0.0071 -0.0109 0.0038 2161 VAL 604 CB 0.0053 -0.0108 0.0048 2162 VAL 604 CG1 0.0041 -0.0106 0.0056 2163 VAL 604 CG2 0.0051 -0.0121 0.0042 2164 GLY 605 N 0.0060 -0.0039 0.0024 2165 GLY 605 CA 0.0052 -0.0030 0.0018 2166 GLY 605 C 0.0059 -0.0016 0.0006 2167 GLY 605 O 0.0074 -0.0015 0.0003 2168 VAL 606 N 0.0049 -0.0006 -0.0002 2169 VAL 606 CA 0.0056 0.0007 -0.0014 2170 VAL 606 C 0.0046 0.0016 -0.0020 2171 VAL 606 O 0.0030 0.0014 -0.0017 2172 VAL 606 CB 0.0056 0.0015 -0.0020 2173 VAL 606 CG1 0.0038 0.0015 -0.0019 2174 VAL 606 CG2 0.0061 0.0029 -0.0033 2175 ALA 607 N 0.0035 0.0036 -0.0049 2176 ALA 607 CA 0.0027 0.0043 -0.0051 2177 ALA 607 C 0.0031 0.0053 -0.0050 2178 ALA 607 O 0.0039 0.0054 -0.0048 2179 ALA 607 CB 0.0019 0.0039 -0.0053 2180 VAL 608 N 0.0025 0.0061 -0.0051 2181 VAL 608 CA 0.0027 0.0071 -0.0050 2182 VAL 608 C 0.0021 0.0076 -0.0051 2183 VAL 608 O 0.0012 0.0076 -0.0053 2184 VAL 608 CB 0.0028 0.0078 -0.0049 2185 VAL 608 CG1 0.0029 0.0089 -0.0049 2186 VAL 608 CG2 0.0036 0.0075 -0.0048 2187 THR 609 N -0.0024 0.0096 -0.0069 2188 THR 609 CA -0.0018 0.0101 -0.0074 2189 THR 609 C -0.0003 0.0108 -0.0082 2190 THR 609 O 0.0005 0.0107 -0.0079 2191 THR 609 CB -0.0016 0.0093 -0.0065 2192 THR 609 CG2 -0.0002 0.0086 -0.0056 2193 THR 609 OG1 -0.0014 0.0098 -0.0071 2194 THR 609 OXT -0.0004 0.0117 -0.0092 2195 LEU 1 N 0.0065 -0.0062 0.0020 2196 LEU 1 CA 0.0037 -0.0059 0.0024 2197 LEU 1 C 0.0022 -0.0056 0.0026 2198 LEU 1 O 0.0018 -0.0075 0.0028 2199 LEU 1 CB 0.0033 -0.0034 0.0022 2200 LEU 1 CG 0.0055 -0.0013 0.0017 2201 LEU 1 CD1 0.0050 0.0004 0.0016 2202 LEU 1 CD2 0.0057 0.0005 0.0015 2203 ALA 2 N 0.0012 -0.0031 0.0025 2204 ALA 2 CA -0.0002 -0.0025 0.0026 2205 ALA 2 C 0.0012 -0.0002 0.0022 2206 ALA 2 O 0.0017 -0.0004 0.0021 2207 ALA 2 CB -0.0031 -0.0017 0.0029 2208 GLU 3 N 0.0021 -0.0023 -0.0020 2209 GLU 3 CA 0.0037 0.0010 -0.0023 2210 GLU 3 C 0.0069 -0.0003 -0.0034 2211 GLU 3 O 0.0067 0.0001 -0.0033 2212 GLU 3 CB 0.0051 0.0043 -0.0026 2213 GLU 3 CG 0.0074 0.0078 -0.0031 2214 GLU 3 CD 0.0117 0.0069 -0.0045 2215 GLU 3 OE1 0.0133 0.0048 -0.0051 2216 GLU 3 OE2 0.0134 0.0081 -0.0049 2217 GLU 4 N 0.0100 -0.0017 -0.0044 2218 GLU 4 CA 0.0133 -0.0031 -0.0056 2219 GLU 4 C 0.0121 -0.0066 -0.0054 2220 GLU 4 O 0.0136 -0.0069 -0.0059 2221 GLU 4 CB 0.0165 -0.0044 -0.0067 2222 GLU 4 CG 0.0184 -0.0008 -0.0070 2223 GLU 4 CD 0.0219 -0.0020 -0.0082 2224 GLU 4 OE1 0.0224 -0.0057 -0.0086 2225 GLU 4 OE2 0.0242 0.0007 -0.0088 2226 TYR 5 N 0.0058 -0.0046 -0.0008 2227 TYR 5 CA 0.0068 -0.0044 -0.0001 2228 TYR 5 C 0.0080 -0.0051 -0.0007 2229 TYR 5 O 0.0088 -0.0052 -0.0006 2230 TYR 5 CB 0.0070 -0.0036 0.0009 2231 TYR 5 CG 0.0065 -0.0031 0.0015 2232 TYR 5 CD1 0.0052 -0.0026 0.0016 2233 TYR 5 CD2 0.0070 -0.0031 0.0016 2234 TYR 5 CE1 0.0046 -0.0022 0.0019 2235 TYR 5 CE2 0.0065 -0.0028 0.0019 2236 TYR 5 CZ 0.0052 -0.0023 0.0020 2237 TYR 5 OH 0.0047 -0.0020 0.0023 2238 GLY 6 N 0.0080 -0.0055 -0.0013 2239 GLY 6 CA 0.0090 -0.0062 -0.0019 2240 GLY 6 C 0.0090 -0.0068 -0.0026 2241 GLY 6 O 0.0099 -0.0070 -0.0026 2242 GLU 7 N 0.0116 -0.0071 -0.0033 2243 GLU 7 CA 0.0107 -0.0081 -0.0040 2244 GLU 7 C 0.0104 -0.0073 -0.0036 2245 GLU 7 O 0.0106 -0.0080 -0.0040 2246 GLU 7 CB 0.0090 -0.0085 -0.0046 2247 GLU 7 CG 0.0090 -0.0102 -0.0054 2248 GLU 7 CD 0.0079 -0.0113 -0.0061 2249 GLU 7 OE1 0.0066 -0.0106 -0.0061 2250 GLU 7 OE2 0.0083 -0.0127 -0.0068 2251 PHE 8 N 0.0099 -0.0057 -0.0029 2252 PHE 8 CA 0.0096 -0.0048 -0.0025 2253 PHE 8 C 0.0113 -0.0048 -0.0022 2254 PHE 8 O 0.0112 -0.0044 -0.0020 2255 PHE 8 CB 0.0091 -0.0030 -0.0018 2256 PHE 8 CG 0.0072 -0.0027 -0.0020 2257 PHE 8 CD1 0.0064 -0.0012 -0.0014 2258 PHE 8 CD2 0.0062 -0.0040 -0.0028 2259 PHE 8 CE1 0.0046 -0.0008 -0.0016 2260 PHE 8 CE2 0.0044 -0.0036 -0.0030 2261 PHE 8 CZ 0.0036 -0.0021 -0.0024 2262 LEU 9 N 0.0100 -0.0102 -0.0026 2263 LEU 9 CA 0.0120 -0.0111 -0.0016 2264 LEU 9 C 0.0132 -0.0126 -0.0032 2265 LEU 9 O 0.0149 -0.0136 -0.0028 2266 LEU 9 CB 0.0122 -0.0106 -0.0001 2267 LEU 9 CG 0.0111 -0.0092 0.0017 2268 LEU 9 CD1 0.0112 -0.0089 0.0028 2269 LEU 9 CD2 0.0119 -0.0091 0.0033 2270 LEU 9 OXT 0.0125 -0.0128 -0.0049