1 GLY 325 N 0.0209 0.0421 -0.0025 2 GLY 325 CA 0.0146 0.0380 -0.0129 3 GLY 325 C 0.0128 0.0319 -0.0096 4 GLY 325 O 0.0174 0.0345 -0.0014 5 ARG 326 N 0.0062 0.0236 -0.0153 6 ARG 326 CA 0.0037 0.0162 -0.0118 7 ARG 326 C 0.0052 0.0095 0.0007 8 ARG 326 O 0.0054 0.0069 0.0043 9 ARG 326 CB -0.0040 0.0083 -0.0207 10 ARG 326 CG -0.0057 0.0148 -0.0334 11 ARG 326 CD -0.0122 0.0083 -0.0411 12 ARG 326 NE -0.0134 0.0151 -0.0528 13 ARG 326 CZ -0.0106 0.0226 -0.0555 14 ARG 326 NH1 -0.0123 0.0278 -0.0664 15 ARG 326 NH2 -0.0060 0.0255 -0.0479 16 LEU 327 N 0.0091 -0.0036 0.0071 17 LEU 327 CA 0.0102 -0.0046 0.0074 18 LEU 327 C 0.0088 -0.0056 0.0083 19 LEU 327 O 0.0073 -0.0062 0.0088 20 LEU 327 CB 0.0120 -0.0058 0.0078 21 LEU 327 CG 0.0135 -0.0049 0.0070 22 LEU 327 CD1 0.0151 -0.0062 0.0075 23 LEU 327 CD2 0.0147 -0.0036 0.0061 24 ILE 328 N 0.0093 -0.0060 0.0084 25 ILE 328 CA 0.0083 -0.0073 0.0092 26 ILE 328 C 0.0094 -0.0091 0.0101 27 ILE 328 O 0.0111 -0.0094 0.0100 28 ILE 328 CB 0.0082 -0.0067 0.0089 29 ILE 328 CG1 0.0069 -0.0049 0.0082 30 ILE 328 CG2 0.0075 -0.0082 0.0099 31 ILE 328 CD1 0.0070 -0.0040 0.0077 32 TYR 329 N 0.0079 -0.0073 0.0119 33 TYR 329 CA 0.0080 -0.0079 0.0118 34 TYR 329 C 0.0079 -0.0073 0.0119 35 TYR 329 O 0.0076 -0.0069 0.0126 36 TYR 329 CB 0.0080 -0.0087 0.0126 37 TYR 329 CG 0.0081 -0.0094 0.0125 38 TYR 329 CD1 0.0080 -0.0091 0.0128 39 TYR 329 CD2 0.0084 -0.0102 0.0121 40 TYR 329 CE1 0.0081 -0.0097 0.0127 41 TYR 329 CE2 0.0085 -0.0108 0.0120 42 TYR 329 CZ 0.0084 -0.0106 0.0123 43 TYR 329 OH 0.0085 -0.0111 0.0121 44 THR 330 N 0.0081 -0.0074 0.0113 45 THR 330 CA 0.0080 -0.0070 0.0114 46 THR 330 C 0.0081 -0.0078 0.0114 47 THR 330 O 0.0084 -0.0085 0.0108 48 THR 330 CB 0.0080 -0.0063 0.0106 49 THR 330 CG2 0.0083 -0.0066 0.0096 50 THR 330 OG1 0.0079 -0.0059 0.0108 51 ALA 331 N 0.0063 -0.0054 0.0077 52 ALA 331 CA 0.0063 -0.0042 0.0077 53 ALA 331 C 0.0060 -0.0016 0.0074 54 ALA 331 O 0.0069 -0.0005 0.0079 55 ALA 331 CB 0.0083 -0.0046 0.0088 56 GLY 332 N 0.0047 -0.0006 0.0067 57 GLY 332 CA 0.0043 0.0018 0.0063 58 GLY 332 C 0.0033 0.0026 0.0058 59 GLY 332 O 0.0018 0.0016 0.0050 60 GLY 333 N 0.0006 0.0063 0.0023 61 GLY 333 CA -0.0006 0.0056 0.0028 62 GLY 333 C -0.0006 0.0055 0.0044 63 GLY 333 O 0.0002 0.0058 0.0053 64 TYR 334 N -0.0017 0.0049 0.0050 65 TYR 334 CA -0.0019 0.0046 0.0065 66 TYR 334 C -0.0023 0.0044 0.0069 67 TYR 334 O -0.0033 0.0039 0.0063 68 TYR 334 CB -0.0030 0.0040 0.0069 69 TYR 334 CG -0.0033 0.0038 0.0086 70 TYR 334 CD1 -0.0042 0.0032 0.0091 71 TYR 334 CD2 -0.0027 0.0040 0.0095 72 TYR 334 CE1 -0.0046 0.0029 0.0106 73 TYR 334 CE2 -0.0031 0.0037 0.0110 74 TYR 334 CZ -0.0040 0.0031 0.0115 75 TYR 334 OH -0.0044 0.0028 0.0129 76 PHE 335 N -0.0029 0.0096 0.0062 77 PHE 335 CA -0.0069 0.0087 0.0094 78 PHE 335 C -0.0048 0.0109 0.0168 79 PHE 335 O 0.0008 0.0131 0.0179 80 PHE 335 CB -0.0063 0.0081 0.0049 81 PHE 335 CG -0.0108 0.0069 0.0075 82 PHE 335 CD1 -0.0177 0.0042 0.0065 83 PHE 335 CD2 -0.0082 0.0085 0.0107 84 PHE 335 CE1 -0.0220 0.0030 0.0085 85 PHE 335 CE2 -0.0124 0.0073 0.0127 86 PHE 335 CZ -0.0193 0.0045 0.0115 87 ARG 336 N -0.0093 0.0102 0.0221 88 ARG 336 CA -0.0082 0.0120 0.0297 89 ARG 336 C -0.0036 0.0141 0.0318 90 ARG 336 O -0.0053 0.0144 0.0367 91 ARG 336 CB -0.0060 0.0134 0.0326 92 ARG 336 CG -0.0097 0.0116 0.0302 93 ARG 336 CD -0.0173 0.0089 0.0308 94 ARG 336 NE -0.0208 0.0073 0.0294 95 ARG 336 CZ -0.0268 0.0047 0.0269 96 ARG 336 NH1 -0.0303 0.0030 0.0248 97 ARG 336 NH2 -0.0295 0.0036 0.0266 98 GLN 337 N -0.0010 0.0089 0.0247 99 GLN 337 CA -0.0007 0.0112 0.0212 100 GLN 337 C -0.0010 0.0131 0.0159 101 GLN 337 O -0.0011 0.0131 0.0153 102 GLN 337 CB 0.0017 0.0154 0.0241 103 GLN 337 CG 0.0038 0.0196 0.0254 104 GLN 337 CD 0.0061 0.0232 0.0290 105 GLN 337 NE2 0.0081 0.0270 0.0305 106 GLN 337 OE1 0.0062 0.0225 0.0309 107 SER 338 N -0.0011 0.0147 0.0119 108 SER 338 CA -0.0008 0.0176 0.0070 109 SER 338 C 0.0016 0.0227 0.0084 110 SER 338 O 0.0034 0.0250 0.0119 111 SER 338 CB -0.0013 0.0185 0.0030 112 SER 338 OG -0.0037 0.0139 0.0014 113 LEU 339 N 0.0046 0.0098 0.0065 114 LEU 339 CA 0.0042 0.0076 0.0054 115 LEU 339 C 0.0057 0.0058 0.0064 116 LEU 339 O 0.0070 0.0059 0.0079 117 LEU 339 CB 0.0033 0.0071 0.0042 118 LEU 339 CG 0.0018 0.0089 0.0032 119 LEU 339 CD1 0.0011 0.0083 0.0022 120 LEU 339 CD2 0.0005 0.0091 0.0018 121 SER 340 N 0.0055 0.0040 0.0056 122 SER 340 CA 0.0067 0.0020 0.0063 123 SER 340 C 0.0067 -0.0000 0.0056 124 SER 340 O 0.0077 -0.0017 0.0062 125 SER 340 CB 0.0066 0.0013 0.0060 126 SER 340 OG 0.0066 0.0031 0.0066 127 TYR 341 N 0.0112 -0.0027 0.0063 128 TYR 341 CA 0.0107 -0.0049 0.0062 129 TYR 341 C 0.0123 -0.0061 0.0083 130 TYR 341 O 0.0136 -0.0048 0.0095 131 TYR 341 CB 0.0098 -0.0040 0.0050 132 TYR 341 CG 0.0082 -0.0026 0.0030 133 TYR 341 CD1 0.0070 -0.0035 0.0017 134 TYR 341 CD2 0.0080 -0.0005 0.0023 135 TYR 341 CE1 0.0055 -0.0023 -0.0003 136 TYR 341 CE2 0.0065 0.0007 0.0003 137 TYR 341 CZ 0.0052 -0.0002 -0.0010 138 TYR 341 OH 0.0037 0.0009 -0.0029 139 LEU 342 N 0.0121 -0.0087 0.0086 140 LEU 342 CA 0.0131 -0.0102 0.0100 141 LEU 342 C 0.0118 -0.0118 0.0089 142 LEU 342 O 0.0105 -0.0133 0.0078 143 LEU 342 CB 0.0141 -0.0119 0.0116 144 LEU 342 CG 0.0152 -0.0137 0.0131 145 LEU 342 CD1 0.0168 -0.0122 0.0146 146 LEU 342 CD2 0.0159 -0.0156 0.0143 147 GLU 343 N 0.0136 -0.0133 0.0110 148 GLU 343 CA 0.0129 -0.0139 0.0082 149 GLU 343 C 0.0133 -0.0138 0.0098 150 GLU 343 O 0.0135 -0.0116 0.0121 151 GLU 343 CB 0.0116 -0.0112 0.0054 152 GLU 343 CG 0.0111 -0.0115 0.0035 153 GLU 343 CD 0.0098 -0.0088 0.0008 154 GLU 343 OE1 0.0094 -0.0056 0.0019 155 GLU 343 OE2 0.0091 -0.0097 -0.0021 156 ALA 344 N 0.0135 -0.0162 0.0085 157 ALA 344 CA 0.0138 -0.0164 0.0095 158 ALA 344 C 0.0128 -0.0156 0.0065 159 ALA 344 O 0.0124 -0.0173 0.0037 160 ALA 344 CB 0.0150 -0.0200 0.0109 161 TYR 345 N 0.0071 -0.0136 0.0023 162 TYR 345 CA 0.0083 -0.0121 0.0030 163 TYR 345 C 0.0074 -0.0118 0.0057 164 TYR 345 O 0.0069 -0.0116 0.0075 165 TYR 345 CB 0.0105 -0.0102 0.0026 166 TYR 345 CG 0.0120 -0.0085 0.0032 167 TYR 345 CD1 0.0125 -0.0086 0.0017 168 TYR 345 CD2 0.0128 -0.0068 0.0053 169 TYR 345 CE1 0.0140 -0.0070 0.0022 170 TYR 345 CE2 0.0143 -0.0052 0.0058 171 TYR 345 CZ 0.0148 -0.0053 0.0043 172 TYR 345 OH 0.0162 -0.0037 0.0048 173 ASN 346 N 0.0074 -0.0116 0.0061 174 ASN 346 CA 0.0070 -0.0110 0.0086 175 ASN 346 C 0.0089 -0.0089 0.0092 176 ASN 346 O 0.0097 -0.0085 0.0083 177 ASN 346 CB 0.0055 -0.0125 0.0086 178 ASN 346 CG 0.0047 -0.0121 0.0112 179 ASN 346 ND2 0.0032 -0.0134 0.0115 180 ASN 346 OD1 0.0053 -0.0107 0.0131 181 PRO 347 N 0.0113 -0.0076 0.0119 182 PRO 347 CA 0.0196 -0.0070 0.0174 183 PRO 347 C 0.0183 -0.0050 0.0271 184 PRO 347 O 0.0250 -0.0045 0.0317 185 PRO 347 CB 0.0237 -0.0073 0.0172 186 PRO 347 CG 0.0199 -0.0088 0.0086 187 PRO 347 CD 0.0103 -0.0083 0.0082 188 SER 348 N 0.0098 -0.0038 0.0305 189 SER 348 CA 0.0079 -0.0018 0.0398 190 SER 348 C 0.0072 -0.0014 0.0416 191 SER 348 O 0.0085 0.0000 0.0492 192 SER 348 CB -0.0006 -0.0006 0.0431 193 SER 348 OG -0.0087 -0.0011 0.0386 194 ASP 349 N 0.0093 -0.0127 0.0280 195 ASP 349 CA 0.0077 -0.0145 0.0208 196 ASP 349 C 0.0123 -0.0115 0.0096 197 ASP 349 O 0.0123 -0.0119 0.0033 198 ASP 349 CB -0.0018 -0.0225 0.0201 199 ASP 349 CG -0.0063 -0.0267 0.0151 200 ASP 349 OD1 -0.0021 -0.0236 0.0095 201 ASP 349 OD2 -0.0138 -0.0328 0.0177 202 GLY 350 N 0.0168 -0.0079 0.0075 203 GLY 350 CA 0.0217 -0.0045 -0.0026 204 GLY 350 C 0.0165 -0.0094 -0.0121 205 GLY 350 O 0.0199 -0.0072 -0.0213 206 THR 351 N 0.0067 -0.0215 -0.0138 207 THR 351 CA 0.0069 -0.0248 -0.0150 208 THR 351 C 0.0073 -0.0237 -0.0110 209 THR 351 O 0.0078 -0.0226 -0.0061 210 THR 351 CB 0.0075 -0.0310 -0.0156 211 THR 351 CG2 0.0070 -0.0321 -0.0203 212 THR 351 OG1 0.0083 -0.0333 -0.0107 213 TRP 352 N 0.0071 -0.0244 -0.0132 214 TRP 352 CA 0.0075 -0.0247 -0.0100 215 TRP 352 C 0.0081 -0.0307 -0.0102 216 TRP 352 O 0.0078 -0.0332 -0.0147 217 TRP 352 CB 0.0068 -0.0206 -0.0122 218 TRP 352 CG 0.0064 -0.0147 -0.0108 219 TRP 352 CD1 0.0056 -0.0110 -0.0139 220 TRP 352 CD2 0.0067 -0.0117 -0.0058 221 TRP 352 CE2 0.0061 -0.0061 -0.0062 222 TRP 352 CE3 0.0074 -0.0131 -0.0009 223 TRP 352 NE1 0.0055 -0.0059 -0.0112 224 TRP 352 CZ2 0.0062 -0.0021 -0.0020 225 TRP 352 CZ3 0.0076 -0.0092 0.0033 226 TRP 352 CH2 0.0069 -0.0037 0.0028 227 LEU 353 N 0.0148 -0.0224 -0.0004 228 LEU 353 CA 0.0157 -0.0233 0.0000 229 LEU 353 C 0.0162 -0.0208 0.0015 230 LEU 353 O 0.0175 -0.0195 0.0031 231 LEU 353 CB 0.0178 -0.0257 0.0010 232 LEU 353 CG 0.0180 -0.0282 0.0002 233 LEU 353 CD1 0.0205 -0.0299 0.0018 234 LEU 353 CD2 0.0173 -0.0274 -0.0001 235 ARG 354 N 0.0155 -0.0201 0.0010 236 ARG 354 CA 0.0163 -0.0182 0.0025 237 ARG 354 C 0.0184 -0.0197 0.0038 238 ARG 354 O 0.0184 -0.0219 0.0030 239 ARG 354 CB 0.0144 -0.0166 0.0015 240 ARG 354 CG 0.0153 -0.0145 0.0030 241 ARG 354 CD 0.0137 -0.0116 0.0027 242 ARG 354 NE 0.0146 -0.0098 0.0041 243 ARG 354 CZ 0.0135 -0.0084 0.0037 244 ARG 354 NH1 0.0114 -0.0084 0.0019 245 ARG 354 NH2 0.0145 -0.0070 0.0051 246 LEU 355 N 0.0176 -0.0135 0.0180 247 LEU 355 CA 0.0162 -0.0127 0.0169 248 LEU 355 C 0.0157 -0.0125 0.0148 249 LEU 355 O 0.0162 -0.0128 0.0143 250 LEU 355 CB 0.0169 -0.0131 0.0168 251 LEU 355 CG 0.0171 -0.0132 0.0190 252 LEU 355 CD1 0.0181 -0.0138 0.0188 253 LEU 355 CD2 0.0153 -0.0121 0.0201 254 ALA 356 N 0.0146 -0.0118 0.0135 255 ALA 356 CA 0.0141 -0.0116 0.0114 256 ALA 356 C 0.0158 -0.0126 0.0100 257 ALA 356 O 0.0168 -0.0132 0.0096 258 ALA 356 CB 0.0127 -0.0108 0.0104 259 ASP 357 N 0.0114 -0.0073 0.0027 260 ASP 357 CA 0.0114 -0.0085 0.0025 261 ASP 357 C 0.0090 -0.0095 0.0031 262 ASP 357 O 0.0077 -0.0104 0.0034 263 ASP 357 CB 0.0131 -0.0104 0.0016 264 ASP 357 CG 0.0156 -0.0094 0.0010 265 ASP 357 OD1 0.0160 -0.0072 0.0012 266 ASP 357 OD2 0.0171 -0.0108 0.0002 267 LEU 358 N 0.0085 -0.0095 0.0033 268 LEU 358 CA 0.0065 -0.0107 0.0037 269 LEU 358 C 0.0066 -0.0134 0.0031 270 LEU 358 O 0.0083 -0.0144 0.0024 271 LEU 358 CB 0.0067 -0.0104 0.0037 272 LEU 358 CG 0.0062 -0.0079 0.0043 273 LEU 358 CD1 0.0073 -0.0076 0.0041 274 LEU 358 CD2 0.0036 -0.0077 0.0052 275 GLN 359 N 0.0007 -0.0155 -0.0032 276 GLN 359 CA 0.0003 -0.0182 -0.0038 277 GLN 359 C 0.0006 -0.0130 -0.0051 278 GLN 359 O -0.0001 -0.0144 -0.0079 279 GLN 359 CB 0.0011 -0.0222 0.0022 280 GLN 359 CG 0.0008 -0.0278 0.0034 281 GLN 359 CD 0.0012 -0.0328 0.0082 282 GLN 359 NE2 0.0005 -0.0389 0.0075 283 GLN 359 OE1 0.0022 -0.0314 0.0126 284 VAL 360 N 0.0014 -0.0070 -0.0034 285 VAL 360 CA 0.0017 -0.0012 -0.0048 286 VAL 360 C 0.0018 0.0042 -0.0070 287 VAL 360 O 0.0024 0.0050 -0.0039 288 VAL 360 CB 0.0030 0.0009 0.0012 289 VAL 360 CG1 0.0032 0.0068 -0.0003 290 VAL 360 CG2 0.0030 -0.0045 0.0040 291 PRO 361 N -0.0058 0.0100 0.0001 292 PRO 361 CA -0.0050 0.0087 0.0010 293 PRO 361 C -0.0041 0.0077 0.0000 294 PRO 361 O -0.0039 0.0077 -0.0014 295 PRO 361 CB -0.0047 0.0084 0.0015 296 PRO 361 CG -0.0056 0.0096 0.0013 297 PRO 361 CD -0.0061 0.0104 0.0000 298 ARG 362 N -0.0035 0.0069 0.0008 299 ARG 362 CA -0.0027 0.0059 -0.0000 300 ARG 362 C -0.0019 0.0046 0.0009 301 ARG 362 O -0.0019 0.0045 0.0023 302 ARG 362 CB -0.0029 0.0062 -0.0003 303 ARG 362 CG -0.0039 0.0076 -0.0009 304 ARG 362 CD -0.0040 0.0079 -0.0026 305 ARG 362 NE -0.0036 0.0075 -0.0035 306 ARG 362 CZ -0.0040 0.0081 -0.0037 307 ARG 362 NH1 -0.0049 0.0091 -0.0030 308 ARG 362 NH2 -0.0036 0.0076 -0.0045 309 SER 363 N -0.0048 0.0063 0.0025 310 SER 363 CA -0.0038 0.0053 0.0032 311 SER 363 C -0.0028 0.0048 0.0023 312 SER 363 O -0.0027 0.0052 0.0010 313 SER 363 CB -0.0035 0.0050 0.0035 314 SER 363 OG -0.0031 0.0051 0.0023 315 GLY 364 N -0.0020 0.0040 0.0029 316 GLY 364 CA -0.0011 0.0035 0.0021 317 GLY 364 C -0.0014 0.0039 0.0017 318 GLY 364 O -0.0008 0.0037 0.0008 319 LEU 365 N -0.0004 0.0029 0.0030 320 LEU 365 CA 0.0002 0.0026 0.0029 321 LEU 365 C 0.0005 0.0016 0.0030 322 LEU 365 O 0.0000 0.0012 0.0031 323 LEU 365 CB -0.0003 0.0026 0.0030 324 LEU 365 CG -0.0010 0.0019 0.0032 325 LEU 365 CD1 -0.0011 0.0019 0.0032 326 LEU 365 CD2 -0.0018 0.0022 0.0032 327 ALA 366 N 0.0011 0.0013 0.0030 328 ALA 366 CA 0.0013 0.0003 0.0031 329 ALA 366 C 0.0011 -0.0000 0.0032 330 ALA 366 O 0.0011 0.0005 0.0031 331 ALA 366 CB 0.0022 0.0001 0.0031 332 GLY 367 N 0.0051 0.0024 0.0071 333 GLY 367 CA 0.0040 0.0032 0.0079 334 GLY 367 C 0.0043 0.0029 0.0079 335 GLY 367 O 0.0056 0.0019 0.0081 336 CYS 368 N 0.0033 0.0037 0.0078 337 CYS 368 CA 0.0035 0.0035 0.0082 338 CYS 368 C 0.0020 0.0045 0.0089 339 CYS 368 O 0.0010 0.0053 0.0089 340 CYS 368 CB 0.0042 0.0031 0.0067 341 CYS 368 SG 0.0032 0.0042 0.0048 342 VAL 369 N 0.0039 0.0084 0.0130 343 VAL 369 CA -0.0011 0.0087 0.0157 344 VAL 369 C -0.0002 0.0086 0.0152 345 VAL 369 O 0.0042 0.0070 0.0168 346 VAL 369 CB -0.0026 0.0070 0.0218 347 VAL 369 CG1 -0.0071 0.0070 0.0251 348 VAL 369 CG2 -0.0051 0.0075 0.0219 349 VAL 370 N -0.0047 0.0102 0.0137 350 VAL 370 CA -0.0051 0.0102 0.0141 351 VAL 370 C -0.0110 0.0107 0.0168 352 VAL 370 O -0.0153 0.0123 0.0154 353 VAL 370 CB -0.0039 0.0118 0.0084 354 VAL 370 CG1 -0.0038 0.0115 0.0092 355 VAL 370 CG2 0.0018 0.0115 0.0053 356 GLY 371 N -0.0283 0.0157 0.0487 357 GLY 371 CA -0.0331 0.0087 0.0509 358 GLY 371 C -0.0285 0.0058 0.0416 359 GLY 371 O -0.0322 -0.0028 0.0410 360 GLY 372 N -0.0204 0.0127 0.0343 361 GLY 372 CA -0.0151 0.0104 0.0244 362 GLY 372 C -0.0117 0.0029 0.0137 363 GLY 372 O -0.0059 0.0030 0.0047 364 LEU 373 N -0.0174 0.0070 0.0177 365 LEU 373 CA -0.0164 0.0045 0.0140 366 LEU 373 C -0.0117 0.0029 0.0126 367 LEU 373 O -0.0105 0.0028 0.0126 368 LEU 373 CB -0.0204 0.0029 0.0109 369 LEU 373 CG -0.0253 0.0043 0.0121 370 LEU 373 CD1 -0.0290 0.0027 0.0089 371 LEU 373 CD2 -0.0258 0.0049 0.0128 372 LEU 374 N -0.0090 0.0018 0.0114 373 LEU 374 CA -0.0047 -0.0000 0.0095 374 LEU 374 C -0.0057 -0.0028 0.0051 375 LEU 374 O -0.0081 -0.0037 0.0032 376 LEU 374 CB -0.0017 0.0001 0.0103 377 LEU 374 CG 0.0027 -0.0020 0.0080 378 LEU 374 CD1 0.0064 -0.0016 0.0094 379 LEU 374 CD2 0.0048 -0.0018 0.0086 380 TYR 375 N -0.0017 0.0040 0.0068 381 TYR 375 CA -0.0016 0.0032 0.0039 382 TYR 375 C 0.0008 0.0020 0.0032 383 TYR 375 O 0.0030 0.0015 0.0042 384 TYR 375 CB -0.0018 0.0029 0.0026 385 TYR 375 CG -0.0044 0.0039 0.0027 386 TYR 375 CD1 -0.0048 0.0047 0.0050 387 TYR 375 CD2 -0.0063 0.0040 0.0006 388 TYR 375 CE1 -0.0072 0.0056 0.0051 389 TYR 375 CE2 -0.0086 0.0049 0.0007 390 TYR 375 CZ -0.0091 0.0057 0.0029 391 TYR 375 OH -0.0114 0.0066 0.0029 392 ALA 376 N 0.0005 0.0016 0.0014 393 ALA 376 CA 0.0026 0.0005 0.0001 394 ALA 376 C 0.0027 -0.0003 -0.0027 395 ALA 376 O 0.0010 -0.0002 -0.0045 396 ALA 376 CB 0.0021 0.0007 0.0001 397 VAL 377 N -0.0036 0.0027 -0.0042 398 VAL 377 CA -0.0024 0.0036 -0.0044 399 VAL 377 C -0.0027 0.0047 -0.0046 400 VAL 377 O -0.0032 0.0044 -0.0045 401 VAL 377 CB -0.0011 0.0028 -0.0043 402 VAL 377 CG1 0.0003 0.0036 -0.0045 403 VAL 377 CG2 -0.0009 0.0014 -0.0040 404 GLY 378 N -0.0024 0.0060 -0.0049 405 GLY 378 CA -0.0025 0.0072 -0.0051 406 GLY 378 C -0.0040 0.0074 -0.0051 407 GLY 378 O -0.0051 0.0074 -0.0051 408 GLY 379 N -0.0088 0.0067 -0.0030 409 GLY 379 CA -0.0083 0.0062 -0.0017 410 GLY 379 C -0.0089 0.0073 -0.0055 411 GLY 379 O -0.0084 0.0078 -0.0095 412 ARG 380 N -0.0100 0.0077 -0.0042 413 ARG 380 CA -0.0112 0.0091 -0.0072 414 ARG 380 C -0.0140 0.0103 -0.0046 415 ARG 380 O -0.0138 0.0094 -0.0006 416 ARG 380 CB -0.0076 0.0073 -0.0095 417 ARG 380 CG -0.0053 0.0053 -0.0065 418 ARG 380 CD -0.0016 0.0036 -0.0093 419 ARG 380 NE 0.0006 0.0017 -0.0071 420 ARG 380 CZ 0.0038 0.0001 -0.0090 421 ARG 380 NH1 0.0056 -0.0014 -0.0068 422 ARG 380 NH2 0.0053 -0.0000 -0.0130 423 ASN 381 N -0.0141 0.0214 -0.0104 424 ASN 381 CA -0.0131 0.0225 -0.0064 425 ASN 381 C -0.0106 0.0180 -0.0062 426 ASN 381 O -0.0112 0.0166 -0.0095 427 ASN 381 CB -0.0159 0.0268 -0.0075 428 ASN 381 CG -0.0151 0.0286 -0.0032 429 ASN 381 ND2 -0.0171 0.0317 -0.0040 430 ASN 381 OD1 -0.0126 0.0271 0.0008 431 ASN 382 N -0.0078 0.0153 -0.0026 432 ASN 382 CA -0.0051 0.0110 -0.0016 433 ASN 382 C -0.0039 0.0124 0.0032 434 ASN 382 O -0.0026 0.0131 0.0075 435 ASN 382 CB -0.0027 0.0070 -0.0011 436 ASN 382 CG 0.0001 0.0021 -0.0006 437 ASN 382 ND2 0.0026 -0.0008 0.0017 438 ASN 382 OD1 0.0000 0.0006 -0.0027 439 SER 383 N -0.0029 0.0161 0.0009 440 SER 383 CA 0.0013 0.0159 0.0020 441 SER 383 C 0.0064 0.0081 -0.0023 442 SER 383 O 0.0054 0.0031 -0.0065 443 SER 383 CB -0.0059 0.0183 0.0017 444 SER 383 OG -0.0106 0.0126 -0.0040 445 PRO 384 N 0.0122 0.0070 -0.0015 446 PRO 384 CA 0.0166 -0.0004 -0.0058 447 PRO 384 C 0.0104 -0.0056 -0.0116 448 PRO 384 O 0.0124 -0.0121 -0.0159 449 PRO 384 CB 0.0230 0.0007 -0.0031 450 PRO 384 CG 0.0190 0.0081 0.0013 451 PRO 384 CD 0.0153 0.0124 0.0035 452 ASP 385 N 0.0126 -0.0121 -0.0141 453 ASP 385 CA 0.0147 -0.0193 -0.0029 454 ASP 385 C 0.0069 -0.0162 0.0070 455 ASP 385 O 0.0074 -0.0213 0.0171 456 ASP 385 CB 0.0237 -0.0270 -0.0048 457 ASP 385 CG 0.0318 -0.0310 -0.0134 458 ASP 385 OD1 0.0335 -0.0337 -0.0111 459 ASP 385 OD2 0.0353 -0.0301 -0.0229 460 GLY 386 N -0.0006 -0.0078 0.0044 461 GLY 386 CA -0.0087 -0.0037 0.0126 462 GLY 386 C -0.0118 0.0012 0.0086 463 GLY 386 O -0.0075 0.0012 -0.0006 464 ASN 387 N -0.0122 -0.0004 -0.0398 465 ASN 387 CA -0.0131 0.0011 -0.0365 466 ASN 387 C -0.0209 0.0045 -0.0447 467 ASN 387 O -0.0202 0.0011 -0.0551 468 ASN 387 CB -0.0032 -0.0059 -0.0357 469 ASN 387 CG -0.0039 -0.0043 -0.0319 470 ASN 387 ND2 -0.0033 -0.0068 -0.0395 471 ASN 387 OD1 -0.0048 -0.0010 -0.0220 472 THR 388 N -0.0265 0.0099 -0.0398 473 THR 388 CA -0.0330 0.0128 -0.0462 474 THR 388 C -0.0315 0.0135 -0.0400 475 THR 388 O -0.0334 0.0175 -0.0301 476 THR 388 CB -0.0436 0.0201 -0.0476 477 THR 388 CG2 -0.0504 0.0228 -0.0559 478 THR 388 OG1 -0.0445 0.0196 -0.0521 479 ASP 389 N -0.0158 0.0127 -0.0208 480 ASP 389 CA -0.0141 0.0111 -0.0184 481 ASP 389 C -0.0158 0.0108 -0.0176 482 ASP 389 O -0.0168 0.0120 -0.0195 483 ASP 389 CB -0.0104 0.0111 -0.0191 484 ASP 389 CG -0.0086 0.0114 -0.0199 485 ASP 389 OD1 -0.0097 0.0108 -0.0187 486 ASP 389 OD2 -0.0060 0.0120 -0.0214 487 SER 390 N -0.0162 0.0093 -0.0148 488 SER 390 CA -0.0181 0.0088 -0.0136 489 SER 390 C -0.0158 0.0082 -0.0130 490 SER 390 O -0.0134 0.0071 -0.0114 491 SER 390 CB -0.0201 0.0075 -0.0109 492 SER 390 OG -0.0218 0.0070 -0.0097 493 SER 391 N -0.0072 0.0110 -0.0133 494 SER 391 CA -0.0057 0.0099 -0.0116 495 SER 391 C -0.0053 0.0071 -0.0121 496 SER 391 O -0.0041 0.0059 -0.0108 497 SER 391 CB -0.0044 0.0105 -0.0095 498 SER 391 OG -0.0044 0.0097 -0.0098 499 ALA 392 N -0.0063 0.0059 -0.0140 500 ALA 392 CA -0.0060 0.0032 -0.0145 501 ALA 392 C -0.0058 0.0021 -0.0146 502 ALA 392 O -0.0067 0.0030 -0.0155 503 ALA 392 CB -0.0074 0.0025 -0.0167 504 LEU 393 N 0.0029 -0.0024 -0.0156 505 LEU 393 CA 0.0025 -0.0030 -0.0123 506 LEU 393 C -0.0007 -0.0048 -0.0126 507 LEU 393 O -0.0030 -0.0061 -0.0135 508 LEU 393 CB 0.0027 -0.0032 -0.0093 509 LEU 393 CG 0.0023 -0.0039 -0.0056 510 LEU 393 CD1 0.0049 -0.0025 -0.0044 511 LEU 393 CD2 0.0021 -0.0044 -0.0028 512 ASP 394 N -0.0008 -0.0050 -0.0117 513 ASP 394 CA -0.0036 -0.0067 -0.0118 514 ASP 394 C -0.0037 -0.0072 -0.0085 515 ASP 394 O -0.0015 -0.0060 -0.0073 516 ASP 394 CB -0.0041 -0.0066 -0.0151 517 ASP 394 CG -0.0037 -0.0059 -0.0185 518 ASP 394 OD1 -0.0059 -0.0070 -0.0207 519 ASP 394 OD2 -0.0010 -0.0042 -0.0195 520 CYS 395 N -0.0118 -0.0139 -0.0024 521 CYS 395 CA -0.0122 -0.0112 -0.0005 522 CYS 395 C -0.0111 -0.0098 0.0012 523 CYS 395 O -0.0121 -0.0095 0.0009 524 CYS 395 CB -0.0155 -0.0101 -0.0012 525 CYS 395 SG -0.0162 -0.0067 0.0011 526 TYR 396 N -0.0091 -0.0085 0.0031 527 TYR 396 CA -0.0082 -0.0066 0.0050 528 TYR 396 C -0.0098 -0.0039 0.0064 529 TYR 396 O -0.0094 -0.0031 0.0072 530 TYR 396 CB -0.0049 -0.0072 0.0062 531 TYR 396 CG -0.0037 -0.0054 0.0082 532 TYR 396 CD1 -0.0032 -0.0057 0.0082 533 TYR 396 CD2 -0.0029 -0.0033 0.0102 534 TYR 396 CE1 -0.0020 -0.0041 0.0101 535 TYR 396 CE2 -0.0017 -0.0017 0.0121 536 TYR 396 CZ -0.0013 -0.0020 0.0120 537 TYR 396 OH -0.0001 -0.0004 0.0139 538 ASN 397 N -0.0078 0.0029 0.0069 539 ASN 397 CA -0.0069 0.0029 0.0047 540 ASN 397 C -0.0072 0.0028 0.0049 541 ASN 397 O -0.0060 0.0039 0.0060 542 ASN 397 CB -0.0047 0.0043 0.0042 543 ASN 397 CG -0.0037 0.0044 0.0018 544 ASN 397 ND2 -0.0020 0.0053 0.0010 545 ASN 397 OD1 -0.0045 0.0036 0.0007 546 PRO 398 N -0.0084 0.0017 0.0035 547 PRO 398 CA -0.0086 0.0016 0.0035 548 PRO 398 C -0.0066 0.0027 0.0029 549 PRO 398 O -0.0064 0.0031 0.0039 550 PRO 398 CB -0.0101 0.0002 0.0017 551 PRO 398 CG -0.0113 -0.0006 0.0016 552 PRO 398 CD -0.0097 0.0005 0.0020 553 MET 399 N -0.0014 -0.0110 -0.0127 554 MET 399 CA 0.0050 -0.0072 -0.0149 555 MET 399 C 0.0071 0.0045 -0.0069 556 MET 399 O 0.0106 0.0078 -0.0071 557 MET 399 CB 0.0160 -0.0081 -0.0247 558 MET 399 CG 0.0149 -0.0198 -0.0334 559 MET 399 SD 0.0105 -0.0281 -0.0366 560 MET 399 CE 0.0224 -0.0217 -0.0412 561 THR 400 N 0.0056 0.0110 -0.0003 562 THR 400 CA 0.0072 0.0223 0.0077 563 THR 400 C -0.0032 0.0242 0.0179 564 THR 400 O -0.0034 0.0325 0.0249 565 THR 400 CB 0.0156 0.0302 0.0073 566 THR 400 CG2 0.0266 0.0293 -0.0025 567 THR 400 OG1 0.0115 0.0284 0.0092 568 ASN 401 N -0.0011 0.0130 0.0069 569 ASN 401 CA -0.0030 0.0087 0.0147 570 ASN 401 C -0.0024 0.0099 0.0171 571 ASN 401 O -0.0019 0.0108 0.0246 572 ASN 401 CB -0.0022 0.0102 0.0220 573 ASN 401 CG -0.0044 0.0051 0.0300 574 ASN 401 ND2 -0.0029 0.0084 0.0376 575 ASN 401 OD1 -0.0076 -0.0021 0.0295 576 GLN 402 N -0.0025 0.0099 0.0105 577 GLN 402 CA -0.0023 0.0103 0.0116 578 GLN 402 C -0.0055 0.0031 0.0076 579 GLN 402 O -0.0068 0.0003 0.0007 580 GLN 402 CB 0.0011 0.0180 0.0076 581 GLN 402 CG 0.0044 0.0255 0.0116 582 GLN 402 CD 0.0078 0.0332 0.0080 583 GLN 402 NE2 0.0106 0.0394 0.0079 584 GLN 402 OE1 0.0081 0.0340 0.0060 585 TRP 403 N -0.0073 -0.0054 0.0013 586 TRP 403 CA -0.0104 -0.0097 -0.0010 587 TRP 403 C -0.0167 -0.0123 -0.0034 588 TRP 403 O -0.0163 -0.0147 -0.0042 589 TRP 403 CB -0.0053 -0.0153 -0.0022 590 TRP 403 CG 0.0005 -0.0136 -0.0002 591 TRP 403 CD1 0.0067 -0.0125 0.0015 592 TRP 403 CD2 0.0006 -0.0127 0.0001 593 TRP 403 CE2 0.0072 -0.0109 0.0022 594 TRP 403 CE3 -0.0042 -0.0131 -0.0010 595 TRP 403 NE1 0.0107 -0.0109 0.0030 596 TRP 403 CZ2 0.0089 -0.0097 0.0031 597 TRP 403 CZ3 -0.0026 -0.0117 -0.0001 598 TRP 403 CH2 0.0040 -0.0100 0.0019 599 SER 404 N -0.0220 -0.0127 -0.0046 600 SER 404 CA -0.0281 -0.0159 -0.0072 601 SER 404 C -0.0293 -0.0208 -0.0094 602 SER 404 O -0.0291 -0.0190 -0.0086 603 SER 404 CB -0.0342 -0.0109 -0.0065 604 SER 404 OG -0.0336 -0.0064 -0.0047 605 PRO 405 N -0.0387 -0.0337 -0.0379 606 PRO 405 CA -0.0295 -0.0252 -0.0378 607 PRO 405 C -0.0261 -0.0267 -0.0236 608 PRO 405 O -0.0331 -0.0351 -0.0179 609 PRO 405 CB -0.0333 -0.0247 -0.0497 610 PRO 405 CG -0.0433 -0.0310 -0.0589 611 PRO 405 CD -0.0480 -0.0388 -0.0485 612 CYS 406 N -0.0156 -0.0185 -0.0189 613 CYS 406 CA -0.0107 -0.0179 -0.0072 614 CYS 406 C -0.0054 -0.0111 -0.0126 615 CYS 406 O -0.0046 -0.0062 -0.0249 616 CYS 406 CB -0.0023 -0.0134 0.0031 617 CYS 406 SG -0.0078 -0.0208 0.0100 618 ALA 407 N 0.0096 -0.0142 -0.0101 619 ALA 407 CA 0.0107 -0.0101 -0.0078 620 ALA 407 C 0.0085 -0.0062 -0.0089 621 ALA 407 O 0.0076 -0.0065 -0.0100 622 ALA 407 CB 0.0142 -0.0107 -0.0045 623 PRO 408 N 0.0077 -0.0023 -0.0087 624 PRO 408 CA 0.0058 0.0017 -0.0094 625 PRO 408 C 0.0078 0.0038 -0.0069 626 PRO 408 O 0.0107 0.0038 -0.0040 627 PRO 408 CB 0.0047 0.0047 -0.0097 628 PRO 408 CG 0.0075 0.0035 -0.0072 629 PRO 408 CD 0.0086 -0.0015 -0.0075 630 MET 409 N 0.0019 0.0047 -0.0054 631 MET 409 CA 0.0022 0.0057 -0.0048 632 MET 409 C 0.0026 0.0069 -0.0040 633 MET 409 O 0.0021 0.0074 -0.0043 634 MET 409 CB 0.0013 0.0063 -0.0054 635 MET 409 CG 0.0010 0.0051 -0.0061 636 MET 409 SD -0.0000 0.0057 -0.0070 637 MET 409 CE -0.0011 0.0064 -0.0078 638 SER 410 N 0.0032 0.0075 -0.0031 639 SER 410 CA 0.0035 0.0087 -0.0024 640 SER 410 C 0.0026 0.0100 -0.0028 641 SER 410 O 0.0028 0.0108 -0.0023 642 SER 410 CB 0.0042 0.0091 -0.0015 643 SER 410 OG 0.0036 0.0096 -0.0019 644 VAL 411 N -0.0040 0.0107 -0.0063 645 VAL 411 CA -0.0046 0.0125 -0.0079 646 VAL 411 C -0.0074 0.0112 -0.0076 647 VAL 411 O -0.0078 0.0088 -0.0057 648 VAL 411 CB -0.0014 0.0135 -0.0078 649 VAL 411 CG1 0.0012 0.0154 -0.0086 650 VAL 411 CG2 0.0002 0.0111 -0.0055 651 PRO 412 N -0.0091 0.0128 -0.0093 652 PRO 412 CA -0.0113 0.0118 -0.0090 653 PRO 412 C -0.0093 0.0108 -0.0077 654 PRO 412 O -0.0065 0.0120 -0.0080 655 PRO 412 CB -0.0131 0.0141 -0.0113 656 PRO 412 CG -0.0130 0.0159 -0.0126 657 PRO 412 CD -0.0095 0.0156 -0.0116 658 ARG 413 N -0.0064 0.0060 -0.0052 659 ARG 413 CA -0.0044 0.0049 -0.0035 660 ARG 413 C -0.0054 0.0045 -0.0024 661 ARG 413 O -0.0064 0.0035 -0.0004 662 ARG 413 CB -0.0038 0.0039 -0.0015 663 ARG 413 CG -0.0026 0.0043 -0.0025 664 ARG 413 CD -0.0020 0.0032 -0.0004 665 ARG 413 NE -0.0009 0.0036 -0.0013 666 ARG 413 CZ 0.0016 0.0036 -0.0017 667 ARG 413 NH1 0.0036 0.0034 -0.0015 668 ARG 413 NH2 0.0023 0.0040 -0.0024 669 ASN 414 N -0.0050 0.0051 -0.0038 670 ASN 414 CA -0.0052 0.0046 -0.0028 671 ASN 414 C -0.0029 0.0036 -0.0011 672 ASN 414 O -0.0005 0.0038 -0.0018 673 ASN 414 CB -0.0052 0.0058 -0.0050 674 ASN 414 CG -0.0051 0.0053 -0.0042 675 ASN 414 ND2 -0.0033 0.0058 -0.0052 676 ASN 414 OD1 -0.0065 0.0046 -0.0025 677 ARG 415 N -0.0022 -0.0011 0.0043 678 ARG 415 CA -0.0014 -0.0036 0.0048 679 ARG 415 C -0.0004 -0.0042 0.0027 680 ARG 415 O 0.0008 -0.0062 0.0019 681 ARG 415 CB -0.0008 -0.0057 0.0053 682 ARG 415 CG -0.0018 -0.0053 0.0075 683 ARG 415 CD -0.0012 -0.0075 0.0081 684 ARG 415 NE -0.0007 -0.0099 0.0092 685 ARG 415 CZ 0.0003 -0.0122 0.0091 686 ARG 415 NH1 0.0010 -0.0128 0.0080 687 ARG 415 NH2 0.0007 -0.0141 0.0100 688 ILE 416 N -0.0008 -0.0022 0.0019 689 ILE 416 CA -0.0002 -0.0022 0.0003 690 ILE 416 C 0.0001 -0.0041 0.0015 691 ILE 416 O -0.0006 -0.0047 0.0038 692 ILE 416 CB -0.0011 0.0005 -0.0001 693 ILE 416 CG1 -0.0004 0.0010 -0.0022 694 ILE 416 CG2 -0.0024 0.0014 0.0023 695 ILE 416 CD1 -0.0013 0.0037 -0.0028 696 GLY 417 N 0.0014 0.0018 0.0070 697 GLY 417 CA 0.0014 0.0018 0.0063 698 GLY 417 C 0.0018 0.0028 0.0053 699 GLY 417 O 0.0019 0.0031 0.0047 700 VAL 418 N 0.0020 0.0034 0.0049 701 VAL 418 CA 0.0024 0.0043 0.0039 702 VAL 418 C 0.0023 0.0041 0.0030 703 VAL 418 O 0.0021 0.0036 0.0034 704 VAL 418 CB 0.0029 0.0056 0.0044 705 VAL 418 CG1 0.0030 0.0059 0.0053 706 VAL 418 CG2 0.0031 0.0060 0.0052 707 GLY 419 N -0.0011 0.0056 -0.0005 708 GLY 419 CA -0.0001 0.0028 -0.0028 709 GLY 419 C 0.0030 0.0042 -0.0045 710 GLY 419 O 0.0047 0.0071 -0.0043 711 VAL 420 N 0.0037 0.0024 -0.0060 712 VAL 420 CA 0.0065 0.0035 -0.0077 713 VAL 420 C 0.0085 0.0011 -0.0106 714 VAL 420 O 0.0074 -0.0021 -0.0114 715 VAL 420 CB 0.0058 0.0038 -0.0070 716 VAL 420 CG1 0.0088 0.0049 -0.0087 717 VAL 420 CG2 0.0041 0.0065 -0.0041 718 ILE 421 N -0.0054 0.0021 -0.0170 719 ILE 421 CA 0.0065 -0.0063 -0.0205 720 ILE 421 C 0.0179 -0.0057 -0.0212 721 ILE 421 O 0.0216 0.0052 -0.0180 722 ILE 421 CB 0.0125 -0.0017 -0.0195 723 ILE 421 CG1 0.0008 -0.0003 -0.0182 724 ILE 421 CG2 0.0235 -0.0119 -0.0236 725 ILE 421 CD1 0.0056 0.0053 -0.0168 726 ASP 422 N 0.0232 -0.0174 -0.0253 727 ASP 422 CA 0.0351 -0.0186 -0.0266 728 ASP 422 C 0.0331 -0.0116 -0.0242 729 ASP 422 O 0.0432 -0.0091 -0.0242 730 ASP 422 CB 0.0491 -0.0152 -0.0266 731 ASP 422 CG 0.0515 -0.0239 -0.0295 732 ASP 422 OD1 0.0434 -0.0338 -0.0320 733 ASP 422 OD2 0.0612 -0.0206 -0.0292 734 GLY 423 N 0.0096 0.0135 -0.0142 735 GLY 423 CA 0.0083 0.0189 -0.0111 736 GLY 423 C 0.0079 0.0210 -0.0102 737 GLY 423 O 0.0062 0.0240 -0.0064 738 HIS 424 N 0.0090 0.0183 -0.0127 739 HIS 424 CA 0.0089 0.0201 -0.0123 740 HIS 424 C 0.0068 0.0169 -0.0082 741 HIS 424 O 0.0065 0.0116 -0.0080 742 HIS 424 CB 0.0115 0.0196 -0.0176 743 HIS 424 CG 0.0136 0.0227 -0.0217 744 HIS 424 CD2 0.0161 0.0218 -0.0269 745 HIS 424 ND1 0.0133 0.0273 -0.0209 746 HIS 424 CE1 0.0157 0.0290 -0.0255 747 HIS 424 NE2 0.0174 0.0259 -0.0292 748 ILE 425 N 0.0079 0.0116 -0.0014 749 ILE 425 CA 0.0070 0.0112 -0.0004 750 ILE 425 C 0.0059 0.0108 0.0005 751 ILE 425 O 0.0063 0.0109 0.0016 752 ILE 425 CB 0.0079 0.0115 0.0008 753 ILE 425 CG1 0.0091 0.0120 -0.0001 754 ILE 425 CG2 0.0068 0.0111 0.0017 755 ILE 425 CD1 0.0102 0.0123 0.0011 756 TYR 426 N 0.0044 0.0103 0.0001 757 TYR 426 CA 0.0032 0.0099 0.0011 758 TYR 426 C 0.0029 0.0097 0.0025 759 TYR 426 O 0.0023 0.0095 0.0022 760 TYR 426 CB 0.0018 0.0094 0.0001 761 TYR 426 CG 0.0020 0.0095 -0.0010 762 TYR 426 CD1 0.0029 0.0099 -0.0024 763 TYR 426 CD2 0.0015 0.0093 -0.0006 764 TYR 426 CE1 0.0032 0.0101 -0.0033 765 TYR 426 CE2 0.0018 0.0095 -0.0015 766 TYR 426 CZ 0.0026 0.0098 -0.0029 767 TYR 426 OH 0.0029 0.0100 -0.0039 768 ALA 427 N 0.0030 0.0089 0.0019 769 ALA 427 CA 0.0032 0.0079 0.0034 770 ALA 427 C 0.0025 0.0061 0.0030 771 ALA 427 O 0.0021 0.0058 0.0021 772 ALA 427 CB 0.0036 0.0087 0.0040 773 VAL 428 N 0.0024 0.0049 0.0039 774 VAL 428 CA 0.0018 0.0032 0.0036 775 VAL 428 C 0.0019 0.0021 0.0051 776 VAL 428 O 0.0023 0.0021 0.0064 777 VAL 428 CB 0.0015 0.0026 0.0032 778 VAL 428 CG1 0.0008 0.0008 0.0028 779 VAL 428 CG2 0.0013 0.0037 0.0017 780 GLY 429 N 0.0020 0.0006 0.0055 781 GLY 429 CA 0.0028 0.0003 0.0049 782 GLY 429 C 0.0017 0.0009 0.0049 783 GLY 429 O 0.0005 0.0017 0.0042 784 GLY 430 N 0.0021 0.0005 0.0055 785 GLY 430 CA 0.0014 0.0010 0.0053 786 GLY 430 C 0.0016 0.0012 0.0036 787 GLY 430 O 0.0025 0.0009 0.0025 788 SER 431 N -0.0024 -0.0007 -0.0007 789 SER 431 CA -0.0020 0.0011 -0.0046 790 SER 431 C -0.0056 0.0056 -0.0065 791 SER 431 O -0.0091 0.0074 -0.0037 792 SER 431 CB -0.0009 -0.0006 -0.0033 793 SER 431 OG -0.0036 -0.0006 0.0012 794 HIS 432 N -0.0047 0.0073 -0.0110 795 HIS 432 CA -0.0076 0.0113 -0.0131 796 HIS 432 C -0.0062 0.0112 -0.0153 797 HIS 432 O -0.0029 0.0100 -0.0188 798 HIS 432 CB -0.0080 0.0139 -0.0170 799 HIS 432 CG -0.0107 0.0181 -0.0199 800 HIS 432 CD2 -0.0140 0.0203 -0.0181 801 HIS 432 ND1 -0.0103 0.0204 -0.0246 802 HIS 432 CE1 -0.0134 0.0239 -0.0257 803 HIS 432 NE2 -0.0156 0.0239 -0.0219 804 GLY 433 N -0.0184 0.0099 -0.0158 805 GLY 433 CA -0.0115 0.0053 -0.0201 806 GLY 433 C -0.0035 0.0030 -0.0183 807 GLY 433 O 0.0004 0.0048 -0.0112 808 CYS 434 N -0.0009 -0.0010 -0.0249 809 CYS 434 CA 0.0062 -0.0035 -0.0244 810 CYS 434 C 0.0037 -0.0020 -0.0233 811 CYS 434 O 0.0093 -0.0033 -0.0215 812 CYS 434 CB 0.0105 -0.0087 -0.0322 813 CYS 434 SG 0.0032 -0.0101 -0.0414 814 ILE 435 N -0.0026 0.0007 -0.0148 815 ILE 435 CA -0.0012 -0.0001 -0.0148 816 ILE 435 C -0.0009 -0.0016 -0.0067 817 ILE 435 O -0.0056 0.0003 -0.0020 818 ILE 435 CB -0.0064 0.0035 -0.0190 819 ILE 435 CG1 -0.0069 0.0052 -0.0272 820 ILE 435 CG2 -0.0050 0.0027 -0.0188 821 ILE 435 CD1 -0.0005 0.0024 -0.0325 822 HIS 436 N 0.0048 -0.0052 -0.0051 823 HIS 436 CA 0.0058 -0.0069 0.0020 824 HIS 436 C 0.0053 -0.0065 0.0008 825 HIS 436 O 0.0091 -0.0078 -0.0041 826 HIS 436 CB 0.0126 -0.0113 0.0045 827 HIS 436 CG 0.0132 -0.0119 0.0064 828 HIS 436 CD2 0.0142 -0.0136 0.0133 829 HIS 436 ND1 0.0123 -0.0106 0.0018 830 HIS 436 CE1 0.0127 -0.0116 0.0058 831 HIS 436 NE2 0.0138 -0.0134 0.0130 832 HIS 437 N 0.0042 -0.0015 0.0009 833 HIS 437 CA 0.0022 -0.0006 0.0005 834 HIS 437 C 0.0036 -0.0007 0.0022 835 HIS 437 O 0.0050 -0.0005 0.0050 836 HIS 437 CB -0.0009 0.0012 0.0017 837 HIS 437 CG -0.0026 0.0014 0.0001 838 HIS 437 CD2 -0.0037 0.0025 0.0016 839 HIS 437 ND1 -0.0034 0.0007 -0.0032 840 HIS 437 CE1 -0.0050 0.0013 -0.0036 841 HIS 437 NE2 -0.0052 0.0024 -0.0008 842 ASN 438 N 0.0030 -0.0010 0.0007 843 ASN 438 CA 0.0030 -0.0005 0.0022 844 ASN 438 C -0.0003 0.0012 0.0025 845 ASN 438 O -0.0007 0.0020 0.0042 846 ASN 438 CB 0.0046 -0.0019 0.0002 847 ASN 438 CG 0.0032 -0.0024 -0.0032 848 ASN 438 ND2 0.0042 -0.0034 -0.0048 849 ASN 438 OD1 0.0015 -0.0021 -0.0047 850 SER 439 N 0.0008 0.0030 0.0036 851 SER 439 CA -0.0003 0.0041 0.0033 852 SER 439 C -0.0001 0.0055 0.0042 853 SER 439 O 0.0008 0.0056 0.0051 854 SER 439 CB -0.0007 0.0039 0.0028 855 SER 439 OG 0.0001 0.0039 0.0035 856 VAL 440 N -0.0011 0.0064 0.0040 857 VAL 440 CA -0.0012 0.0078 0.0047 858 VAL 440 C -0.0023 0.0087 0.0043 859 VAL 440 O -0.0032 0.0084 0.0033 860 VAL 440 CB -0.0013 0.0082 0.0049 861 VAL 440 CG1 -0.0013 0.0096 0.0057 862 VAL 440 CG2 -0.0002 0.0073 0.0053 863 GLU 441 N 0.0013 0.0119 0.0031 864 GLU 441 CA 0.0010 0.0107 0.0036 865 GLU 441 C 0.0016 0.0122 0.0029 866 GLU 441 O 0.0029 0.0136 0.0018 867 GLU 441 CB 0.0019 0.0081 0.0035 868 GLU 441 CG 0.0042 0.0077 0.0022 869 GLU 441 CD 0.0047 0.0051 0.0023 870 GLU 441 OE1 0.0040 0.0035 0.0030 871 GLU 441 OE2 0.0055 0.0048 0.0019 872 ARG 442 N 0.0007 0.0119 0.0035 873 ARG 442 CA 0.0009 0.0132 0.0031 874 ARG 442 C 0.0017 0.0115 0.0030 875 ARG 442 O 0.0006 0.0099 0.0039 876 ARG 442 CB -0.0011 0.0146 0.0041 877 ARG 442 CG -0.0010 0.0161 0.0037 878 ARG 442 CD -0.0031 0.0171 0.0049 879 ARG 442 NE -0.0043 0.0154 0.0059 880 ARG 442 CZ -0.0060 0.0145 0.0071 881 ARG 442 NH1 -0.0069 0.0154 0.0075 882 ARG 442 NH2 -0.0068 0.0129 0.0079 883 TYR 443 N 0.0051 0.0122 0.0013 884 TYR 443 CA 0.0067 0.0109 0.0010 885 TYR 443 C 0.0046 0.0154 0.0010 886 TYR 443 O 0.0054 0.0203 0.0004 887 TYR 443 CB 0.0129 0.0105 -0.0003 888 TYR 443 CG 0.0152 0.0091 -0.0008 889 TYR 443 CD1 0.0149 0.0037 -0.0001 890 TYR 443 CD2 0.0180 0.0132 -0.0018 891 TYR 443 CE1 0.0175 0.0024 -0.0006 892 TYR 443 CE2 0.0206 0.0119 -0.0023 893 TYR 443 CZ 0.0204 0.0064 -0.0017 894 TYR 443 OH 0.0232 0.0052 -0.0022 895 GLU 444 N 0.0026 0.0136 0.0017 896 GLU 444 CA 0.0008 0.0172 0.0017 897 GLU 444 C 0.0045 0.0164 0.0010 898 GLU 444 O 0.0039 0.0123 0.0015 899 GLU 444 CB -0.0052 0.0160 0.0032 900 GLU 444 CG -0.0087 0.0178 0.0038 901 GLU 444 CD -0.0147 0.0166 0.0053 902 GLU 444 OE1 -0.0170 0.0174 0.0058 903 GLU 444 OE2 -0.0172 0.0166 0.0059 904 PRO 445 N 0.0109 0.0282 -0.0037 905 PRO 445 CA 0.0273 0.0354 0.0014 906 PRO 445 C 0.0271 0.0445 -0.0030 907 PRO 445 O 0.0385 0.0448 0.0026 908 PRO 445 CB 0.0359 0.0479 -0.0001 909 PRO 445 CG 0.0281 0.0407 -0.0007 910 PRO 445 CD 0.0101 0.0334 -0.0064 911 GLU 446 N 0.0142 0.0519 -0.0129 912 GLU 446 CA 0.0121 0.0609 -0.0182 913 GLU 446 C 0.0074 0.0489 -0.0150 914 GLU 446 O 0.0072 0.0548 -0.0179 915 GLU 446 CB -0.0012 0.0719 -0.0300 916 GLU 446 CG 0.0026 0.0854 -0.0343 917 GLU 446 CD -0.0011 0.0789 -0.0332 918 GLU 446 OE1 -0.0074 0.0636 -0.0293 919 GLU 446 OE2 0.0038 0.0893 -0.0355 920 ARG 447 N -0.0053 0.0095 0.0183 921 ARG 447 CA -0.0108 -0.0059 0.0241 922 ARG 447 C -0.0003 -0.0171 0.0188 923 ARG 447 O -0.0016 -0.0318 0.0217 924 ARG 447 CB -0.0243 -0.0018 0.0324 925 ARG 447 CG -0.0367 0.0065 0.0394 926 ARG 447 CD -0.0427 -0.0040 0.0448 927 ARG 447 NE -0.0334 -0.0055 0.0389 928 ARG 447 CZ -0.0322 -0.0171 0.0397 929 ARG 447 NH1 -0.0407 -0.0287 0.0470 930 ARG 447 NH2 -0.0220 -0.0172 0.0331 931 ASP 448 N 0.0107 -0.0105 0.0106 932 ASP 448 CA 0.0207 -0.0187 0.0052 933 ASP 448 C 0.0135 -0.0245 0.0107 934 ASP 448 O 0.0161 -0.0382 0.0109 935 ASP 448 CB 0.0309 -0.0316 0.0003 936 ASP 448 CG 0.0433 -0.0373 -0.0070 937 ASP 448 OD1 0.0478 -0.0270 -0.0115 938 ASP 448 OD2 0.0504 -0.0500 -0.0099 939 GLU 449 N -0.0009 -0.0139 0.0109 940 GLU 449 CA -0.0017 -0.0129 0.0126 941 GLU 449 C -0.0002 -0.0078 0.0118 942 GLU 449 O -0.0001 -0.0040 0.0129 943 GLU 449 CB -0.0047 -0.0135 0.0175 944 GLU 449 CG -0.0065 -0.0189 0.0187 945 GLU 449 CD -0.0095 -0.0193 0.0236 946 GLU 449 OE1 -0.0111 -0.0234 0.0249 947 GLU 449 OE2 -0.0101 -0.0155 0.0261 948 TRP 450 N 0.0007 -0.0075 0.0105 949 TRP 450 CA 0.0016 -0.0030 0.0105 950 TRP 450 C -0.0006 -0.0023 0.0146 951 TRP 450 O -0.0017 -0.0054 0.0152 952 TRP 450 CB 0.0040 -0.0030 0.0064 953 TRP 450 CG 0.0065 -0.0024 0.0023 954 TRP 450 CD1 0.0075 -0.0061 -0.0007 955 TRP 450 CD2 0.0084 0.0022 0.0006 956 TRP 450 CE2 0.0106 0.0010 -0.0035 957 TRP 450 CE3 0.0086 0.0073 0.0022 958 TRP 450 NE1 0.0099 -0.0042 -0.0041 959 TRP 450 CZ2 0.0128 0.0046 -0.0060 960 TRP 450 CZ3 0.0107 0.0109 -0.0002 961 TRP 450 CH2 0.0129 0.0096 -0.0043 962 HIS 451 N -0.0065 -0.0003 0.0106 963 HIS 451 CA -0.0074 0.0013 0.0137 964 HIS 451 C -0.0045 0.0058 0.0127 965 HIS 451 O -0.0027 0.0093 0.0127 966 HIS 451 CB -0.0099 0.0021 0.0187 967 HIS 451 CG -0.0131 -0.0024 0.0200 968 HIS 451 CD2 -0.0138 -0.0045 0.0194 969 HIS 451 ND1 -0.0156 -0.0053 0.0218 970 HIS 451 CE1 -0.0178 -0.0091 0.0222 971 HIS 451 NE2 -0.0168 -0.0087 0.0208 972 LEU 452 N -0.0041 0.0059 0.0120 973 LEU 452 CA -0.0017 0.0102 0.0117 974 LEU 452 C -0.0024 0.0139 0.0164 975 LEU 452 O -0.0052 0.0127 0.0200 976 LEU 452 CB -0.0014 0.0092 0.0104 977 LEU 452 CG 0.0007 0.0074 0.0052 978 LEU 452 CD1 0.0042 0.0111 0.0024 979 LEU 452 CD2 -0.0004 0.0029 0.0029 980 VAL 453 N -0.0057 0.0127 0.0055 981 VAL 453 CA -0.0058 0.0123 0.0050 982 VAL 453 C -0.0057 0.0112 0.0049 983 VAL 453 O -0.0056 0.0108 0.0051 984 VAL 453 CB -0.0057 0.0126 0.0054 985 VAL 453 CG1 -0.0058 0.0136 0.0054 986 VAL 453 CG2 -0.0054 0.0122 0.0064 987 ALA 454 N -0.0058 0.0107 0.0045 988 ALA 454 CA -0.0057 0.0096 0.0044 989 ALA 454 C -0.0054 0.0092 0.0054 990 ALA 454 O -0.0052 0.0095 0.0060 991 ALA 454 CB -0.0058 0.0092 0.0040 992 PRO 455 N -0.0036 0.0026 0.0010 993 PRO 455 CA -0.0031 0.0018 0.0024 994 PRO 455 C -0.0035 0.0011 0.0021 995 PRO 455 O -0.0045 0.0006 0.0010 996 PRO 455 CB -0.0033 0.0003 0.0030 997 PRO 455 CG -0.0044 -0.0001 0.0016 998 PRO 455 CD -0.0044 0.0016 0.0005 999 MET 456 N -0.0028 0.0009 0.0033 1000 MET 456 CA -0.0031 -0.0000 0.0034 1001 MET 456 C -0.0040 -0.0019 0.0033 1002 MET 456 O -0.0040 -0.0026 0.0038 1003 MET 456 CB -0.0021 -0.0001 0.0050 1004 MET 456 CG -0.0013 0.0017 0.0051 1005 MET 456 SD -0.0001 0.0017 0.0069 1006 MET 456 CE 0.0005 0.0011 0.0082 1007 LEU 457 N -0.0057 -0.0065 0.0016 1008 LEU 457 CA -0.0064 -0.0103 0.0012 1009 LEU 457 C -0.0034 -0.0132 0.0034 1010 LEU 457 O -0.0038 -0.0169 0.0032 1011 LEU 457 CB -0.0075 -0.0092 0.0005 1012 LEU 457 CG -0.0104 -0.0061 -0.0015 1013 LEU 457 CD1 -0.0112 -0.0051 -0.0021 1014 LEU 457 CD2 -0.0137 -0.0076 -0.0037 1015 THR 458 N -0.0003 -0.0114 0.0054 1016 THR 458 CA 0.0029 -0.0137 0.0076 1017 THR 458 C 0.0048 -0.0132 0.0088 1018 THR 458 O 0.0050 -0.0099 0.0089 1019 THR 458 CB 0.0051 -0.0123 0.0090 1020 THR 458 CG2 0.0075 -0.0156 0.0107 1021 THR 458 OG1 0.0032 -0.0114 0.0077 1022 ARG 459 N 0.0071 -0.0112 0.0050 1023 ARG 459 CA 0.0066 -0.0096 0.0064 1024 ARG 459 C 0.0067 -0.0098 0.0089 1025 ARG 459 O 0.0073 -0.0116 0.0098 1026 ARG 459 CB 0.0068 -0.0101 0.0063 1027 ARG 459 CG 0.0066 -0.0097 0.0039 1028 ARG 459 CD 0.0068 -0.0104 0.0037 1029 ARG 459 NE 0.0067 -0.0100 0.0014 1030 ARG 459 CZ 0.0061 -0.0081 0.0005 1031 ARG 459 NH1 0.0055 -0.0063 0.0017 1032 ARG 459 NH2 0.0060 -0.0080 -0.0017 1033 ARG 460 N 0.0061 -0.0079 0.0101 1034 ARG 460 CA 0.0062 -0.0080 0.0125 1035 ARG 460 C 0.0056 -0.0061 0.0140 1036 ARG 460 O 0.0050 -0.0042 0.0137 1037 ARG 460 CB 0.0062 -0.0080 0.0125 1038 ARG 460 CG 0.0067 -0.0098 0.0111 1039 ARG 460 CD 0.0067 -0.0096 0.0112 1040 ARG 460 NE 0.0072 -0.0112 0.0098 1041 ARG 460 CZ 0.0078 -0.0132 0.0104 1042 ARG 460 NH1 0.0081 -0.0139 0.0125 1043 ARG 460 NH2 0.0082 -0.0144 0.0089 1044 ILE 461 N 0.0084 -0.0125 0.0103 1045 ILE 461 CA 0.0073 -0.0124 0.0104 1046 ILE 461 C 0.0068 -0.0131 0.0108 1047 ILE 461 O 0.0071 -0.0132 0.0109 1048 ILE 461 CB 0.0069 -0.0116 0.0099 1049 ILE 461 CG1 0.0066 -0.0113 0.0098 1050 ILE 461 CG2 0.0075 -0.0109 0.0095 1051 ILE 461 CD1 0.0059 -0.0106 0.0094 1052 GLY 462 N 0.0060 -0.0134 0.0110 1053 GLY 462 CA 0.0056 -0.0141 0.0115 1054 GLY 462 C 0.0063 -0.0149 0.0119 1055 GLY 462 O 0.0065 -0.0153 0.0121 1056 VAL 463 N 0.0061 -0.0111 0.0121 1057 VAL 463 CA 0.0053 -0.0108 0.0105 1058 VAL 463 C 0.0059 -0.0092 0.0101 1059 VAL 463 O 0.0067 -0.0080 0.0105 1060 VAL 463 CB 0.0046 -0.0107 0.0093 1061 VAL 463 CG1 0.0053 -0.0094 0.0093 1062 VAL 463 CG2 0.0036 -0.0106 0.0076 1063 GLY 464 N 0.0054 -0.0093 0.0095 1064 GLY 464 CA 0.0058 -0.0079 0.0088 1065 GLY 464 C 0.0052 -0.0071 0.0072 1066 GLY 464 O 0.0042 -0.0080 0.0063 1067 VAL 465 N 0.0010 -0.0038 0.0056 1068 VAL 465 CA 0.0006 -0.0019 0.0017 1069 VAL 465 C 0.0017 0.0010 -0.0007 1070 VAL 465 O 0.0039 0.0027 0.0010 1071 VAL 465 CB 0.0022 -0.0003 0.0024 1072 VAL 465 CG1 0.0019 0.0018 -0.0016 1073 VAL 465 CG2 0.0008 -0.0033 0.0044 1074 ALA 466 N -0.0000 0.0014 -0.0046 1075 ALA 466 CA 0.0009 0.0043 -0.0075 1076 ALA 466 C -0.0005 0.0052 -0.0116 1077 ALA 466 O -0.0024 0.0033 -0.0123 1078 ALA 466 CB -0.0000 0.0033 -0.0077 1079 VAL 467 N -0.0031 0.0049 -0.0142 1080 VAL 467 CA -0.0050 0.0067 -0.0189 1081 VAL 467 C -0.0058 0.0074 -0.0207 1082 VAL 467 O -0.0040 0.0096 -0.0187 1083 VAL 467 CB -0.0040 0.0114 -0.0198 1084 VAL 467 CG1 -0.0059 0.0137 -0.0247 1085 VAL 467 CG2 -0.0037 0.0103 -0.0185 1086 LEU 468 N -0.0083 0.0059 -0.0245 1087 LEU 468 CA -0.0093 0.0065 -0.0268 1088 LEU 468 C -0.0118 0.0073 -0.0318 1089 LEU 468 O -0.0135 0.0048 -0.0334 1090 LEU 468 CB -0.0098 0.0022 -0.0251 1091 LEU 468 CG -0.0112 0.0019 -0.0276 1092 LEU 468 CD1 -0.0096 0.0062 -0.0272 1093 LEU 468 CD2 -0.0117 -0.0027 -0.0257 1094 ASN 469 N -0.0102 0.0148 -0.0633 1095 ASN 469 CA -0.0095 0.0141 -0.0604 1096 ASN 469 C -0.0052 0.0105 -0.0500 1097 ASN 469 O -0.0079 0.0114 -0.0443 1098 ASN 469 CB -0.0186 0.0196 -0.0615 1099 ASN 469 CG -0.0221 0.0227 -0.0722 1100 ASN 469 ND2 -0.0306 0.0278 -0.0730 1101 ASN 469 OD1 -0.0169 0.0205 -0.0797 1102 ARG 470 N 0.0015 0.0063 -0.0475 1103 ARG 470 CA 0.0058 0.0027 -0.0375 1104 ARG 470 C -0.0004 0.0053 -0.0281 1105 ARG 470 O 0.0025 0.0027 -0.0195 1106 ARG 470 CB 0.0113 -0.0007 -0.0357 1107 ARG 470 CG 0.0195 -0.0047 -0.0432 1108 ARG 470 CD 0.0241 -0.0076 -0.0422 1109 ARG 470 NE 0.0274 -0.0106 -0.0319 1110 ARG 470 CZ 0.0232 -0.0089 -0.0241 1111 ARG 470 NH1 0.0154 -0.0043 -0.0247 1112 ARG 470 NH2 0.0266 -0.0119 -0.0152 1113 LEU 471 N -0.0080 0.0085 -0.0262 1114 LEU 471 CA -0.0108 0.0077 -0.0222 1115 LEU 471 C -0.0093 0.0071 -0.0202 1116 LEU 471 O -0.0085 0.0077 -0.0227 1117 LEU 471 CB -0.0159 0.0084 -0.0233 1118 LEU 471 CG -0.0176 0.0090 -0.0253 1119 LEU 471 CD1 -0.0226 0.0097 -0.0268 1120 LEU 471 CD2 -0.0173 0.0082 -0.0220 1121 LEU 472 N -0.0091 0.0060 -0.0158 1122 LEU 472 CA -0.0082 0.0053 -0.0133 1123 LEU 472 C -0.0128 0.0054 -0.0122 1124 LEU 472 O -0.0159 0.0052 -0.0103 1125 LEU 472 CB -0.0055 0.0041 -0.0091 1126 LEU 472 CG -0.0038 0.0033 -0.0062 1127 LEU 472 CD1 0.0004 0.0035 -0.0083 1128 LEU 472 CD2 -0.0024 0.0020 -0.0016 1129 TYR 473 N -0.0064 0.0045 -0.0098 1130 TYR 473 CA -0.0083 0.0014 -0.0081 1131 TYR 473 C -0.0067 -0.0000 -0.0039 1132 TYR 473 O -0.0039 0.0016 -0.0022 1133 TYR 473 CB -0.0087 0.0017 -0.0092 1134 TYR 473 CG -0.0108 0.0024 -0.0132 1135 TYR 473 CD1 -0.0097 0.0055 -0.0159 1136 TYR 473 CD2 -0.0140 -0.0001 -0.0142 1137 TYR 473 CE1 -0.0118 0.0061 -0.0197 1138 TYR 473 CE2 -0.0161 0.0004 -0.0179 1139 TYR 473 CZ -0.0150 0.0035 -0.0207 1140 TYR 473 OH -0.0171 0.0040 -0.0243 1141 ALA 474 N -0.0086 -0.0031 -0.0023 1142 ALA 474 CA -0.0077 -0.0050 0.0017 1143 ALA 474 C -0.0096 -0.0077 0.0028 1144 ALA 474 O -0.0126 -0.0098 0.0014 1145 ALA 474 CB -0.0081 -0.0063 0.0029 1146 VAL 475 N 0.0056 -0.0081 0.0042 1147 VAL 475 CA 0.0048 -0.0086 0.0042 1148 VAL 475 C 0.0057 -0.0104 0.0067 1149 VAL 475 O 0.0081 -0.0102 0.0079 1150 VAL 475 CB 0.0059 -0.0065 0.0027 1151 VAL 475 CG1 0.0052 -0.0069 0.0027 1152 VAL 475 CG2 0.0049 -0.0048 0.0002 1153 GLY 476 N 0.0038 -0.0121 0.0073 1154 GLY 476 CA 0.0044 -0.0139 0.0095 1155 GLY 476 C 0.0057 -0.0151 0.0115 1156 GLY 476 O 0.0049 -0.0155 0.0115 1157 GLY 477 N 0.0062 -0.0163 0.0133 1158 GLY 477 CA 0.0066 -0.0178 0.0135 1159 GLY 477 C 0.0060 -0.0161 0.0140 1160 GLY 477 O 0.0053 -0.0138 0.0130 1161 PHE 478 N 0.0064 -0.0173 0.0151 1162 PHE 478 CA 0.0059 -0.0162 0.0157 1163 PHE 478 C 0.0061 -0.0171 0.0185 1164 PHE 478 O 0.0068 -0.0195 0.0191 1165 PHE 478 CB 0.0063 -0.0169 0.0133 1166 PHE 478 CG 0.0060 -0.0158 0.0135 1167 PHE 478 CD1 0.0051 -0.0131 0.0129 1168 PHE 478 CD2 0.0065 -0.0175 0.0142 1169 PHE 478 CE1 0.0048 -0.0121 0.0130 1170 PHE 478 CE2 0.0062 -0.0165 0.0143 1171 PHE 478 CZ 0.0053 -0.0138 0.0138 1172 ASP 479 N 0.0121 -0.0148 0.0215 1173 ASP 479 CA 0.0119 -0.0154 0.0242 1174 ASP 479 C 0.0118 -0.0162 0.0230 1175 ASP 479 O 0.0116 -0.0174 0.0249 1176 ASP 479 CB 0.0123 -0.0126 0.0268 1177 ASP 479 CG 0.0129 -0.0092 0.0255 1178 ASP 479 OD1 0.0130 -0.0092 0.0228 1179 ASP 479 OD2 0.0133 -0.0067 0.0270 1180 GLY 480 N 0.0120 -0.0158 0.0197 1181 GLY 480 CA 0.0120 -0.0159 0.0181 1182 GLY 480 C 0.0126 -0.0127 0.0166 1183 GLY 480 O 0.0126 -0.0127 0.0142 1184 THR 481 N 0.0095 -0.0030 0.0308 1185 THR 481 CA 0.0063 0.0157 0.0252 1186 THR 481 C 0.0028 0.0176 0.0166 1187 THR 481 O -0.0032 0.0230 0.0021 1188 THR 481 CB 0.0114 0.0290 0.0403 1189 THR 481 CG2 0.0086 0.0489 0.0358 1190 THR 481 OG1 0.0146 0.0273 0.0482 1191 ASN 482 N 0.0064 0.0118 0.0249 1192 ASN 482 CA 0.0041 0.0142 0.0196 1193 ASN 482 C 0.0030 -0.0038 0.0141 1194 ASN 482 O 0.0065 -0.0181 0.0211 1195 ASN 482 CB 0.0093 0.0235 0.0340 1196 ASN 482 CG 0.0100 0.0418 0.0386 1197 ASN 482 ND2 0.0159 0.0444 0.0539 1198 ASN 482 OD1 0.0053 0.0535 0.0281 1199 ARG 483 N -0.0003 -0.0044 0.0155 1200 ARG 483 CA 0.0000 -0.0078 0.0141 1201 ARG 483 C 0.0014 -0.0084 0.0150 1202 ARG 483 O 0.0010 -0.0062 0.0159 1203 ARG 483 CB -0.0026 -0.0086 0.0111 1204 ARG 483 CG -0.0037 -0.0089 0.0098 1205 ARG 483 CD -0.0052 -0.0057 0.0101 1206 ARG 483 NE -0.0061 -0.0062 0.0089 1207 ARG 483 CZ -0.0075 -0.0039 0.0088 1208 ARG 483 NH1 -0.0084 -0.0008 0.0096 1209 ARG 483 NH2 -0.0081 -0.0047 0.0078 1210 LEU 484 N 0.0030 -0.0115 0.0150 1211 LEU 484 CA 0.0048 -0.0123 0.0163 1212 LEU 484 C 0.0040 -0.0146 0.0143 1213 LEU 484 O 0.0036 -0.0171 0.0127 1214 LEU 484 CB 0.0076 -0.0140 0.0182 1215 LEU 484 CG 0.0086 -0.0120 0.0201 1216 LEU 484 CD1 0.0112 -0.0142 0.0215 1217 LEU 484 CD2 0.0090 -0.0090 0.0222 1218 ASN 485 N 0.0071 -0.0145 0.0092 1219 ASN 485 CA 0.0068 -0.0127 0.0078 1220 ASN 485 C 0.0058 -0.0122 0.0075 1221 ASN 485 O 0.0055 -0.0108 0.0064 1222 ASN 485 CB 0.0056 -0.0120 0.0074 1223 ASN 485 CG 0.0035 -0.0126 0.0079 1224 ASN 485 ND2 0.0025 -0.0135 0.0087 1225 ASN 485 OD1 0.0027 -0.0124 0.0078 1226 SER 486 N 0.0049 -0.0134 0.0085 1227 SER 486 CA 0.0036 -0.0130 0.0082 1228 SER 486 C 0.0049 -0.0124 0.0077 1229 SER 486 O 0.0067 -0.0128 0.0079 1230 SER 486 CB 0.0024 -0.0145 0.0094 1231 SER 486 OG 0.0037 -0.0157 0.0103 1232 ALA 487 N -0.0035 -0.0085 0.0030 1233 ALA 487 CA -0.0031 -0.0055 0.0022 1234 ALA 487 C -0.0049 -0.0051 -0.0004 1235 ALA 487 O -0.0065 -0.0068 -0.0018 1236 ALA 487 CB -0.0022 -0.0035 0.0024 1237 GLU 488 N -0.0046 -0.0030 -0.0010 1238 GLU 488 CA -0.0062 -0.0023 -0.0034 1239 GLU 488 C -0.0057 0.0010 -0.0042 1240 GLU 488 O -0.0040 0.0027 -0.0027 1241 GLU 488 CB -0.0068 -0.0040 -0.0033 1242 GLU 488 CG -0.0051 -0.0038 -0.0013 1243 GLU 488 CD -0.0058 -0.0061 -0.0011 1244 GLU 488 OE1 -0.0071 -0.0059 -0.0028 1245 GLU 488 OE2 -0.0050 -0.0081 0.0008 1246 CYS 489 N -0.0173 0.0071 -0.0052 1247 CYS 489 CA -0.0158 0.0070 -0.0064 1248 CYS 489 C -0.0147 0.0069 -0.0053 1249 CYS 489 O -0.0155 0.0070 -0.0045 1250 CYS 489 CB -0.0167 0.0070 -0.0081 1251 CYS 489 SG -0.0150 0.0068 -0.0094 1252 TYR 490 N -0.0129 0.0067 -0.0054 1253 TYR 490 CA -0.0116 0.0065 -0.0046 1254 TYR 490 C -0.0108 0.0064 -0.0061 1255 TYR 490 O -0.0101 0.0063 -0.0075 1256 TYR 490 CB -0.0102 0.0064 -0.0035 1257 TYR 490 CG -0.0087 0.0063 -0.0028 1258 TYR 490 CD1 -0.0089 0.0063 -0.0012 1259 TYR 490 CD2 -0.0069 0.0061 -0.0036 1260 TYR 490 CE1 -0.0074 0.0062 -0.0004 1261 TYR 490 CE2 -0.0054 0.0059 -0.0028 1262 TYR 490 CZ -0.0057 0.0060 -0.0012 1263 TYR 490 OH -0.0042 0.0058 -0.0004 1264 TYR 491 N -0.0010 0.0113 0.0030 1265 TYR 491 CA -0.0002 0.0066 0.0085 1266 TYR 491 C -0.0014 0.0028 0.0097 1267 TYR 491 O 0.0007 0.0052 0.0115 1268 TYR 491 CB 0.0042 0.0100 0.0135 1269 TYR 491 CG 0.0058 0.0061 0.0198 1270 TYR 491 CD1 0.0034 0.0000 0.0207 1271 TYR 491 CD2 0.0098 0.0088 0.0247 1272 TYR 491 CE1 0.0049 -0.0034 0.0266 1273 TYR 491 CE2 0.0114 0.0053 0.0305 1274 TYR 491 CZ 0.0089 -0.0008 0.0315 1275 TYR 491 OH 0.0103 -0.0042 0.0371 1276 PRO 492 N -0.0049 -0.0028 0.0083 1277 PRO 492 CA -0.0066 -0.0063 0.0084 1278 PRO 492 C -0.0038 -0.0075 0.0144 1279 PRO 492 O -0.0030 -0.0062 0.0147 1280 PRO 492 CB -0.0105 -0.0123 0.0067 1281 PRO 492 CG -0.0117 -0.0107 0.0030 1282 PRO 492 CD -0.0078 -0.0059 0.0059 1283 GLU 493 N -0.0111 -0.0041 0.0250 1284 GLU 493 CA -0.0055 -0.0047 0.0240 1285 GLU 493 C 0.0023 -0.0020 0.0192 1286 GLU 493 O 0.0063 -0.0008 0.0170 1287 GLU 493 CB -0.0031 -0.0115 0.0298 1288 GLU 493 CG -0.0103 -0.0144 0.0346 1289 GLU 493 CD -0.0151 -0.0172 0.0385 1290 GLU 493 OE1 -0.0144 -0.0158 0.0370 1291 GLU 493 OE2 -0.0199 -0.0206 0.0431 1292 ARG 494 N 0.0045 -0.0008 0.0175 1293 ARG 494 CA 0.0110 0.0027 0.0123 1294 ARG 494 C 0.0076 0.0093 0.0071 1295 ARG 494 O 0.0121 0.0131 0.0022 1296 ARG 494 CB 0.0170 -0.0011 0.0142 1297 ARG 494 CG 0.0251 0.0013 0.0097 1298 ARG 494 CD 0.0307 -0.0022 0.0115 1299 ARG 494 NE 0.0345 -0.0086 0.0164 1300 ARG 494 CZ 0.0400 -0.0123 0.0183 1301 ARG 494 NH1 0.0421 -0.0107 0.0163 1302 ARG 494 NH2 0.0437 -0.0176 0.0223 1303 ASN 495 N 0.0027 -0.0002 0.0091 1304 ASN 495 CA -0.0010 0.0053 0.0051 1305 ASN 495 C 0.0007 0.0104 0.0034 1306 ASN 495 O 0.0021 0.0162 0.0012 1307 ASN 495 CB -0.0005 0.0077 0.0042 1308 ASN 495 CG -0.0048 0.0128 0.0001 1309 ASN 495 ND2 -0.0023 0.0177 -0.0012 1310 ASN 495 OD1 -0.0106 0.0124 -0.0018 1311 GLU 496 N 0.0010 0.0084 0.0045 1312 GLU 496 CA 0.0036 0.0124 0.0036 1313 GLU 496 C -0.0011 0.0115 0.0022 1314 GLU 496 O -0.0030 0.0060 0.0040 1315 GLU 496 CB 0.0107 0.0110 0.0069 1316 GLU 496 CG 0.0140 0.0148 0.0064 1317 GLU 496 CD 0.0212 0.0135 0.0097 1318 GLU 496 OE1 0.0257 0.0158 0.0104 1319 GLU 496 OE2 0.0224 0.0099 0.0119 1320 TRP 497 N -0.0078 0.0060 0.0012 1321 TRP 497 CA -0.0097 0.0063 0.0001 1322 TRP 497 C -0.0118 0.0069 -0.0002 1323 TRP 497 O -0.0123 0.0076 0.0014 1324 TRP 497 CB -0.0102 0.0068 0.0013 1325 TRP 497 CG -0.0086 0.0062 0.0012 1326 TRP 497 CD1 -0.0067 0.0061 0.0026 1327 TRP 497 CD2 -0.0085 0.0057 -0.0005 1328 TRP 497 CE2 -0.0066 0.0052 0.0000 1329 TRP 497 CE3 -0.0099 0.0056 -0.0024 1330 TRP 497 NE1 -0.0055 0.0054 0.0020 1331 TRP 497 CZ2 -0.0060 0.0046 -0.0013 1332 TRP 497 CZ3 -0.0093 0.0050 -0.0038 1333 TRP 497 CH2 -0.0074 0.0045 -0.0032 1334 ARG 498 N -0.0132 0.0068 -0.0020 1335 ARG 498 CA -0.0154 0.0075 -0.0024 1336 ARG 498 C -0.0170 0.0077 -0.0035 1337 ARG 498 O -0.0165 0.0071 -0.0050 1338 ARG 498 CB -0.0154 0.0070 -0.0039 1339 ARG 498 CG -0.0143 0.0070 -0.0026 1340 ARG 498 CD -0.0143 0.0066 -0.0040 1341 ARG 498 NE -0.0133 0.0067 -0.0027 1342 ARG 498 CZ -0.0140 0.0071 -0.0022 1343 ARG 498 NH1 -0.0158 0.0074 -0.0032 1344 ARG 498 NH2 -0.0128 0.0071 -0.0007 1345 MET 499 N -0.0145 -0.0090 -0.0052 1346 MET 499 CA -0.0136 -0.0089 -0.0049 1347 MET 499 C -0.0138 -0.0070 -0.0062 1348 MET 499 O -0.0155 -0.0064 -0.0071 1349 MET 499 CB -0.0147 -0.0105 -0.0043 1350 MET 499 CG -0.0146 -0.0124 -0.0031 1351 MET 499 SD -0.0121 -0.0129 -0.0019 1352 MET 499 CE -0.0107 -0.0127 -0.0015 1353 ILE 500 N -0.0123 -0.0062 -0.0061 1354 ILE 500 CA -0.0123 -0.0046 -0.0071 1355 ILE 500 C -0.0122 -0.0053 -0.0066 1356 ILE 500 O -0.0120 -0.0069 -0.0055 1357 ILE 500 CB -0.0106 -0.0029 -0.0075 1358 ILE 500 CG1 -0.0084 -0.0033 -0.0065 1359 ILE 500 CG2 -0.0109 -0.0022 -0.0081 1360 ILE 500 CD1 -0.0068 -0.0016 -0.0070 1361 THR 501 N 0.0001 -0.0061 -0.0002 1362 THR 501 CA 0.0018 -0.0062 0.0000 1363 THR 501 C 0.0031 -0.0070 -0.0001 1364 THR 501 O 0.0033 -0.0067 0.0000 1365 THR 501 CB 0.0023 -0.0045 0.0007 1366 THR 501 CG2 0.0039 -0.0045 0.0009 1367 THR 501 OG1 0.0010 -0.0038 0.0009 1368 ALA 502 N 0.0041 -0.0082 -0.0005 1369 ALA 502 CA 0.0055 -0.0090 -0.0006 1370 ALA 502 C 0.0069 -0.0078 0.0000 1371 ALA 502 O 0.0072 -0.0068 0.0004 1372 ALA 502 CB 0.0061 -0.0104 -0.0011 1373 MET 503 N 0.0055 -0.0085 -0.0002 1374 MET 503 CA 0.0065 -0.0079 -0.0000 1375 MET 503 C 0.0066 -0.0084 0.0001 1376 MET 503 O 0.0064 -0.0094 0.0004 1377 MET 503 CB 0.0076 -0.0081 0.0004 1378 MET 503 CG 0.0076 -0.0076 0.0002 1379 MET 503 SD 0.0089 -0.0078 0.0007 1380 MET 503 CE 0.0087 -0.0093 0.0011 1381 ASN 504 N 0.0072 -0.0077 0.0001 1382 ASN 504 CA 0.0076 -0.0081 0.0003 1383 ASN 504 C 0.0084 -0.0090 0.0009 1384 ASN 504 O 0.0085 -0.0097 0.0011 1385 ASN 504 CB 0.0081 -0.0071 0.0002 1386 ASN 504 CG 0.0074 -0.0061 -0.0003 1387 ASN 504 ND2 0.0076 -0.0052 -0.0005 1388 ASN 504 OD1 0.0068 -0.0060 -0.0005 1389 THR 505 N 0.0032 -0.0064 0.0018 1390 THR 505 CA 0.0023 -0.0056 0.0012 1391 THR 505 C 0.0038 -0.0056 0.0036 1392 THR 505 O 0.0057 -0.0076 0.0046 1393 THR 505 CB 0.0018 -0.0075 -0.0016 1394 THR 505 CG2 -0.0000 -0.0060 -0.0029 1395 THR 505 OG1 0.0011 -0.0084 -0.0036 1396 ILE 506 N 0.0029 -0.0037 0.0043 1397 ILE 506 CA 0.0041 -0.0040 0.0058 1398 ILE 506 C 0.0045 -0.0064 0.0040 1399 ILE 506 O 0.0030 -0.0064 0.0016 1400 ILE 506 CB 0.0029 -0.0012 0.0067 1401 ILE 506 CG1 0.0029 0.0009 0.0091 1402 ILE 506 CG2 0.0038 -0.0017 0.0078 1403 ILE 506 CD1 0.0016 0.0038 0.0100 1404 ARG 507 N 0.0009 -0.0066 0.0062 1405 ARG 507 CA 0.0019 -0.0082 0.0050 1406 ARG 507 C 0.0024 -0.0100 0.0061 1407 ARG 507 O 0.0025 -0.0109 0.0073 1408 ARG 507 CB 0.0022 -0.0084 0.0043 1409 ARG 507 CG 0.0018 -0.0067 0.0033 1410 ARG 507 CD 0.0021 -0.0071 0.0027 1411 ARG 507 NE 0.0016 -0.0055 0.0017 1412 ARG 507 CZ 0.0019 -0.0049 -0.0002 1413 ARG 507 NH1 0.0027 -0.0058 -0.0015 1414 ARG 507 NH2 0.0014 -0.0034 -0.0008 1415 SER 508 N 0.0029 -0.0107 0.0054 1416 SER 508 CA 0.0036 -0.0126 0.0060 1417 SER 508 C 0.0046 -0.0139 0.0044 1418 SER 508 O 0.0049 -0.0134 0.0027 1419 SER 508 CB 0.0034 -0.0126 0.0066 1420 SER 508 OG 0.0041 -0.0145 0.0070 1421 GLY 509 N 0.0013 -0.0104 0.0037 1422 GLY 509 CA 0.0022 -0.0104 0.0033 1423 GLY 509 C 0.0024 -0.0095 0.0026 1424 GLY 509 O 0.0032 -0.0094 0.0022 1425 ALA 510 N 0.0017 -0.0088 0.0026 1426 ALA 510 CA 0.0019 -0.0080 0.0020 1427 ALA 510 C 0.0023 -0.0081 0.0019 1428 ALA 510 O 0.0021 -0.0087 0.0023 1429 ALA 510 CB 0.0010 -0.0074 0.0021 1430 GLY 511 N 0.0046 -0.0049 0.0025 1431 GLY 511 CA 0.0047 -0.0044 0.0022 1432 GLY 511 C 0.0045 -0.0045 0.0016 1433 GLY 511 O 0.0044 -0.0049 0.0015 1434 VAL 512 N 0.0045 -0.0042 0.0011 1435 VAL 512 CA 0.0043 -0.0042 0.0005 1436 VAL 512 C 0.0044 -0.0036 0.0002 1437 VAL 512 O 0.0046 -0.0032 0.0003 1438 VAL 512 CB 0.0041 -0.0045 0.0001 1439 VAL 512 CG1 0.0040 -0.0045 -0.0006 1440 VAL 512 CG2 0.0040 -0.0052 0.0003 1441 CYS 513 N 0.0033 -0.0046 -0.0005 1442 CYS 513 CA 0.0025 -0.0012 -0.0014 1443 CYS 513 C 0.0015 -0.0009 -0.0030 1444 CYS 513 O 0.0016 -0.0032 -0.0030 1445 CYS 513 CB 0.0040 0.0011 0.0013 1446 CYS 513 SG 0.0054 0.0004 0.0035 1447 VAL 514 N 0.0004 0.0018 -0.0044 1448 VAL 514 CA -0.0004 0.0027 -0.0057 1449 VAL 514 C 0.0007 0.0049 -0.0036 1450 VAL 514 O 0.0013 0.0072 -0.0024 1451 VAL 514 CB -0.0023 0.0041 -0.0086 1452 VAL 514 CG1 -0.0025 0.0076 -0.0085 1453 VAL 514 CG2 -0.0033 0.0043 -0.0103 1454 LEU 515 N 0.0007 0.0023 -0.0008 1455 LEU 515 CA 0.0018 0.0040 -0.0022 1456 LEU 515 C -0.0002 0.0050 -0.0040 1457 LEU 515 O -0.0021 0.0043 -0.0039 1458 LEU 515 CB 0.0029 0.0037 -0.0015 1459 LEU 515 CG 0.0039 0.0054 -0.0030 1460 LEU 515 CD1 0.0063 0.0065 -0.0033 1461 LEU 515 CD2 0.0043 0.0050 -0.0024 1462 HIS 516 N 0.0004 0.0067 -0.0056 1463 HIS 516 CA -0.0013 0.0079 -0.0075 1464 HIS 516 C -0.0039 0.0071 -0.0075 1465 HIS 516 O -0.0057 0.0073 -0.0084 1466 HIS 516 CB -0.0012 0.0087 -0.0083 1467 HIS 516 CG 0.0012 0.0097 -0.0085 1468 HIS 516 CD2 0.0032 0.0106 -0.0087 1469 HIS 516 ND1 0.0016 0.0102 -0.0089 1470 HIS 516 CE1 0.0038 0.0113 -0.0093 1471 HIS 516 NE2 0.0048 0.0116 -0.0092 1472 ASN 517 N -0.0084 0.0072 -0.0025 1473 ASN 517 CA -0.0101 0.0047 -0.0056 1474 ASN 517 C -0.0072 0.0007 -0.0067 1475 ASN 517 O -0.0085 -0.0014 -0.0093 1476 ASN 517 CB -0.0129 0.0071 -0.0056 1477 ASN 517 CG -0.0160 0.0108 -0.0049 1478 ASN 517 ND2 -0.0165 0.0141 -0.0027 1479 ASN 517 OD1 -0.0177 0.0108 -0.0060 1480 CYS 518 N -0.0035 -0.0006 -0.0052 1481 CYS 518 CA -0.0007 -0.0046 -0.0065 1482 CYS 518 C -0.0004 -0.0070 -0.0080 1483 CYS 518 O -0.0001 -0.0055 -0.0067 1484 CYS 518 CB 0.0034 -0.0046 -0.0036 1485 CYS 518 SG 0.0030 -0.0029 -0.0026 1486 ILE 519 N -0.0018 -0.0037 -0.0084 1487 ILE 519 CA -0.0010 -0.0050 -0.0077 1488 ILE 519 C 0.0005 -0.0060 -0.0065 1489 ILE 519 O 0.0003 -0.0074 -0.0065 1490 ILE 519 CB -0.0022 -0.0068 -0.0086 1491 ILE 519 CG1 -0.0039 -0.0060 -0.0100 1492 ILE 519 CG2 -0.0014 -0.0082 -0.0079 1493 ILE 519 CD1 -0.0038 -0.0050 -0.0099 1494 TYR 520 N 0.0020 -0.0054 -0.0054 1495 TYR 520 CA 0.0035 -0.0064 -0.0041 1496 TYR 520 C 0.0039 -0.0083 -0.0038 1497 TYR 520 O 0.0037 -0.0081 -0.0039 1498 TYR 520 CB 0.0050 -0.0048 -0.0030 1499 TYR 520 CG 0.0050 -0.0032 -0.0031 1500 TYR 520 CD1 0.0038 -0.0016 -0.0041 1501 TYR 520 CD2 0.0062 -0.0034 -0.0022 1502 TYR 520 CE1 0.0038 -0.0002 -0.0042 1503 TYR 520 CE2 0.0062 -0.0019 -0.0023 1504 TYR 520 CZ 0.0050 -0.0004 -0.0033 1505 TYR 520 OH 0.0050 0.0010 -0.0034 1506 ALA 521 N 0.0055 -0.0049 -0.0025 1507 ALA 521 CA 0.0050 -0.0040 -0.0025 1508 ALA 521 C 0.0040 -0.0043 -0.0017 1509 ALA 521 O 0.0041 -0.0052 -0.0015 1510 ALA 521 CB 0.0059 -0.0038 -0.0031 1511 ALA 522 N 0.0031 -0.0037 -0.0013 1512 ALA 522 CA 0.0020 -0.0039 -0.0005 1513 ALA 522 C 0.0016 -0.0029 -0.0004 1514 ALA 522 O 0.0015 -0.0018 -0.0007 1515 ALA 522 CB 0.0013 -0.0039 -0.0000 1516 GLY 523 N -0.0014 -0.0014 -0.0029 1517 GLY 523 CA -0.0010 -0.0017 -0.0039 1518 GLY 523 C -0.0014 -0.0021 -0.0029 1519 GLY 523 O -0.0019 -0.0013 -0.0016 1520 GLY 524 N -0.0012 -0.0034 -0.0034 1521 GLY 524 CA -0.0015 -0.0037 -0.0028 1522 GLY 524 C -0.0011 -0.0028 -0.0037 1523 GLY 524 O -0.0005 -0.0022 -0.0051 1524 TYR 525 N -0.0043 -0.0082 -0.0048 1525 TYR 525 CA -0.0055 -0.0054 -0.0052 1526 TYR 525 C -0.0068 -0.0022 -0.0018 1527 TYR 525 O -0.0064 -0.0032 0.0019 1528 TYR 525 CB -0.0046 -0.0075 -0.0047 1529 TYR 525 CG -0.0056 -0.0050 -0.0053 1530 TYR 525 CD1 -0.0060 -0.0040 -0.0094 1531 TYR 525 CD2 -0.0061 -0.0038 -0.0019 1532 TYR 525 CE1 -0.0069 -0.0018 -0.0102 1533 TYR 525 CE2 -0.0071 -0.0016 -0.0027 1534 TYR 525 CZ -0.0074 -0.0006 -0.0068 1535 TYR 525 OH -0.0083 0.0015 -0.0076 1536 ASP 526 N -0.0083 0.0015 -0.0031 1537 ASP 526 CA -0.0097 0.0048 -0.0004 1538 ASP 526 C -0.0103 0.0063 0.0019 1539 ASP 526 O -0.0112 0.0085 0.0050 1540 ASP 526 CB -0.0110 0.0079 -0.0028 1541 ASP 526 CG -0.0117 0.0098 -0.0063 1542 ASP 526 OD1 -0.0116 0.0095 -0.0064 1543 ASP 526 OD2 -0.0127 0.0123 -0.0085 1544 GLY 527 N -0.0128 0.0087 0.0018 1545 GLY 527 CA -0.0149 0.0098 0.0076 1546 GLY 527 C -0.0156 0.0123 0.0018 1547 GLY 527 O -0.0149 0.0105 0.0052 1548 GLN 528 N -0.0158 0.0153 -0.0070 1549 GLN 528 CA -0.0165 0.0184 -0.0137 1550 GLN 528 C -0.0116 0.0147 -0.0227 1551 GLN 528 O -0.0078 0.0104 -0.0246 1552 GLN 528 CB -0.0227 0.0271 -0.0159 1553 GLN 528 CG -0.0279 0.0313 -0.0073 1554 GLN 528 CD -0.0290 0.0306 -0.0006 1555 GLN 528 NE2 -0.0278 0.0300 -0.0036 1556 GLN 528 OE1 -0.0304 0.0299 0.0079 1557 ASP 529 N -0.0081 0.0156 -0.0104 1558 ASP 529 CA -0.0078 0.0136 -0.0136 1559 ASP 529 C -0.0069 0.0100 -0.0124 1560 ASP 529 O -0.0066 0.0096 -0.0090 1561 ASP 529 CB -0.0086 0.0163 -0.0157 1562 ASP 529 CG -0.0095 0.0194 -0.0178 1563 ASP 529 OD1 -0.0094 0.0183 -0.0205 1564 ASP 529 OD2 -0.0102 0.0227 -0.0165 1565 GLN 530 N -0.0065 0.0075 -0.0152 1566 GLN 530 CA -0.0058 0.0045 -0.0147 1567 GLN 530 C -0.0062 0.0061 -0.0152 1568 GLN 530 O -0.0068 0.0081 -0.0179 1569 GLN 530 CB -0.0052 0.0012 -0.0175 1570 GLN 530 CG -0.0044 -0.0017 -0.0158 1571 GLN 530 CD -0.0046 -0.0008 -0.0163 1572 GLN 530 NE2 -0.0040 -0.0028 -0.0144 1573 GLN 530 OE1 -0.0054 0.0017 -0.0183 1574 LEU 531 N -0.0016 0.0013 -0.0097 1575 LEU 531 CA -0.0015 0.0023 -0.0087 1576 LEU 531 C -0.0017 0.0025 -0.0084 1577 LEU 531 O -0.0025 0.0018 -0.0084 1578 LEU 531 CB -0.0024 0.0024 -0.0078 1579 LEU 531 CG -0.0022 0.0023 -0.0081 1580 LEU 531 CD1 -0.0033 0.0021 -0.0073 1581 LEU 531 CD2 -0.0012 0.0033 -0.0081 1582 ASN 532 N -0.0011 0.0035 -0.0079 1583 ASN 532 CA -0.0014 0.0039 -0.0072 1584 ASN 532 C -0.0019 0.0047 -0.0059 1585 ASN 532 O -0.0023 0.0050 -0.0052 1586 ASN 532 CB -0.0004 0.0044 -0.0075 1587 ASN 532 CG 0.0008 0.0053 -0.0077 1588 ASN 532 ND2 0.0008 0.0060 -0.0070 1589 ASN 532 OD1 0.0016 0.0052 -0.0086 1590 SER 533 N 0.0029 0.0004 -0.0030 1591 SER 533 CA 0.0041 -0.0007 -0.0033 1592 SER 533 C 0.0046 -0.0002 -0.0038 1593 SER 533 O 0.0045 0.0011 -0.0042 1594 SER 533 CB 0.0052 -0.0009 -0.0039 1595 SER 533 OG 0.0058 0.0004 -0.0047 1596 VAL 534 N 0.0053 -0.0013 -0.0038 1597 VAL 534 CA 0.0059 -0.0011 -0.0042 1598 VAL 534 C 0.0073 -0.0021 -0.0046 1599 VAL 534 O 0.0074 -0.0034 -0.0042 1600 VAL 534 CB 0.0050 -0.0015 -0.0036 1601 VAL 534 CG1 0.0056 -0.0012 -0.0040 1602 VAL 534 CG2 0.0035 -0.0007 -0.0030 1603 GLU 535 N 0.0093 -0.0058 -0.0051 1604 GLU 535 CA 0.0093 -0.0059 -0.0053 1605 GLU 535 C 0.0093 -0.0057 -0.0055 1606 GLU 535 O 0.0094 -0.0055 -0.0054 1607 GLU 535 CB 0.0092 -0.0061 -0.0054 1608 GLU 535 CG 0.0092 -0.0060 -0.0053 1609 GLU 535 CD 0.0092 -0.0062 -0.0053 1610 GLU 535 OE1 0.0091 -0.0063 -0.0055 1611 GLU 535 OE2 0.0092 -0.0063 -0.0052 1612 ARG 536 N 0.0093 -0.0057 -0.0057 1613 ARG 536 CA 0.0093 -0.0055 -0.0059 1614 ARG 536 C 0.0093 -0.0056 -0.0061 1615 ARG 536 O 0.0092 -0.0058 -0.0061 1616 ARG 536 CB 0.0094 -0.0054 -0.0059 1617 ARG 536 CG 0.0093 -0.0055 -0.0060 1618 ARG 536 CD 0.0094 -0.0054 -0.0060 1619 ARG 536 NE 0.0093 -0.0055 -0.0060 1620 ARG 536 CZ 0.0093 -0.0055 -0.0060 1621 ARG 536 NH1 0.0094 -0.0053 -0.0058 1622 ARG 536 NH2 0.0093 -0.0056 -0.0060 1623 TYR 537 N 0.0057 -0.0068 -0.0090 1624 TYR 537 CA 0.0048 -0.0062 -0.0069 1625 TYR 537 C 0.0028 -0.0057 -0.0037 1626 TYR 537 O 0.0007 -0.0073 -0.0035 1627 TYR 537 CB 0.0031 -0.0083 -0.0083 1628 TYR 537 CG 0.0024 -0.0079 -0.0066 1629 TYR 537 CD1 0.0047 -0.0062 -0.0067 1630 TYR 537 CD2 -0.0005 -0.0093 -0.0053 1631 TYR 537 CE1 0.0040 -0.0060 -0.0055 1632 TYR 537 CE2 -0.0012 -0.0091 -0.0040 1633 TYR 537 CZ 0.0011 -0.0073 -0.0041 1634 TYR 537 OH 0.0007 -0.0069 -0.0029 1635 ASP 538 N 0.0035 -0.0038 -0.0012 1636 ASP 538 CA 0.0016 -0.0033 0.0020 1637 ASP 538 C 0.0004 -0.0036 0.0030 1638 ASP 538 O 0.0021 -0.0025 0.0027 1639 ASP 538 CB 0.0032 -0.0008 0.0041 1640 ASP 538 CG 0.0014 -0.0001 0.0075 1641 ASP 538 OD1 0.0027 0.0018 0.0092 1642 ASP 538 OD2 -0.0009 -0.0013 0.0085 1643 VAL 539 N -0.0062 -0.0054 0.0024 1644 VAL 539 CA -0.0059 -0.0054 -0.0006 1645 VAL 539 C 0.0023 -0.0041 0.0115 1646 VAL 539 O 0.0073 -0.0035 0.0080 1647 VAL 539 CB -0.0217 -0.0076 -0.0026 1648 VAL 539 CG1 -0.0298 -0.0088 -0.0161 1649 VAL 539 CG2 -0.0316 -0.0088 0.0113 1650 GLU 540 N 0.0038 -0.0038 0.0253 1651 GLU 540 CA 0.0116 -0.0026 0.0375 1652 GLU 540 C 0.0286 -0.0003 0.0359 1653 GLU 540 O 0.0366 0.0009 0.0398 1654 GLU 540 CB 0.0066 -0.0032 0.0529 1655 GLU 540 CG -0.0098 -0.0055 0.0562 1656 GLU 540 CD -0.0147 -0.0060 0.0726 1657 GLU 540 OE1 -0.0058 -0.0047 0.0828 1658 GLU 540 OE2 -0.0283 -0.0079 0.0748 1659 THR 541 N 0.0039 0.0061 0.0309 1660 THR 541 CA 0.0085 0.0165 0.0282 1661 THR 541 C 0.0098 0.0170 0.0240 1662 THR 541 O 0.0136 0.0252 0.0209 1663 THR 541 CB 0.0122 0.0207 0.0199 1664 THR 541 CG2 0.0112 0.0201 0.0228 1665 THR 541 OG1 0.0125 0.0152 0.0097 1666 GLU 542 N 0.0067 0.0081 0.0223 1667 GLU 542 CA 0.0075 0.0068 0.0173 1668 GLU 542 C 0.0119 0.0113 0.0062 1669 GLU 542 O 0.0137 0.0138 0.0027 1670 GLU 542 CB 0.0068 0.0102 0.0254 1671 GLU 542 CG 0.0020 0.0041 0.0355 1672 GLU 542 CD 0.0010 0.0063 0.0431 1673 GLU 542 OE1 0.0042 0.0149 0.0434 1674 GLU 542 OE2 -0.0031 -0.0009 0.0484 1675 THR 543 N 0.0088 0.0020 0.0057 1676 THR 543 CA 0.0107 0.0032 0.0035 1677 THR 543 C 0.0105 0.0017 0.0011 1678 THR 543 O 0.0094 0.0007 0.0016 1679 THR 543 CB 0.0120 0.0055 0.0049 1680 THR 543 CG2 0.0140 0.0069 0.0028 1681 THR 543 OG1 0.0125 0.0071 0.0068 1682 TRP 544 N 0.0116 0.0018 -0.0015 1683 TRP 544 CA 0.0118 0.0009 -0.0039 1684 TRP 544 C 0.0135 0.0027 -0.0044 1685 TRP 544 O 0.0152 0.0045 -0.0051 1686 TRP 544 CB 0.0121 -0.0000 -0.0065 1687 TRP 544 CG 0.0104 -0.0022 -0.0065 1688 TRP 544 CD1 0.0100 -0.0022 -0.0056 1689 TRP 544 CD2 0.0088 -0.0046 -0.0075 1690 TRP 544 CE2 0.0075 -0.0060 -0.0071 1691 TRP 544 CE3 0.0084 -0.0058 -0.0087 1692 TRP 544 NE1 0.0083 -0.0045 -0.0059 1693 TRP 544 CZ2 0.0059 -0.0085 -0.0079 1694 TRP 544 CZ3 0.0067 -0.0082 -0.0095 1695 TRP 544 CH2 0.0055 -0.0096 -0.0091 1696 THR 545 N 0.0123 -0.0035 -0.0053 1697 THR 545 CA 0.0122 -0.0036 -0.0053 1698 THR 545 C 0.0122 -0.0035 -0.0050 1699 THR 545 O 0.0125 -0.0033 -0.0050 1700 THR 545 CB 0.0122 -0.0036 -0.0057 1701 THR 545 CG2 0.0120 -0.0038 -0.0057 1702 THR 545 OG1 0.0121 -0.0037 -0.0059 1703 PHE 546 N 0.0120 -0.0036 -0.0048 1704 PHE 546 CA 0.0120 -0.0035 -0.0046 1705 PHE 546 C 0.0122 -0.0035 -0.0049 1706 PHE 546 O 0.0120 -0.0037 -0.0051 1707 PHE 546 CB 0.0118 -0.0037 -0.0044 1708 PHE 546 CG 0.0117 -0.0037 -0.0041 1709 PHE 546 CD1 0.0118 -0.0035 -0.0038 1710 PHE 546 CD2 0.0114 -0.0038 -0.0041 1711 PHE 546 CE1 0.0118 -0.0035 -0.0035 1712 PHE 546 CE2 0.0114 -0.0038 -0.0039 1713 PHE 546 CZ 0.0115 -0.0037 -0.0036 1714 VAL 547 N 0.0127 -0.0068 -0.0052 1715 VAL 547 CA 0.0113 -0.0075 -0.0034 1716 VAL 547 C 0.0093 -0.0072 -0.0016 1717 VAL 547 O 0.0092 -0.0065 -0.0018 1718 VAL 547 CB 0.0109 -0.0058 -0.0038 1719 VAL 547 CG1 0.0128 -0.0062 -0.0056 1720 VAL 547 CG2 0.0099 -0.0029 -0.0042 1721 ALA 548 N 0.0077 -0.0075 0.0002 1722 ALA 548 CA 0.0058 -0.0071 0.0020 1723 ALA 548 C 0.0050 -0.0045 0.0014 1724 ALA 548 O 0.0050 -0.0025 0.0005 1725 ALA 548 CB 0.0042 -0.0074 0.0037 1726 PRO 549 N 0.0033 -0.0001 0.0021 1727 PRO 549 CA 0.0026 0.0011 0.0013 1728 PRO 549 C 0.0009 0.0018 0.0020 1729 PRO 549 O 0.0003 0.0013 0.0034 1730 PRO 549 CB 0.0032 0.0007 0.0011 1731 PRO 549 CG 0.0035 -0.0006 0.0026 1732 PRO 549 CD 0.0040 -0.0011 0.0028 1733 MET 550 N 0.0002 0.0030 0.0011 1734 MET 550 CA -0.0014 0.0038 0.0016 1735 MET 550 C -0.0016 0.0034 0.0023 1736 MET 550 O -0.0006 0.0028 0.0021 1737 MET 550 CB -0.0019 0.0051 0.0002 1738 MET 550 CG -0.0017 0.0056 -0.0007 1739 MET 550 SD -0.0023 0.0072 -0.0023 1740 MET 550 CE -0.0010 0.0070 -0.0035 1741 LYS 551 N -0.0045 0.0082 0.0014 1742 LYS 551 CA -0.0054 0.0090 -0.0002 1743 LYS 551 C -0.0057 0.0109 -0.0031 1744 LYS 551 O -0.0047 0.0124 -0.0044 1745 LYS 551 CB -0.0082 0.0073 0.0001 1746 LYS 551 CG -0.0078 0.0057 0.0025 1747 LYS 551 CD -0.0065 0.0045 0.0051 1748 LYS 551 CE -0.0063 0.0029 0.0073 1749 LYS 551 NZ -0.0046 0.0020 0.0098 1750 HIS 552 N -0.0068 0.0110 -0.0039 1751 HIS 552 CA -0.0073 0.0127 -0.0066 1752 HIS 552 C -0.0053 0.0139 -0.0068 1753 HIS 552 O -0.0055 0.0131 -0.0059 1754 HIS 552 CB -0.0104 0.0120 -0.0077 1755 HIS 552 CG -0.0124 0.0108 -0.0075 1756 HIS 552 CD2 -0.0141 0.0087 -0.0058 1757 HIS 552 ND1 -0.0126 0.0116 -0.0088 1758 HIS 552 CE1 -0.0145 0.0100 -0.0080 1759 HIS 552 NE2 -0.0154 0.0083 -0.0062 1760 ARG 553 N -0.0028 0.0100 -0.0074 1761 ARG 553 CA -0.0035 0.0094 -0.0073 1762 ARG 553 C -0.0047 0.0075 -0.0081 1763 ARG 553 O -0.0044 0.0066 -0.0095 1764 ARG 553 CB -0.0021 0.0101 -0.0082 1765 ARG 553 CG -0.0013 0.0092 -0.0102 1766 ARG 553 CD 0.0002 0.0099 -0.0112 1767 ARG 553 NE 0.0009 0.0088 -0.0131 1768 ARG 553 CZ 0.0017 0.0087 -0.0143 1769 ARG 553 NH1 0.0022 0.0097 -0.0138 1770 ARG 553 NH2 0.0018 0.0074 -0.0159 1771 ARG 554 N -0.0061 0.0068 -0.0072 1772 ARG 554 CA -0.0074 0.0050 -0.0078 1773 ARG 554 C -0.0085 0.0045 -0.0071 1774 ARG 554 O -0.0091 0.0053 -0.0055 1775 ARG 554 CB -0.0084 0.0045 -0.0072 1776 ARG 554 CG -0.0091 0.0055 -0.0052 1777 ARG 554 CD -0.0099 0.0050 -0.0047 1778 ARG 554 NE -0.0087 0.0059 -0.0052 1779 ARG 554 CZ -0.0090 0.0053 -0.0056 1780 ARG 554 NH1 -0.0101 0.0037 -0.0060 1781 ARG 554 NH2 -0.0081 0.0063 -0.0055 1782 SER 555 N -0.0046 -0.0039 -0.0037 1783 SER 555 CA -0.0054 -0.0045 -0.0032 1784 SER 555 C -0.0052 -0.0054 -0.0032 1785 SER 555 O -0.0045 -0.0056 -0.0036 1786 SER 555 CB -0.0057 -0.0048 -0.0030 1787 SER 555 OG -0.0051 -0.0056 -0.0032 1788 ALA 556 N -0.0059 -0.0058 -0.0028 1789 ALA 556 CA -0.0058 -0.0065 -0.0027 1790 ALA 556 C -0.0054 -0.0061 -0.0030 1791 ALA 556 O -0.0050 -0.0067 -0.0033 1792 ALA 556 CB -0.0055 -0.0075 -0.0029 1793 LEU 557 N -0.0026 0.0001 0.0030 1794 LEU 557 CA -0.0028 0.0006 0.0034 1795 LEU 557 C -0.0033 0.0009 0.0031 1796 LEU 557 O -0.0034 0.0008 0.0026 1797 LEU 557 CB -0.0025 0.0005 0.0037 1798 LEU 557 CG -0.0026 0.0003 0.0034 1799 LEU 557 CD1 -0.0025 0.0006 0.0038 1800 LEU 557 CD2 -0.0022 -0.0002 0.0032 1801 GLY 558 N -0.0035 0.0014 0.0034 1802 GLY 558 CA -0.0039 0.0018 0.0033 1803 GLY 558 C -0.0038 0.0019 0.0035 1804 GLY 558 O -0.0034 0.0018 0.0040 1805 ILE 559 N 0.0027 0.0013 0.0089 1806 ILE 559 CA 0.0027 0.0014 0.0088 1807 ILE 559 C 0.0029 0.0008 0.0091 1808 ILE 559 O 0.0031 0.0005 0.0096 1809 ILE 559 CB 0.0024 0.0020 0.0092 1810 ILE 559 CG1 0.0023 0.0022 0.0089 1811 ILE 559 CG2 0.0025 0.0020 0.0100 1812 ILE 559 CD1 0.0021 0.0029 0.0091 1813 THR 560 N 0.0030 0.0007 0.0087 1814 THR 560 CA 0.0032 0.0002 0.0089 1815 THR 560 C 0.0031 0.0003 0.0087 1816 THR 560 O 0.0029 0.0007 0.0082 1817 THR 560 CB 0.0034 -0.0005 0.0088 1818 THR 560 CG2 0.0034 -0.0007 0.0080 1819 THR 560 OG1 0.0036 -0.0009 0.0091 1820 VAL 561 N 0.0059 0.0017 0.0064 1821 VAL 561 CA 0.0059 0.0014 0.0058 1822 VAL 561 C 0.0063 -0.0003 0.0051 1823 VAL 561 O 0.0069 -0.0015 0.0059 1824 VAL 561 CB 0.0060 0.0018 0.0072 1825 VAL 561 CG1 0.0060 0.0014 0.0067 1826 VAL 561 CG2 0.0055 0.0036 0.0077 1827 HIS 562 N 0.0060 -0.0005 0.0036 1828 HIS 562 CA 0.0063 -0.0020 0.0028 1829 HIS 562 C 0.0061 -0.0019 0.0021 1830 HIS 562 O 0.0056 -0.0008 0.0013 1831 HIS 562 CB 0.0062 -0.0026 0.0014 1832 HIS 562 CG 0.0066 -0.0042 0.0005 1833 HIS 562 CD2 0.0070 -0.0055 0.0005 1834 HIS 562 ND1 0.0064 -0.0044 -0.0006 1835 HIS 562 CE1 0.0068 -0.0060 -0.0013 1836 HIS 562 NE2 0.0072 -0.0066 -0.0006 1837 GLN 563 N 0.0097 -0.0016 -0.0036 1838 GLN 563 CA 0.0096 -0.0002 -0.0038 1839 GLN 563 C 0.0091 0.0028 -0.0035 1840 GLN 563 O 0.0094 0.0044 -0.0049 1841 GLN 563 CB 0.0105 -0.0010 -0.0063 1842 GLN 563 CG 0.0108 -0.0038 -0.0060 1843 GLN 563 CD 0.0117 -0.0049 -0.0084 1844 GLN 563 NE2 0.0122 -0.0074 -0.0087 1845 GLN 563 OE1 0.0121 -0.0035 -0.0101 1846 GLY 564 N 0.0083 0.0037 -0.0016 1847 GLY 564 CA 0.0078 0.0065 -0.0010 1848 GLY 564 C 0.0081 0.0081 -0.0028 1849 GLY 564 O 0.0077 0.0105 -0.0026 1850 ARG 565 N 0.0070 0.0095 -0.0011 1851 ARG 565 CA 0.0071 0.0086 -0.0003 1852 ARG 565 C 0.0071 0.0069 0.0013 1853 ARG 565 O 0.0080 0.0064 0.0018 1854 ARG 565 CB 0.0089 0.0092 -0.0008 1855 ARG 565 CG 0.0088 0.0109 -0.0023 1856 ARG 565 CD 0.0106 0.0114 -0.0027 1857 ARG 565 NE 0.0106 0.0130 -0.0042 1858 ARG 565 CZ 0.0121 0.0140 -0.0051 1859 ARG 565 NH1 0.0140 0.0136 -0.0046 1860 ARG 565 NH2 0.0117 0.0154 -0.0063 1861 ILE 566 N 0.0060 0.0061 0.0020 1862 ILE 566 CA 0.0061 0.0044 0.0036 1863 ILE 566 C 0.0081 0.0040 0.0040 1864 ILE 566 O 0.0087 0.0046 0.0034 1865 ILE 566 CB 0.0042 0.0037 0.0041 1866 ILE 566 CG1 0.0023 0.0038 0.0040 1867 ILE 566 CG2 0.0044 0.0020 0.0057 1868 ILE 566 CD1 0.0002 0.0036 0.0041 1869 TYR 567 N 0.0038 0.0027 0.0061 1870 TYR 567 CA 0.0030 0.0031 0.0057 1871 TYR 567 C 0.0030 0.0044 0.0064 1872 TYR 567 O 0.0038 0.0046 0.0071 1873 TYR 567 CB 0.0033 0.0022 0.0054 1874 TYR 567 CG 0.0032 0.0010 0.0047 1875 TYR 567 CD1 0.0040 0.0002 0.0048 1876 TYR 567 CD2 0.0023 0.0006 0.0038 1877 TYR 567 CE1 0.0040 -0.0010 0.0042 1878 TYR 567 CE2 0.0023 -0.0006 0.0032 1879 TYR 567 CZ 0.0031 -0.0014 0.0033 1880 TYR 567 OH 0.0031 -0.0025 0.0027 1881 VAL 568 N 0.0020 0.0051 0.0061 1882 VAL 568 CA 0.0017 0.0063 0.0066 1883 VAL 568 C 0.0011 0.0064 0.0061 1884 VAL 568 O 0.0004 0.0059 0.0053 1885 VAL 568 CB 0.0011 0.0073 0.0066 1886 VAL 568 CG1 0.0018 0.0074 0.0072 1887 VAL 568 CG2 -0.0000 0.0072 0.0058 1888 LEU 569 N -0.0048 0.0044 0.0025 1889 LEU 569 CA -0.0049 0.0036 0.0013 1890 LEU 569 C -0.0052 0.0047 0.0013 1891 LEU 569 O -0.0049 0.0051 0.0026 1892 LEU 569 CB -0.0044 0.0018 0.0019 1893 LEU 569 CG -0.0041 0.0004 0.0017 1894 LEU 569 CD1 -0.0038 0.0005 0.0032 1895 LEU 569 CD2 -0.0038 -0.0013 0.0016 1896 GLY 570 N -0.0056 0.0051 -0.0003 1897 GLY 570 CA -0.0059 0.0059 -0.0006 1898 GLY 570 C -0.0060 0.0076 0.0004 1899 GLY 570 O -0.0062 0.0086 0.0007 1900 GLY 571 N -0.0104 0.0012 -0.0046 1901 GLY 571 CA -0.0105 -0.0000 -0.0052 1902 GLY 571 C -0.0088 -0.0013 -0.0055 1903 GLY 571 O -0.0079 -0.0016 -0.0055 1904 TYR 572 N -0.0085 -0.0022 -0.0059 1905 TYR 572 CA -0.0070 -0.0034 -0.0062 1906 TYR 572 C -0.0063 -0.0031 -0.0060 1907 TYR 572 O -0.0074 -0.0025 -0.0059 1908 TYR 572 CB -0.0078 -0.0052 -0.0071 1909 TYR 572 CG -0.0065 -0.0067 -0.0076 1910 TYR 572 CD1 -0.0051 -0.0071 -0.0076 1911 TYR 572 CD2 -0.0066 -0.0078 -0.0081 1912 TYR 572 CE1 -0.0038 -0.0086 -0.0081 1913 TYR 572 CE2 -0.0054 -0.0092 -0.0085 1914 TYR 572 CZ -0.0039 -0.0096 -0.0085 1915 TYR 572 OH -0.0028 -0.0110 -0.0090 1916 ASP 573 N -0.0064 0.0005 -0.0124 1917 ASP 573 CA -0.0044 0.0029 -0.0120 1918 ASP 573 C -0.0028 0.0037 -0.0141 1919 ASP 573 O -0.0009 0.0055 -0.0145 1920 ASP 573 CB -0.0036 0.0039 -0.0117 1921 ASP 573 CG -0.0029 0.0034 -0.0144 1922 ASP 573 OD1 -0.0033 0.0019 -0.0164 1923 ASP 573 OD2 -0.0014 0.0049 -0.0148 1924 GLY 574 N -0.0034 0.0022 -0.0157 1925 GLY 574 CA -0.0021 0.0025 -0.0181 1926 GLY 574 C -0.0016 0.0017 -0.0208 1927 GLY 574 O -0.0015 0.0008 -0.0228 1928 HIS 575 N -0.0040 0.0097 -0.0221 1929 HIS 575 CA -0.0061 0.0092 -0.0267 1930 HIS 575 C -0.0106 0.0049 -0.0270 1931 HIS 575 O -0.0130 0.0040 -0.0314 1932 HIS 575 CB -0.0042 0.0110 -0.0264 1933 HIS 575 CG 0.0002 0.0154 -0.0266 1934 HIS 575 CD2 0.0033 0.0170 -0.0223 1935 HIS 575 ND1 0.0016 0.0184 -0.0312 1936 HIS 575 CE1 0.0056 0.0218 -0.0295 1937 HIS 575 NE2 0.0067 0.0211 -0.0242 1938 THR 576 N -0.0118 0.0021 -0.0225 1939 THR 576 CA -0.0159 -0.0021 -0.0219 1940 THR 576 C -0.0172 -0.0047 -0.0180 1941 THR 576 O -0.0147 -0.0034 -0.0148 1942 THR 576 CB -0.0163 -0.0031 -0.0203 1943 THR 576 CG2 -0.0151 -0.0006 -0.0240 1944 THR 576 OG1 -0.0142 -0.0028 -0.0151 1945 PHE 577 N -0.0118 -0.0016 -0.0062 1946 PHE 577 CA -0.0121 -0.0020 -0.0056 1947 PHE 577 C -0.0113 -0.0006 -0.0073 1948 PHE 577 O -0.0095 -0.0007 -0.0086 1949 PHE 577 CB -0.0109 -0.0043 -0.0048 1950 PHE 577 CG -0.0117 -0.0058 -0.0030 1951 PHE 577 CD1 -0.0111 -0.0064 -0.0030 1952 PHE 577 CD2 -0.0131 -0.0065 -0.0014 1953 PHE 577 CE1 -0.0120 -0.0077 -0.0013 1954 PHE 577 CE2 -0.0139 -0.0078 0.0003 1955 PHE 577 CZ -0.0134 -0.0084 0.0003 1956 LEU 578 N -0.0127 0.0008 -0.0073 1957 LEU 578 CA -0.0122 0.0024 -0.0089 1958 LEU 578 C -0.0108 0.0015 -0.0093 1959 LEU 578 O -0.0112 0.0002 -0.0081 1960 LEU 578 CB -0.0143 0.0042 -0.0087 1961 LEU 578 CG -0.0155 0.0056 -0.0088 1962 LEU 578 CD1 -0.0167 0.0047 -0.0071 1963 LEU 578 CD2 -0.0171 0.0076 -0.0091 1964 ASP 579 N -0.0127 0.0127 -0.0079 1965 ASP 579 CA -0.0122 0.0098 -0.0082 1966 ASP 579 C -0.0120 0.0095 -0.0076 1967 ASP 579 O -0.0114 0.0074 -0.0069 1968 ASP 579 CB -0.0129 0.0086 -0.0109 1969 ASP 579 CG -0.0139 0.0101 -0.0132 1970 ASP 579 OD1 -0.0141 0.0122 -0.0127 1971 ASP 579 OD2 -0.0144 0.0092 -0.0155 1972 SER 580 N -0.0125 0.0117 -0.0078 1973 SER 580 CA -0.0124 0.0119 -0.0074 1974 SER 580 C -0.0114 0.0106 -0.0050 1975 SER 580 O -0.0109 0.0115 -0.0028 1976 SER 580 CB -0.0129 0.0149 -0.0074 1977 SER 580 OG -0.0129 0.0150 -0.0071 1978 VAL 581 N -0.0082 0.0094 -0.0007 1979 VAL 581 CA -0.0067 0.0083 0.0004 1980 VAL 581 C -0.0069 0.0078 0.0001 1981 VAL 581 O -0.0077 0.0066 -0.0010 1982 VAL 581 CB -0.0061 0.0063 0.0004 1983 VAL 581 CG1 -0.0046 0.0052 0.0015 1984 VAL 581 CG2 -0.0060 0.0067 0.0006 1985 GLU 582 N -0.0061 0.0088 0.0011 1986 GLU 582 CA -0.0061 0.0084 0.0010 1987 GLU 582 C -0.0045 0.0070 0.0020 1988 GLU 582 O -0.0033 0.0073 0.0033 1989 GLU 582 CB -0.0064 0.0103 0.0012 1990 GLU 582 CG -0.0079 0.0116 0.0002 1991 GLU 582 CD -0.0082 0.0135 0.0005 1992 GLU 582 OE1 -0.0081 0.0132 0.0005 1993 GLU 582 OE2 -0.0085 0.0152 0.0007 1994 CYS 583 N 0.0005 0.0079 0.0075 1995 CYS 583 CA 0.0017 0.0074 0.0060 1996 CYS 583 C 0.0019 0.0052 0.0053 1997 CYS 583 O 0.0008 0.0039 0.0061 1998 CYS 583 CB 0.0015 0.0075 0.0063 1999 CYS 583 SG 0.0029 0.0068 0.0046 2000 TYR 584 N 0.0031 0.0050 0.0039 2001 TYR 584 CA 0.0035 0.0030 0.0029 2002 TYR 584 C 0.0043 0.0024 0.0019 2003 TYR 584 O 0.0054 0.0034 0.0009 2004 TYR 584 CB 0.0044 0.0031 0.0019 2005 TYR 584 CG 0.0049 0.0011 0.0009 2006 TYR 584 CD1 0.0039 -0.0005 0.0015 2007 TYR 584 CD2 0.0063 0.0010 -0.0007 2008 TYR 584 CE1 0.0044 -0.0022 0.0005 2009 TYR 584 CE2 0.0068 -0.0007 -0.0017 2010 TYR 584 CZ 0.0058 -0.0024 -0.0011 2011 TYR 584 OH 0.0063 -0.0040 -0.0020 2012 ASP 585 N 0.0075 0.0056 0.0049 2013 ASP 585 CA 0.0075 0.0073 0.0014 2014 ASP 585 C 0.0053 0.0045 -0.0019 2015 ASP 585 O 0.0041 0.0017 -0.0012 2016 ASP 585 CB 0.0086 0.0087 0.0029 2017 ASP 585 CG 0.0090 0.0111 -0.0004 2018 ASP 585 OD1 0.0084 0.0117 -0.0039 2019 ASP 585 OD2 0.0103 0.0131 0.0008 2020 PRO 586 N 0.0047 0.0050 -0.0054 2021 PRO 586 CA 0.0026 0.0024 -0.0086 2022 PRO 586 C 0.0019 0.0021 -0.0106 2023 PRO 586 O 0.0001 -0.0010 -0.0118 2024 PRO 586 CB 0.0026 0.0041 -0.0118 2025 PRO 586 CG 0.0048 0.0083 -0.0115 2026 PRO 586 CD 0.0060 0.0084 -0.0068 2027 ASP 587 N 0.0012 0.0068 -0.0222 2028 ASP 587 CA 0.0008 0.0076 -0.0242 2029 ASP 587 C 0.0015 0.0009 -0.0168 2030 ASP 587 O 0.0004 -0.0011 -0.0187 2031 ASP 587 CB 0.0033 0.0188 -0.0241 2032 ASP 587 CG 0.0027 0.0263 -0.0319 2033 ASP 587 OD1 0.0003 0.0233 -0.0375 2034 ASP 587 OD2 0.0044 0.0351 -0.0325 2035 THR 588 N 0.0031 -0.0030 -0.0085 2036 THR 588 CA 0.0036 -0.0103 -0.0012 2037 THR 588 C 0.0017 -0.0206 0.0000 2038 THR 588 O 0.0018 -0.0274 0.0053 2039 THR 588 CB 0.0077 -0.0059 0.0091 2040 THR 588 CG2 0.0099 0.0041 0.0091 2041 THR 588 OG1 0.0094 -0.0039 0.0135 2042 ASP 589 N 0.0057 -0.0125 -0.0005 2043 ASP 589 CA 0.0057 -0.0140 -0.0004 2044 ASP 589 C 0.0042 -0.0135 0.0048 2045 ASP 589 O 0.0038 -0.0170 0.0067 2046 ASP 589 CB 0.0067 -0.0191 -0.0029 2047 ASP 589 CG 0.0069 -0.0203 -0.0037 2048 ASP 589 OD1 0.0070 -0.0166 -0.0045 2049 ASP 589 OD2 0.0074 -0.0247 -0.0048 2050 THR 590 N 0.0034 -0.0092 0.0073 2051 THR 590 CA 0.0019 -0.0083 0.0121 2052 THR 590 C 0.0016 -0.0031 0.0125 2053 THR 590 O 0.0020 0.0008 0.0109 2054 THR 590 CB 0.0007 -0.0092 0.0165 2055 THR 590 CG2 0.0008 -0.0145 0.0167 2056 THR 590 OG1 0.0004 -0.0055 0.0169 2057 TRP 591 N -0.0014 0.0018 0.0066 2058 TRP 591 CA -0.0025 0.0030 0.0063 2059 TRP 591 C -0.0041 0.0028 0.0070 2060 TRP 591 O -0.0044 0.0021 0.0075 2061 TRP 591 CB -0.0022 0.0042 0.0055 2062 TRP 591 CG -0.0007 0.0047 0.0046 2063 TRP 591 CD1 0.0006 0.0042 0.0044 2064 TRP 591 CD2 -0.0005 0.0058 0.0039 2065 TRP 591 CE2 0.0011 0.0059 0.0033 2066 TRP 591 CE3 -0.0013 0.0068 0.0037 2067 TRP 591 NE1 0.0017 0.0049 0.0036 2068 TRP 591 CZ2 0.0017 0.0069 0.0025 2069 TRP 591 CZ3 -0.0007 0.0077 0.0029 2070 TRP 591 CH2 0.0008 0.0078 0.0023 2071 SER 592 N -0.0051 0.0036 0.0070 2072 SER 592 CA -0.0068 0.0037 0.0075 2073 SER 592 C -0.0076 0.0052 0.0069 2074 SER 592 O -0.0071 0.0059 0.0064 2075 SER 592 CB -0.0075 0.0026 0.0084 2076 SER 592 OG -0.0075 0.0029 0.0082 2077 GLU 593 N -0.0115 0.0114 -0.0025 2078 GLU 593 CA -0.0119 0.0102 -0.0033 2079 GLU 593 C -0.0122 0.0063 -0.0044 2080 GLU 593 O -0.0134 0.0054 -0.0067 2081 GLU 593 CB -0.0134 0.0125 -0.0058 2082 GLU 593 CG -0.0136 0.0116 -0.0062 2083 GLU 593 CD -0.0150 0.0143 -0.0083 2084 GLU 593 OE1 -0.0165 0.0139 -0.0111 2085 GLU 593 OE2 -0.0145 0.0160 -0.0072 2086 VAL 594 N -0.0110 0.0040 -0.0025 2087 VAL 594 CA -0.0109 0.0002 -0.0029 2088 VAL 594 C -0.0117 -0.0015 -0.0045 2089 VAL 594 O -0.0124 -0.0042 -0.0060 2090 VAL 594 CB -0.0091 -0.0017 0.0001 2091 VAL 594 CG1 -0.0084 -0.0007 0.0015 2092 VAL 594 CG2 -0.0078 -0.0008 0.0026 2093 THR 595 N -0.0082 -0.0013 -0.0101 2094 THR 595 CA -0.0090 -0.0022 -0.0114 2095 THR 595 C -0.0099 0.0031 -0.0104 2096 THR 595 O -0.0096 0.0072 -0.0083 2097 THR 595 CB -0.0059 -0.0066 -0.0093 2098 THR 595 CG2 -0.0025 -0.0049 -0.0044 2099 THR 595 OG1 -0.0070 -0.0083 -0.0114 2100 ARG 596 N -0.0108 0.0029 -0.0115 2101 ARG 596 CA -0.0109 0.0071 -0.0099 2102 ARG 596 C -0.0087 0.0046 -0.0082 2103 ARG 596 O -0.0085 0.0001 -0.0099 2104 ARG 596 CB -0.0148 0.0102 -0.0136 2105 ARG 596 CG -0.0167 0.0134 -0.0146 2106 ARG 596 CD -0.0207 0.0165 -0.0183 2107 ARG 596 NE -0.0224 0.0191 -0.0194 2108 ARG 596 CZ -0.0259 0.0205 -0.0232 2109 ARG 596 NH1 -0.0283 0.0203 -0.0262 2110 ARG 596 NH2 -0.0271 0.0221 -0.0240 2111 MET 597 N -0.0065 0.0031 -0.0097 2112 MET 597 CA -0.0054 0.0012 -0.0085 2113 MET 597 C -0.0054 0.0006 -0.0105 2114 MET 597 O -0.0064 0.0021 -0.0120 2115 MET 597 CB -0.0054 0.0023 -0.0057 2116 MET 597 CG -0.0052 0.0027 -0.0035 2117 MET 597 SD -0.0051 0.0037 -0.0000 2118 MET 597 CE -0.0067 0.0068 -0.0006 2119 THR 598 N -0.0043 -0.0016 -0.0102 2120 THR 598 CA -0.0041 -0.0025 -0.0119 2121 THR 598 C -0.0049 -0.0007 -0.0114 2122 THR 598 O -0.0051 -0.0010 -0.0131 2123 THR 598 CB -0.0027 -0.0051 -0.0111 2124 THR 598 CG2 -0.0018 -0.0071 -0.0118 2125 THR 598 OG1 -0.0022 -0.0050 -0.0083 2126 SER 599 N -0.0055 0.0026 -0.0094 2127 SER 599 CA -0.0069 0.0027 -0.0076 2128 SER 599 C -0.0084 0.0027 -0.0074 2129 SER 599 O -0.0077 0.0026 -0.0078 2130 SER 599 CB -0.0057 0.0031 -0.0055 2131 SER 599 OG -0.0043 0.0033 -0.0052 2132 GLY 600 N -0.0103 0.0026 -0.0067 2133 GLY 600 CA -0.0119 0.0026 -0.0064 2134 GLY 600 C -0.0113 0.0028 -0.0047 2135 GLY 600 O -0.0107 0.0031 -0.0030 2136 ARG 601 N -0.0078 0.0005 -0.0010 2137 ARG 601 CA -0.0069 0.0011 -0.0004 2138 ARG 601 C -0.0074 0.0006 -0.0012 2139 ARG 601 O -0.0076 -0.0001 -0.0028 2140 ARG 601 CB -0.0049 0.0018 -0.0006 2141 ARG 601 CG -0.0041 0.0013 -0.0025 2142 ARG 601 CD -0.0022 0.0020 -0.0028 2143 ARG 601 NE -0.0020 0.0021 -0.0027 2144 ARG 601 CZ -0.0008 0.0022 -0.0035 2145 ARG 601 NH1 0.0006 0.0024 -0.0044 2146 ARG 601 NH2 -0.0008 0.0023 -0.0033 2147 SER 602 N -0.0073 0.0010 -0.0003 2148 SER 602 CA -0.0075 0.0006 -0.0010 2149 SER 602 C -0.0059 0.0012 -0.0011 2150 SER 602 O -0.0047 0.0020 -0.0001 2151 SER 602 CB -0.0091 0.0004 0.0000 2152 SER 602 OG -0.0087 0.0012 0.0017 2153 GLY 603 N -0.0008 0.0020 0.0045 2154 GLY 603 CA -0.0005 0.0020 0.0046 2155 GLY 603 C -0.0006 0.0016 0.0047 2156 GLY 603 O -0.0006 0.0017 0.0047 2157 VAL 604 N -0.0008 0.0012 0.0048 2158 VAL 604 CA -0.0009 0.0008 0.0049 2159 VAL 604 C -0.0004 0.0006 0.0052 2160 VAL 604 O -0.0001 0.0006 0.0053 2161 VAL 604 CB -0.0012 0.0004 0.0049 2162 VAL 604 CG1 -0.0016 0.0005 0.0046 2163 VAL 604 CG2 -0.0010 0.0002 0.0051 2164 GLY 605 N 0.0029 -0.0018 0.0093 2165 GLY 605 CA 0.0032 -0.0024 0.0105 2166 GLY 605 C 0.0029 -0.0032 0.0105 2167 GLY 605 O 0.0023 -0.0036 0.0096 2168 VAL 606 N 0.0033 -0.0034 0.0114 2169 VAL 606 CA 0.0031 -0.0043 0.0116 2170 VAL 606 C 0.0035 -0.0048 0.0128 2171 VAL 606 O 0.0041 -0.0042 0.0136 2172 VAL 606 CB 0.0031 -0.0036 0.0111 2173 VAL 606 CG1 0.0038 -0.0025 0.0115 2174 VAL 606 CG2 0.0028 -0.0045 0.0112 2175 ALA 607 N -0.0023 -0.0068 0.0147 2176 ALA 607 CA -0.0026 -0.0062 0.0137 2177 ALA 607 C -0.0014 -0.0054 0.0119 2178 ALA 607 O -0.0002 -0.0054 0.0116 2179 ALA 607 CB -0.0022 -0.0068 0.0148 2180 VAL 608 N -0.0017 -0.0047 0.0108 2181 VAL 608 CA -0.0006 -0.0039 0.0090 2182 VAL 608 C 0.0003 -0.0038 0.0087 2183 VAL 608 O -0.0007 -0.0038 0.0088 2184 VAL 608 CB -0.0019 -0.0029 0.0075 2185 VAL 608 CG1 -0.0010 -0.0020 0.0056 2186 VAL 608 CG2 -0.0024 -0.0029 0.0076 2187 THR 609 N -0.0054 0.0012 0.0115 2188 THR 609 CA -0.0043 0.0034 0.0097 2189 THR 609 C -0.0004 0.0060 0.0088 2190 THR 609 O 0.0020 0.0055 0.0102 2191 THR 609 CB -0.0041 0.0018 0.0115 2192 THR 609 CG2 -0.0005 0.0003 0.0143 2193 THR 609 OG1 -0.0039 0.0039 0.0095 2194 THR 609 OXT -0.0007 0.0087 0.0060 2195 LEU 1 N -0.0046 -0.0103 -0.0027 2196 LEU 1 CA -0.0038 -0.0096 -0.0002 2197 LEU 1 C -0.0037 -0.0119 0.0015 2198 LEU 1 O -0.0037 -0.0130 0.0018 2199 LEU 1 CB -0.0035 -0.0083 0.0003 2200 LEU 1 CG -0.0041 -0.0091 -0.0014 2201 LEU 1 CD1 -0.0042 -0.0116 -0.0005 2202 LEU 1 CD2 -0.0039 -0.0071 -0.0016 2203 ALA 2 N -0.0034 -0.0127 0.0026 2204 ALA 2 CA -0.0033 -0.0149 0.0042 2205 ALA 2 C -0.0038 -0.0166 0.0034 2206 ALA 2 O -0.0041 -0.0188 0.0031 2207 ALA 2 CB -0.0024 -0.0142 0.0068 2208 GLU 3 N 0.0002 -0.0200 0.0036 2209 GLU 3 CA -0.0002 -0.0217 0.0024 2210 GLU 3 C -0.0010 -0.0227 0.0009 2211 GLU 3 O -0.0005 -0.0247 0.0007 2212 GLU 3 CB -0.0011 -0.0207 0.0015 2213 GLU 3 CG -0.0017 -0.0223 0.0000 2214 GLU 3 CD -0.0031 -0.0223 -0.0018 2215 GLU 3 OE1 -0.0039 -0.0205 -0.0022 2216 GLU 3 OE2 -0.0034 -0.0240 -0.0029 2217 GLU 4 N -0.0021 -0.0215 -0.0002 2218 GLU 4 CA -0.0030 -0.0223 -0.0017 2219 GLU 4 C -0.0022 -0.0232 -0.0009 2220 GLU 4 O -0.0024 -0.0247 -0.0018 2221 GLU 4 CB -0.0043 -0.0205 -0.0028 2222 GLU 4 CG -0.0053 -0.0199 -0.0039 2223 GLU 4 CD -0.0067 -0.0183 -0.0052 2224 GLU 4 OE1 -0.0068 -0.0173 -0.0050 2225 GLU 4 OE2 -0.0077 -0.0181 -0.0064 2226 TYR 5 N -0.0033 -0.0211 -0.0051 2227 TYR 5 CA -0.0016 -0.0194 -0.0046 2228 TYR 5 C 0.0006 -0.0218 -0.0050 2229 TYR 5 O 0.0012 -0.0215 -0.0049 2230 TYR 5 CB -0.0000 -0.0166 -0.0038 2231 TYR 5 CG -0.0025 -0.0141 -0.0033 2232 TYR 5 CD1 -0.0047 -0.0130 -0.0031 2233 TYR 5 CD2 -0.0031 -0.0135 -0.0032 2234 TYR 5 CE1 -0.0075 -0.0114 -0.0029 2235 TYR 5 CE2 -0.0058 -0.0120 -0.0029 2236 TYR 5 CZ -0.0080 -0.0109 -0.0028 2237 TYR 5 OH -0.0108 -0.0093 -0.0026 2238 GLY 6 N 0.0019 -0.0241 -0.0055 2239 GLY 6 CA 0.0040 -0.0264 -0.0060 2240 GLY 6 C 0.0020 -0.0283 -0.0065 2241 GLY 6 O 0.0026 -0.0283 -0.0065 2242 GLU 7 N 0.0083 -0.0361 -0.0058 2243 GLU 7 CA 0.0033 -0.0376 -0.0029 2244 GLU 7 C -0.0004 -0.0315 -0.0017 2245 GLU 7 O -0.0027 -0.0308 -0.0005 2246 GLU 7 CB -0.0001 -0.0424 -0.0003 2247 GLU 7 CG 0.0006 -0.0492 0.0003 2248 GLU 7 CD -0.0048 -0.0513 0.0036 2249 GLU 7 OE1 -0.0095 -0.0491 0.0058 2250 GLU 7 OE2 -0.0044 -0.0553 0.0040 2251 PHE 8 N -0.0010 -0.0273 -0.0020 2252 PHE 8 CA -0.0044 -0.0212 -0.0011 2253 PHE 8 C -0.0019 -0.0172 -0.0030 2254 PHE 8 O -0.0049 -0.0128 -0.0020 2255 PHE 8 CB -0.0043 -0.0174 -0.0017 2256 PHE 8 CG -0.0085 -0.0193 0.0009 2257 PHE 8 CD1 -0.0101 -0.0151 0.0012 2258 PHE 8 CD2 -0.0108 -0.0253 0.0031 2259 PHE 8 CE1 -0.0140 -0.0168 0.0036 2260 PHE 8 CE2 -0.0147 -0.0270 0.0055 2261 PHE 8 CZ -0.0163 -0.0227 0.0057 2262 LEU 9 N -0.0043 -0.0180 -0.0069 2263 LEU 9 CA -0.0028 -0.0151 -0.0087 2264 LEU 9 C -0.0037 -0.0163 -0.0077 2265 LEU 9 O -0.0041 -0.0132 -0.0081 2266 LEU 9 CB 0.0014 -0.0155 -0.0117 2267 LEU 9 CG 0.0029 -0.0143 -0.0131 2268 LEU 9 CD1 0.0070 -0.0156 -0.0159 2269 LEU 9 CD2 0.0018 -0.0094 -0.0136 2270 LEU 9 OXT -0.0040 -0.0203 -0.0065