1 ASP 513 N 0.0114 -0.0297 -0.0609 2 ASP 513 CA 0.0066 -0.0291 -0.0697 3 ASP 513 C 0.0108 -0.0286 -0.0573 4 ASP 513 O 0.0187 -0.0297 -0.0435 5 ASP 513 CB 0.0141 -0.0372 -0.0869 6 ASP 513 CG 0.0317 -0.0463 -0.0850 7 ASP 513 OD1 0.0396 -0.0474 -0.0714 8 ASP 513 OD2 0.0377 -0.0523 -0.0971 9 ASN 514 N 0.0076 -0.0302 -0.0498 10 ASN 514 CA 0.0081 -0.0276 -0.0427 11 ASN 514 C 0.0050 -0.0244 -0.0351 12 ASN 514 O 0.0075 -0.0221 -0.0284 13 ASN 514 CB 0.0172 -0.0281 -0.0414 14 ASN 514 CG 0.0175 -0.0258 -0.0352 15 ASN 514 ND2 0.0240 -0.0245 -0.0298 16 ASN 514 OD1 0.0116 -0.0250 -0.0349 17 LEU 515 N 0.0032 -0.0204 -0.0314 18 LEU 515 CA 0.0008 -0.0185 -0.0262 19 LEU 515 C -0.0034 -0.0166 -0.0238 20 LEU 515 O -0.0062 -0.0165 -0.0270 21 LEU 515 CB -0.0019 -0.0180 -0.0276 22 LEU 515 CG 0.0021 -0.0198 -0.0301 23 LEU 515 CD1 -0.0012 -0.0191 -0.0316 24 LEU 515 CD2 0.0071 -0.0203 -0.0258 25 VAL 516 N -0.0044 -0.0178 -0.0139 26 VAL 516 CA -0.0082 -0.0142 -0.0123 27 VAL 516 C -0.0095 -0.0111 -0.0093 28 VAL 516 O -0.0061 -0.0105 -0.0062 29 VAL 516 CB -0.0062 -0.0132 -0.0096 30 VAL 516 CG1 -0.0100 -0.0093 -0.0075 31 VAL 516 CG2 -0.0048 -0.0164 -0.0126 32 LEU 517 N -0.0105 -0.0121 -0.0015 33 LEU 517 CA -0.0092 -0.0105 -0.0011 34 LEU 517 C -0.0097 -0.0083 -0.0018 35 LEU 517 O -0.0114 -0.0077 -0.0028 36 LEU 517 CB -0.0092 -0.0109 -0.0011 37 LEU 517 CG -0.0077 -0.0095 -0.0006 38 LEU 517 CD1 -0.0057 -0.0101 0.0006 39 LEU 517 CD2 -0.0081 -0.0100 -0.0007 40 ILE 518 N -0.0074 -0.0085 0.0046 41 ILE 518 CA -0.0082 -0.0052 0.0048 42 ILE 518 C -0.0068 -0.0035 0.0052 43 ILE 518 O -0.0042 -0.0042 0.0057 44 ILE 518 CB -0.0071 -0.0040 0.0051 45 ILE 518 CG1 -0.0088 -0.0055 0.0046 46 ILE 518 CG2 -0.0075 -0.0003 0.0054 47 ILE 518 CD1 -0.0075 -0.0049 0.0050 48 ARG 519 N -0.0046 -0.0050 0.0090 49 ARG 519 CA -0.0030 -0.0051 0.0080 50 ARG 519 C -0.0035 -0.0015 0.0080 51 ARG 519 O -0.0059 0.0003 0.0094 52 ARG 519 CB -0.0041 -0.0080 0.0090 53 ARG 519 CG -0.0034 -0.0118 0.0089 54 ARG 519 CD -0.0047 -0.0146 0.0101 55 ARG 519 NE -0.0044 -0.0181 0.0102 56 ARG 519 CZ -0.0065 -0.0194 0.0117 57 ARG 519 NH1 -0.0090 -0.0175 0.0132 58 ARG 519 NH2 -0.0060 -0.0226 0.0117 59 MET 520 N -0.0016 -0.0025 0.0109 60 MET 520 CA -0.0020 0.0005 0.0097 61 MET 520 C 0.0007 0.0000 0.0073 62 MET 520 O 0.0031 -0.0013 0.0057 63 MET 520 CB -0.0028 0.0040 0.0086 64 MET 520 CG -0.0006 0.0043 0.0063 65 MET 520 SD -0.0016 0.0084 0.0051 66 MET 520 CE -0.0037 0.0076 0.0075 67 LYS 521 N 0.0034 -0.0035 0.0079 68 LYS 521 CA 0.0051 -0.0045 0.0053 69 LYS 521 C 0.0044 -0.0021 0.0028 70 LYS 521 O 0.0028 -0.0000 0.0034 71 LYS 521 CB 0.0058 -0.0061 0.0061 72 LYS 521 CG 0.0067 -0.0087 0.0082 73 LYS 521 CD 0.0078 -0.0106 0.0085 74 LYS 521 CE 0.0090 -0.0133 0.0103 75 LYS 521 NZ 0.0086 -0.0142 0.0128 76 PRO 522 N 0.0118 -0.0056 0.0015 77 PRO 522 CA 0.0117 0.0002 -0.0030 78 PRO 522 C 0.0109 0.0011 -0.0017 79 PRO 522 O 0.0110 -0.0035 0.0018 80 PRO 522 CB 0.0154 -0.0020 -0.0099 81 PRO 522 CG 0.0175 -0.0098 -0.0088 82 PRO 522 CD 0.0154 -0.0117 -0.0020 83 ASP 523 N 0.0075 0.0099 -0.0020 84 ASP 523 CA 0.0062 0.0121 -0.0001 85 ASP 523 C 0.0131 0.0011 -0.0105 86 ASP 523 O 0.0184 -0.0076 -0.0188 87 ASP 523 CB 0.0030 0.0300 -0.0026 88 ASP 523 CG 0.0077 0.0378 -0.0188 89 ASP 523 OD1 0.0141 0.0291 -0.0294 90 ASP 523 OD2 0.0049 0.0528 -0.0207 91 GLU 524 N 0.0119 -0.0041 0.0009 92 GLU 524 CA 0.0178 -0.0246 -0.0139 93 GLU 524 C 0.0368 -0.0178 -0.0491 94 GLU 524 O 0.0441 -0.0413 -0.0670 95 GLU 524 CB 0.0083 -0.0179 0.0055 96 GLU 524 CG -0.0102 -0.0347 0.0383 97 GLU 524 CD -0.0206 -0.0294 0.0590 98 GLU 524 OE1 -0.0132 -0.0144 0.0473 99 GLU 524 OE2 -0.0363 -0.0377 0.0877 100 ASN 525 N 0.0394 0.0184 -0.0591 101 ASN 525 CA 0.0523 0.0248 -0.0811 102 ASN 525 C 0.0552 0.0150 -0.0740 103 ASN 525 O 0.0612 0.0238 -0.0905 104 ASN 525 CB 0.0434 0.0530 -0.1005 105 ASN 525 CG 0.0518 0.0583 -0.1161 106 ASN 525 ND2 0.0371 0.0648 -0.1057 107 ASN 525 OD1 0.0727 0.0536 -0.1356 108 GLY 526 N 0.0354 0.0027 -0.0531 109 GLY 526 CA 0.0353 0.0003 -0.0440 110 GLY 526 C 0.0225 0.0050 -0.0386 111 GLY 526 O 0.0215 0.0038 -0.0325 112 ARG 527 N 0.0287 0.0165 -0.0328 113 ARG 527 CA 0.0126 0.0258 -0.0279 114 ARG 527 C 0.0006 0.0238 -0.0089 115 ARG 527 O -0.0001 0.0211 -0.0031 116 ARG 527 CB 0.0033 0.0411 -0.0425 117 ARG 527 CG 0.0150 0.0434 -0.0617 118 ARG 527 CD 0.0054 0.0590 -0.0763 119 ARG 527 NE 0.0171 0.0608 -0.0949 120 ARG 527 CZ 0.0245 0.0628 -0.1081 121 ARG 527 NH1 0.0212 0.0636 -0.1052 122 ARG 527 NH2 0.0349 0.0644 -0.1244 123 PHE 528 N 0.0051 0.0224 -0.0065 124 PHE 528 CA 0.0012 0.0215 -0.0004 125 PHE 528 C -0.0024 0.0287 0.0017 126 PHE 528 O -0.0063 0.0288 0.0073 127 PHE 528 CB 0.0025 0.0173 -0.0005 128 PHE 528 CG 0.0054 0.0097 -0.0015 129 PHE 528 CD1 0.0035 0.0045 0.0034 130 PHE 528 CD2 0.0099 0.0077 -0.0072 131 PHE 528 CE1 0.0062 -0.0026 0.0025 132 PHE 528 CE2 0.0126 0.0006 -0.0081 133 PHE 528 CZ 0.0107 -0.0046 -0.0032 134 GLY 529 N 0.0016 0.0356 0.0066 135 GLY 529 CA 0.0010 0.0377 0.0073 136 GLY 529 C 0.0039 0.0325 0.0056 137 GLY 529 O 0.0026 0.0335 0.0059 138 PHE 530 N 0.0060 0.0200 0.0122 139 PHE 530 CA 0.0085 0.0154 0.0110 140 PHE 530 C 0.0148 0.0149 0.0124 141 PHE 530 O 0.0168 0.0168 0.0136 142 PHE 530 CB 0.0058 0.0102 0.0084 143 PHE 530 CG 0.0069 0.0081 0.0078 144 PHE 530 CD1 0.0111 0.0040 0.0073 145 PHE 530 CD2 0.0036 0.0101 0.0078 146 PHE 530 CE1 0.0121 0.0020 0.0067 147 PHE 530 CE2 0.0045 0.0080 0.0072 148 PHE 530 CZ 0.0088 0.0040 0.0067 149 ASN 531 N 0.0149 0.0061 0.0185 150 ASN 531 CA 0.0225 0.0041 0.0211 151 ASN 531 C 0.0238 -0.0038 0.0189 152 ASN 531 O 0.0197 -0.0079 0.0156 153 ASN 531 CB 0.0262 0.0051 0.0231 154 ASN 531 CG 0.0256 0.0126 0.0256 155 ASN 531 ND2 0.0288 0.0135 0.0273 156 ASN 531 OD1 0.0219 0.0176 0.0257 157 VAL 532 N 0.0199 -0.0167 0.0231 158 VAL 532 CA 0.0208 -0.0151 0.0193 159 VAL 532 C 0.0219 -0.0160 0.0203 160 VAL 532 O 0.0205 -0.0172 0.0236 161 VAL 532 CB 0.0168 -0.0127 0.0167 162 VAL 532 CG1 0.0160 -0.0116 0.0150 163 VAL 532 CG2 0.0127 -0.0127 0.0192 164 LYS 533 N 0.0177 -0.0194 0.0255 165 LYS 533 CA 0.0197 -0.0200 0.0255 166 LYS 533 C 0.0173 -0.0162 0.0182 167 LYS 533 O 0.0159 -0.0136 0.0132 168 LYS 533 CB 0.0284 -0.0227 0.0257 169 LYS 533 CG 0.0313 -0.0268 0.0331 170 LYS 533 CD 0.0399 -0.0293 0.0328 171 LYS 533 CE 0.0427 -0.0333 0.0401 172 LYS 533 NZ 0.0511 -0.0358 0.0400 173 GLY 534 N 0.0114 -0.0180 0.0159 174 GLY 534 CA 0.0092 -0.0118 0.0089 175 GLY 534 C -0.0004 -0.0101 0.0073 176 GLY 534 O -0.0061 -0.0138 0.0117 177 GLY 535 N -0.0056 -0.0041 0.0062 178 GLY 535 CA -0.0166 0.0014 0.0052 179 GLY 535 C -0.0220 0.0076 0.0028 180 GLY 535 O -0.0185 0.0061 0.0029 181 TYR 536 N -0.0272 0.0142 0.0033 182 TYR 536 CA -0.0347 0.0242 -0.0009 183 TYR 536 C -0.0421 0.0191 0.0007 184 TYR 536 O -0.0425 0.0254 -0.0018 185 TYR 536 CB -0.0449 0.0303 -0.0038 186 TYR 536 CG -0.0533 0.0406 -0.0083 187 TYR 536 CD1 -0.0481 0.0531 -0.0128 188 TYR 536 CD2 -0.0666 0.0380 -0.0079 189 TYR 536 CE1 -0.0558 0.0626 -0.0169 190 TYR 536 CE2 -0.0742 0.0473 -0.0119 191 TYR 536 CZ -0.0689 0.0596 -0.0164 192 TYR 536 OH -0.0770 0.0687 -0.0204 193 ASP 537 N -0.0464 0.0105 0.0050 194 ASP 537 CA -0.0528 0.0040 0.0085 195 ASP 537 C -0.0457 -0.0023 0.0090 196 ASP 537 O -0.0501 -0.0057 0.0110 197 ASP 537 CB -0.0590 -0.0037 0.0123 198 ASP 537 CG -0.0521 -0.0106 0.0131 199 ASP 537 OD1 -0.0441 -0.0068 0.0101 200 ASP 537 OD2 -0.0551 -0.0198 0.0167 201 GLN 538 N -0.0268 -0.0032 0.0090 202 GLN 538 CA -0.0184 -0.0084 0.0095 203 GLN 538 C -0.0124 -0.0026 0.0039 204 GLN 538 O -0.0052 -0.0060 0.0037 205 GLN 538 CB -0.0123 -0.0139 0.0111 206 GLN 538 CG -0.0177 -0.0207 0.0171 207 GLN 538 CD -0.0112 -0.0269 0.0190 208 GLN 538 NE2 -0.0157 -0.0315 0.0233 209 GLN 538 OE1 -0.0022 -0.0276 0.0165 210 LYS 539 N -0.0178 0.0070 -0.0020 211 LYS 539 CA -0.0115 0.0186 -0.0070 212 LYS 539 C 0.0052 0.0171 -0.0108 213 LYS 539 O 0.0126 0.0202 -0.0136 214 LYS 539 CB -0.0173 0.0188 -0.0055 215 LYS 539 CG -0.0340 0.0199 -0.0016 216 LYS 539 CD -0.0379 0.0190 -0.0004 217 LYS 539 CE -0.0496 0.0086 0.0057 218 LYS 539 NZ -0.0642 0.0134 0.0080 219 MET 540 N 0.0082 0.0082 -0.0094 220 MET 540 CA 0.0182 0.0081 -0.0099 221 MET 540 CA 0.0182 0.0069 -0.0089 222 MET 540 C 0.0158 0.0081 -0.0098 223 MET 540 O 0.0069 0.0062 -0.0074 224 MET 540 CB 0.0264 0.0014 -0.0045 225 MET 540 CB 0.0225 -0.0019 -0.0012 226 MET 540 CG 0.0226 -0.0068 0.0032 227 MET 540 CG 0.0275 -0.0036 0.0001 228 MET 540 SD 0.0334 -0.0137 0.0088 229 MET 540 SD 0.0382 0.0028 -0.0065 230 MET 540 CE 0.0269 -0.0229 0.0174 231 MET 540 CE 0.0486 -0.0001 -0.0046 232 PRO 541 N 0.0222 0.0037 -0.0099 233 PRO 541 CA 0.0186 0.0026 -0.0091 234 PRO 541 C 0.0172 -0.0027 -0.0019 235 PRO 541 O 0.0209 -0.0052 0.0027 236 PRO 541 CB 0.0248 0.0051 -0.0112 237 PRO 541 CG 0.0325 0.0056 -0.0102 238 PRO 541 CD 0.0304 0.0064 -0.0118 239 VAL 542 N 0.0143 -0.0041 0.0023 240 VAL 542 CA 0.0138 -0.0077 0.0060 241 VAL 542 C 0.0194 -0.0090 0.0060 242 VAL 542 O 0.0215 -0.0064 0.0030 243 VAL 542 CB 0.0086 -0.0069 0.0064 244 VAL 542 CG1 0.0085 -0.0106 0.0101 245 VAL 542 CG2 0.0030 -0.0060 0.0068 246 ILE 543 N 0.0233 -0.0116 0.0097 247 ILE 543 CA 0.0265 -0.0127 0.0094 248 ILE 543 C 0.0258 -0.0141 0.0128 249 ILE 543 O 0.0246 -0.0152 0.0159 250 ILE 543 CB 0.0305 -0.0142 0.0092 251 ILE 543 CG1 0.0312 -0.0129 0.0060 252 ILE 543 CG2 0.0339 -0.0154 0.0088 253 ILE 543 CD1 0.0322 -0.0114 0.0021 254 VAL 544 N 0.0233 -0.0131 0.0095 255 VAL 544 CA 0.0217 -0.0096 0.0112 256 VAL 544 C 0.0243 -0.0111 0.0125 257 VAL 544 O 0.0246 -0.0141 0.0101 258 VAL 544 CB 0.0175 -0.0081 0.0081 259 VAL 544 CG1 0.0160 -0.0046 0.0098 260 VAL 544 CG2 0.0151 -0.0067 0.0068 261 SER 545 N 0.0244 -0.0110 0.0159 262 SER 545 CA 0.0274 -0.0122 0.0177 263 SER 545 C 0.0261 -0.0102 0.0189 264 SER 545 O 0.0283 -0.0114 0.0198 265 SER 545 CB 0.0306 -0.0123 0.0212 266 SER 545 OG 0.0291 -0.0090 0.0239 267 ARG 546 N 0.0252 -0.0037 0.0168 268 ARG 546 CA 0.0208 0.0029 0.0168 269 ARG 546 C 0.0140 0.0073 0.0145 270 ARG 546 O 0.0146 0.0080 0.0152 271 ARG 546 CB 0.0258 0.0095 0.0225 272 ARG 546 CG 0.0219 0.0155 0.0227 273 ARG 546 CD 0.0268 0.0214 0.0281 274 ARG 546 NE 0.0220 0.0275 0.0277 275 ARG 546 CZ 0.0184 0.0351 0.0286 276 ARG 546 NH1 0.0194 0.0377 0.0304 277 ARG 546 NH2 0.0139 0.0401 0.0280 278 VAL 547 N 0.0122 0.0144 0.0151 279 VAL 547 CA 0.0074 0.0177 0.0138 280 VAL 547 C 0.0054 0.0234 0.0146 281 VAL 547 O 0.0037 0.0227 0.0136 282 VAL 547 CB 0.0024 0.0139 0.0102 283 VAL 547 CG1 -0.0028 0.0179 0.0090 284 VAL 547 CG2 0.0044 0.0082 0.0094 285 ALA 548 N 0.0041 0.0318 0.0158 286 ALA 548 CA 0.0024 0.0382 0.0168 287 ALA 548 C -0.0047 0.0404 0.0149 288 ALA 548 O -0.0076 0.0393 0.0136 289 ALA 548 CB 0.0064 0.0432 0.0193 290 PRO 549 N -0.0068 0.0475 0.0161 291 PRO 549 CA -0.0146 0.0496 0.0148 292 PRO 549 C -0.0165 0.0541 0.0153 293 PRO 549 O -0.0126 0.0591 0.0171 294 PRO 549 CB -0.0162 0.0544 0.0154 295 PRO 549 CG -0.0103 0.0522 0.0162 296 PRO 549 CD -0.0036 0.0503 0.0173 297 GLY 550 N -0.0212 0.0521 0.0151 298 GLY 550 CA -0.0244 0.0550 0.0157 299 GLY 550 C -0.0204 0.0531 0.0154 300 GLY 550 O -0.0221 0.0561 0.0160 301 THR 551 N -0.0166 0.0472 0.0139 302 THR 551 CA -0.0122 0.0440 0.0128 303 THR 551 C -0.0145 0.0374 0.0131 304 THR 551 O -0.0190 0.0351 0.0139 305 THR 551 CB -0.0060 0.0436 0.0116 306 THR 551 CG2 -0.0033 0.0502 0.0112 307 THR 551 OG1 -0.0065 0.0398 0.0115 308 PRO 552 N -0.0098 0.0320 0.0113 309 PRO 552 CA -0.0122 0.0251 0.0117 310 PRO 552 C -0.0121 0.0228 0.0113 311 PRO 552 O -0.0163 0.0191 0.0133 312 PRO 552 CB -0.0085 0.0210 0.0087 313 PRO 552 CG -0.0070 0.0259 0.0086 314 PRO 552 CD -0.0058 0.0326 0.0089 315 ALA 553 N -0.0091 0.0227 0.0098 316 ALA 553 CA -0.0085 0.0191 0.0089 317 ALA 553 C -0.0118 0.0195 0.0091 318 ALA 553 O -0.0128 0.0162 0.0083 319 ALA 553 CB -0.0034 0.0190 0.0088 320 ASP 554 N -0.0138 0.0257 0.0108 321 ASP 554 CA -0.0183 0.0266 0.0108 322 ASP 554 C -0.0245 0.0257 0.0106 323 ASP 554 O -0.0286 0.0247 0.0104 324 ASP 554 CB -0.0177 0.0329 0.0119 325 ASP 554 CG -0.0220 0.0346 0.0121 326 ASP 554 OD1 -0.0224 0.0313 0.0116 327 ASP 554 OD2 -0.0252 0.0390 0.0128 328 LEU 555 N -0.0253 0.0271 0.0120 329 LEU 555 CA -0.0315 0.0268 0.0125 330 LEU 555 C -0.0331 0.0208 0.0116 331 LEU 555 O -0.0382 0.0201 0.0119 332 LEU 555 CB -0.0322 0.0322 0.0134 333 LEU 555 CG -0.0310 0.0386 0.0144 334 LEU 555 CD1 -0.0315 0.0433 0.0152 335 LEU 555 CD2 -0.0359 0.0400 0.0150 336 CYS 556 N -0.0257 0.0175 0.0098 337 CYS 556 CA -0.0267 0.0129 0.0087 338 CYS 556 C -0.0304 0.0090 0.0078 339 CYS 556 O -0.0321 0.0097 0.0079 340 CYS 556 CB -0.0213 0.0104 0.0082 341 CYS 556 SG -0.0166 0.0092 0.0080 342 VAL 557 N -0.0291 0.0089 0.0072 343 VAL 557 CA -0.0336 0.0042 0.0052 344 VAL 557 C -0.0303 -0.0023 0.0037 345 VAL 557 O -0.0293 -0.0051 0.0030 346 VAL 557 CB -0.0395 0.0042 0.0045 347 VAL 557 CG1 -0.0440 -0.0011 0.0023 348 VAL 557 CG2 -0.0430 0.0106 0.0059 349 PRO 558 N -0.0266 -0.0011 -0.0000 350 PRO 558 CA -0.0263 0.0002 0.0006 351 PRO 558 C -0.0230 0.0020 0.0021 352 PRO 558 O -0.0211 0.0022 0.0025 353 PRO 558 CB -0.0261 -0.0029 -0.0007 354 PRO 558 CG -0.0238 -0.0053 -0.0012 355 PRO 558 CD -0.0249 -0.0045 -0.0011 356 ARG 559 N -0.0255 0.0035 0.0012 357 ARG 559 CA -0.0211 0.0062 0.0032 358 ARG 559 C -0.0162 0.0028 0.0037 359 ARG 559 O -0.0163 -0.0018 0.0026 360 ARG 559 CB -0.0218 0.0078 0.0033 361 ARG 559 CG -0.0182 0.0118 0.0053 362 ARG 559 CD -0.0174 0.0117 0.0055 363 ARG 559 NE -0.0148 0.0161 0.0073 364 ARG 559 CZ -0.0108 0.0156 0.0084 365 ARG 559 NH1 -0.0087 0.0109 0.0078 366 ARG 559 NH2 -0.0088 0.0198 0.0099 367 LEU 560 N -0.0105 0.0041 0.0041 368 LEU 560 CA -0.0059 0.0019 0.0041 369 LEU 560 C -0.0039 0.0025 0.0047 370 LEU 560 O -0.0046 0.0061 0.0060 371 LEU 560 CB -0.0030 0.0039 0.0055 372 LEU 560 CG 0.0018 0.0016 0.0055 373 LEU 560 CD1 0.0014 -0.0029 0.0036 374 LEU 560 CD2 0.0045 0.0044 0.0072 375 ASN 561 N 0.0032 -0.0036 0.0025 376 ASN 561 CA 0.0058 -0.0039 0.0032 377 ASN 561 C 0.0117 -0.0053 0.0045 378 ASN 561 O 0.0138 -0.0081 0.0037 379 ASN 561 CB 0.0036 -0.0076 0.0003 380 ASN 561 CG -0.0019 -0.0060 -0.0007 381 ASN 561 ND2 -0.0054 -0.0088 -0.0035 382 ASN 561 OD1 -0.0031 -0.0022 0.0011 383 GLU 562 N 0.0133 -0.0070 0.0054 384 GLU 562 CA 0.0186 -0.0093 0.0075 385 GLU 562 C 0.0196 -0.0151 0.0049 386 GLU 562 O 0.0167 -0.0175 0.0018 387 GLU 562 CB 0.0205 -0.0081 0.0094 388 GLU 562 CG 0.0202 -0.0025 0.0123 389 GLU 562 CD 0.0155 0.0009 0.0111 390 GLU 562 OE1 0.0116 -0.0007 0.0078 391 GLU 562 OE2 0.0158 0.0051 0.0137 392 GLY 563 N 0.0261 -0.0160 0.0056 393 GLY 563 CA 0.0273 -0.0190 0.0030 394 GLY 563 C 0.0251 -0.0184 0.0006 395 GLY 563 O 0.0261 -0.0205 -0.0011 396 ASP 564 N 0.0214 -0.0152 0.0025 397 ASP 564 CA 0.0185 -0.0152 -0.0004 398 ASP 564 C 0.0205 -0.0155 0.0012 399 ASP 564 O 0.0220 -0.0135 0.0053 400 ASP 564 CB 0.0138 -0.0115 -0.0001 401 ASP 564 CG 0.0107 -0.0111 -0.0027 402 ASP 564 OD1 0.0119 -0.0140 -0.0051 403 ASP 564 OD2 0.0070 -0.0079 -0.0022 404 GLN 565 N 0.0224 -0.0136 0.0017 405 GLN 565 CA 0.0216 -0.0132 0.0019 406 GLN 565 C 0.0180 -0.0114 0.0015 407 GLN 565 O 0.0167 -0.0108 -0.0011 408 GLN 565 CB 0.0233 -0.0139 -0.0011 409 GLN 565 CG 0.0224 -0.0135 -0.0010 410 GLN 565 CD 0.0238 -0.0141 -0.0040 411 GLN 565 NE2 0.0223 -0.0133 -0.0049 412 GLN 565 OE1 0.0264 -0.0153 -0.0055 413 VAL 566 N 0.0153 -0.0094 0.0027 414 VAL 566 CA 0.0129 -0.0070 0.0026 415 VAL 566 C 0.0119 -0.0057 0.0013 416 VAL 566 O 0.0119 -0.0061 0.0025 417 VAL 566 CB 0.0114 -0.0068 0.0058 418 VAL 566 CG1 0.0088 -0.0044 0.0057 419 VAL 566 CG2 0.0125 -0.0083 0.0070 420 VAL 567 N 0.0093 -0.0057 0.0006 421 VAL 567 CA 0.0084 -0.0030 0.0006 422 VAL 567 C 0.0059 0.0037 0.0034 423 VAL 567 O 0.0050 0.0050 0.0079 424 VAL 567 CB 0.0092 -0.0029 -0.0066 425 VAL 567 CG1 0.0082 0.0003 -0.0068 426 VAL 567 CG2 0.0117 -0.0097 -0.0092 427 LEU 568 N 0.0037 0.0024 0.0054 428 LEU 568 CA 0.0031 0.0035 0.0058 429 LEU 568 C 0.0033 0.0011 0.0054 430 LEU 568 O 0.0050 -0.0007 0.0045 431 LEU 568 CB 0.0050 0.0059 0.0051 432 LEU 568 CG 0.0053 0.0087 0.0051 433 LEU 568 CD1 0.0072 0.0108 0.0043 434 LEU 568 CD2 0.0028 0.0102 0.0065 435 ILE 569 N 0.0030 0.0009 0.0071 436 ILE 569 CA 0.0035 -0.0010 0.0061 437 ILE 569 C 0.0046 -0.0002 0.0063 438 ILE 569 O 0.0034 0.0007 0.0069 439 ILE 569 CB 0.0014 -0.0024 0.0056 440 ILE 569 CG1 0.0004 -0.0031 0.0054 441 ILE 569 CG2 0.0021 -0.0043 0.0045 442 ILE 569 CD1 -0.0018 -0.0044 0.0050 443 ASN 570 N 0.0078 -0.0029 0.0068 444 ASN 570 CA 0.0102 -0.0035 0.0074 445 ASN 570 C 0.0101 -0.0014 0.0095 446 ASN 570 O 0.0104 -0.0015 0.0094 447 ASN 570 CB 0.0100 -0.0055 0.0052 448 ASN 570 CG 0.0106 -0.0077 0.0033 449 ASN 570 ND2 0.0090 -0.0091 0.0012 450 ASN 570 OD1 0.0125 -0.0082 0.0037 451 GLY 571 N 0.0090 0.0032 0.0090 452 GLY 571 CA 0.0086 0.0081 0.0105 453 GLY 571 C 0.0038 0.0103 0.0112 454 GLY 571 O 0.0034 0.0144 0.0126 455 ARG 572 N 0.0030 0.0097 0.0114 456 ARG 572 CA -0.0010 0.0108 0.0123 457 ARG 572 C -0.0034 0.0112 0.0127 458 ARG 572 O -0.0035 0.0090 0.0112 459 ARG 572 CB -0.0030 0.0083 0.0108 460 ARG 572 CG -0.0070 0.0093 0.0116 461 ARG 572 CD -0.0094 0.0063 0.0098 462 ARG 572 NE -0.0073 0.0044 0.0085 463 ARG 572 CZ -0.0076 0.0047 0.0088 464 ARG 572 NH1 -0.0101 0.0070 0.0103 465 ARG 572 NH2 -0.0057 0.0028 0.0075 466 ASP 573 N -0.0053 0.0169 0.0145 467 ASP 573 CA -0.0085 0.0193 0.0150 468 ASP 573 C -0.0138 0.0168 0.0125 469 ASP 573 O -0.0170 0.0170 0.0119 470 ASP 573 CB -0.0096 0.0249 0.0175 471 ASP 573 CG -0.0131 0.0280 0.0183 472 ASP 573 OD1 -0.0150 0.0259 0.0168 473 ASP 573 OD2 -0.0141 0.0326 0.0204 474 ILE 574 N -0.0081 0.0173 0.0093 475 ILE 574 CA -0.0133 0.0136 0.0082 476 ILE 574 C -0.0169 0.0167 0.0079 477 ILE 574 O -0.0207 0.0135 0.0071 478 ILE 574 CB -0.0108 0.0068 0.0080 479 ILE 574 CG1 -0.0054 0.0072 0.0088 480 ILE 574 CG2 -0.0090 0.0031 0.0080 481 ILE 574 CD1 -0.0040 0.0010 0.0085 482 ALA 575 N -0.0182 0.0258 0.0101 483 ALA 575 CA -0.0183 0.0347 0.0066 484 ALA 575 C -0.0230 0.0357 -0.0016 485 ALA 575 O -0.0228 0.0412 -0.0035 486 ALA 575 CB -0.0165 0.0409 0.0071 487 GLU 576 N -0.0308 0.0377 0.0024 488 GLU 576 CA -0.0403 0.0382 -0.0016 489 GLU 576 C -0.0449 0.0282 -0.0020 490 GLU 576 O -0.0531 0.0275 -0.0053 491 GLU 576 CB -0.0457 0.0440 -0.0047 492 GLU 576 CG -0.0414 0.0540 -0.0045 493 GLU 576 CD -0.0395 0.0612 -0.0048 494 GLU 576 OE1 -0.0446 0.0611 -0.0070 495 GLU 576 OE2 -0.0329 0.0673 -0.0030 496 HIS 577 N -0.0365 0.0208 0.0052 497 HIS 577 CA -0.0387 0.0140 0.0045 498 HIS 577 C -0.0396 0.0099 0.0041 499 HIS 577 O -0.0361 0.0108 0.0049 500 HIS 577 CB -0.0339 0.0102 0.0053 501 HIS 577 CG -0.0342 0.0127 0.0054 502 HIS 577 CD2 -0.0388 0.0116 0.0044 503 HIS 577 ND1 -0.0292 0.0168 0.0065 504 HIS 577 CE1 -0.0311 0.0182 0.0062 505 HIS 577 NE2 -0.0367 0.0151 0.0049 506 THR 578 N -0.0470 0.0089 0.0054 507 THR 578 CA -0.0471 0.0015 0.0068 508 THR 578 C -0.0395 -0.0058 0.0080 509 THR 578 O -0.0359 -0.0064 0.0080 510 THR 578 CB -0.0567 -0.0035 0.0079 511 THR 578 CG2 -0.0651 0.0031 0.0068 512 THR 578 OG1 -0.0579 -0.0087 0.0088 513 HIS 579 N -0.0330 -0.0093 0.0067 514 HIS 579 CA -0.0281 -0.0152 0.0097 515 HIS 579 C -0.0315 -0.0208 0.0112 516 HIS 579 O -0.0275 -0.0231 0.0127 517 HIS 579 CB -0.0273 -0.0190 0.0112 518 HIS 579 CG -0.0220 -0.0251 0.0144 519 HIS 579 CD2 -0.0234 -0.0321 0.0168 520 HIS 579 ND1 -0.0145 -0.0240 0.0152 521 HIS 579 CE1 -0.0115 -0.0305 0.0181 522 HIS 579 NE2 -0.0168 -0.0355 0.0191 523 ASP 580 N -0.0424 -0.0248 0.0119 524 ASP 580 CA -0.0436 -0.0294 0.0121 525 ASP 580 C -0.0416 -0.0211 0.0117 526 ASP 580 O -0.0382 -0.0243 0.0109 527 ASP 580 CB -0.0542 -0.0347 0.0145 528 ASP 580 CG -0.0553 -0.0453 0.0147 529 ASP 580 OD1 -0.0473 -0.0494 0.0127 530 ASP 580 OD2 -0.0641 -0.0495 0.0167 531 GLN 581 N -0.0407 -0.0167 0.0102 532 GLN 581 CA -0.0392 -0.0108 0.0095 533 GLN 581 C -0.0295 -0.0108 0.0084 534 GLN 581 O -0.0272 -0.0113 0.0082 535 GLN 581 CB -0.0424 -0.0016 0.0089 536 GLN 581 CG -0.0523 -0.0007 0.0099 537 GLN 581 CD -0.0561 0.0076 0.0095 538 GLN 581 NE2 -0.0647 0.0086 0.0103 539 GLN 581 OE1 -0.0517 0.0126 0.0085 540 VAL 582 N -0.0259 -0.0092 0.0085 541 VAL 582 CA -0.0191 -0.0095 0.0066 542 VAL 582 C -0.0168 -0.0153 0.0054 543 VAL 582 O -0.0120 -0.0149 0.0042 544 VAL 582 CB -0.0173 -0.0095 0.0062 545 VAL 582 CG1 -0.0106 -0.0117 0.0042 546 VAL 582 CG2 -0.0180 -0.0028 0.0071 547 VAL 583 N -0.0196 -0.0208 0.0037 548 VAL 583 CA -0.0176 -0.0249 0.0007 549 VAL 583 C -0.0166 -0.0191 0.0014 550 VAL 583 O -0.0117 -0.0186 -0.0031 551 VAL 583 CB -0.0222 -0.0329 0.0030 552 VAL 583 CG1 -0.0211 -0.0366 0.0009 553 VAL 583 CG2 -0.0221 -0.0391 0.0012 554 LEU 584 N -0.0176 -0.0159 -0.0026 555 LEU 584 CA -0.0124 -0.0139 -0.0027 556 LEU 584 C -0.0068 -0.0108 -0.0012 557 LEU 584 O -0.0016 -0.0104 -0.0039 558 LEU 584 CB -0.0143 -0.0121 0.0012 559 LEU 584 CG -0.0093 -0.0105 0.0007 560 LEU 584 CD1 -0.0072 -0.0135 -0.0052 561 LEU 584 CD2 -0.0117 -0.0089 0.0045 562 PHE 585 N -0.0114 -0.0110 -0.0001 563 PHE 585 CA -0.0068 -0.0081 0.0005 564 PHE 585 C -0.0026 -0.0107 -0.0019 565 PHE 585 O 0.0015 -0.0101 -0.0025 566 PHE 585 CB -0.0070 -0.0044 0.0025 567 PHE 585 CG -0.0105 -0.0011 0.0051 568 PHE 585 CD1 -0.0110 0.0001 0.0058 569 PHE 585 CD2 -0.0132 0.0010 0.0068 570 PHE 585 CE1 -0.0141 0.0032 0.0082 571 PHE 585 CE2 -0.0164 0.0040 0.0092 572 PHE 585 CZ -0.0168 0.0051 0.0099 573 ILE 586 N 0.0011 -0.0078 -0.0039 574 ILE 586 CA 0.0022 -0.0085 -0.0053 575 ILE 586 C 0.0038 -0.0095 -0.0070 576 ILE 586 O 0.0056 -0.0098 -0.0077 577 ILE 586 CB 0.0002 -0.0091 -0.0062 578 ILE 586 CG1 -0.0009 -0.0081 -0.0044 579 ILE 586 CG2 0.0012 -0.0101 -0.0080 580 ILE 586 CD1 -0.0034 -0.0085 -0.0048 581 LYS 587 N -0.0030 -0.0141 -0.0124 582 LYS 587 CA 0.0030 -0.0098 -0.0184 583 LYS 587 C 0.0117 -0.0140 -0.0161 584 LYS 587 O 0.0171 -0.0110 -0.0206 585 LYS 587 CB 0.0060 -0.0047 -0.0243 586 LYS 587 CG -0.0029 -0.0001 -0.0270 587 LYS 587 CD -0.0007 0.0058 -0.0337 588 LYS 587 CE 0.0021 0.0115 -0.0404 589 LYS 587 NZ 0.0016 0.0179 -0.0469 590 ALA 588 N 0.0087 -0.0129 -0.0119 591 ALA 588 CA 0.0120 -0.0128 -0.0105 592 ALA 588 C 0.0158 -0.0133 -0.0101 593 ALA 588 O 0.0169 -0.0122 -0.0072 594 ALA 588 CB 0.0111 -0.0111 -0.0068 595 SER 589 N 0.0192 -0.0156 -0.0152 596 SER 589 CA 0.0215 -0.0165 -0.0145 597 SER 589 C 0.0249 -0.0178 -0.0112 598 SER 589 O 0.0259 -0.0181 -0.0092 599 SER 589 CB 0.0230 -0.0173 -0.0187 600 SER 589 OG 0.0260 -0.0185 -0.0202 601 SER 590 N 0.0272 -0.0198 -0.0123 602 SER 590 CA 0.0307 -0.0219 -0.0092 603 SER 590 C 0.0293 -0.0211 -0.0042 604 SER 590 O 0.0320 -0.0227 -0.0010 605 SER 590 CB 0.0337 -0.0236 -0.0113 606 SER 590 OG 0.0320 -0.0226 -0.0114 607 GLU 591 N 0.0228 -0.0156 -0.0045 608 GLU 591 CA 0.0214 -0.0135 0.0007 609 GLU 591 C 0.0218 -0.0133 0.0014 610 GLU 591 O 0.0208 -0.0116 0.0055 611 GLU 591 CB 0.0157 -0.0122 0.0016 612 GLU 591 CG 0.0155 -0.0122 0.0013 613 GLU 591 CD 0.0101 -0.0111 0.0019 614 GLU 591 OE1 0.0064 -0.0098 0.0038 615 GLU 591 OE2 0.0096 -0.0115 0.0005 616 ARG 592 N 0.0225 -0.0180 -0.0019 617 ARG 592 CA 0.0214 -0.0174 0.0007 618 ARG 592 C 0.0236 -0.0199 0.0033 619 ARG 592 O 0.0261 -0.0222 0.0023 620 ARG 592 CB 0.0209 -0.0165 -0.0018 621 ARG 592 CG 0.0186 -0.0138 -0.0044 622 ARG 592 CD 0.0180 -0.0129 -0.0070 623 ARG 592 NE 0.0162 -0.0107 -0.0099 624 ARG 592 CZ 0.0160 -0.0101 -0.0133 625 ARG 592 NH1 0.0175 -0.0114 -0.0143 626 ARG 592 NH2 0.0145 -0.0082 -0.0159 627 HIS 593 N 0.0188 -0.0188 0.0054 628 HIS 593 CA 0.0201 -0.0214 0.0080 629 HIS 593 C 0.0194 -0.0207 0.0080 630 HIS 593 O 0.0169 -0.0185 0.0087 631 HIS 593 CB 0.0190 -0.0222 0.0119 632 SER 594 N 0.0247 -0.0292 0.0110 633 SER 594 CA 0.0245 -0.0289 0.0109 634 SER 594 C 0.0224 -0.0250 0.0074 635 SER 594 O 0.0205 -0.0233 0.0083 636 SER 594 CB 0.0228 -0.0296 0.0160 637 SER 594 OG 0.0246 -0.0331 0.0191 638 GLY 595 N 0.0217 -0.0220 0.0038 639 GLY 595 CA 0.0199 -0.0188 -0.0001 640 GLY 595 C 0.0160 -0.0151 0.0012 641 GLY 595 O 0.0143 -0.0123 -0.0018 642 GLU 596 N 0.0122 -0.0134 0.0031 643 GLU 596 CA 0.0092 -0.0109 0.0042 644 GLU 596 C 0.0104 -0.0110 0.0031 645 GLU 596 O 0.0121 -0.0144 0.0037 646 GLU 596 CB 0.0061 -0.0125 0.0082 647 GLU 596 CG 0.0041 -0.0117 0.0097 648 GLU 596 CD 0.0015 -0.0139 0.0136 649 GLU 596 OE1 0.0025 -0.0174 0.0152 650 GLU 596 OE2 -0.0014 -0.0120 0.0152 651 LEU 597 N 0.0085 -0.0072 0.0022 652 LEU 597 CA 0.0080 -0.0068 0.0022 653 LEU 597 C 0.0067 -0.0069 0.0043 654 LEU 597 O 0.0055 -0.0063 0.0050 655 LEU 597 CB 0.0071 -0.0050 0.0007 656 LEU 597 CG 0.0063 -0.0043 0.0008 657 LEU 597 CD1 0.0076 -0.0050 0.0001 658 LEU 597 CD2 0.0051 -0.0026 -0.0004 659 MET 598 N 0.0057 -0.0065 0.0044 660 MET 598 CA 0.0059 -0.0055 0.0052 661 MET 598 C 0.0057 -0.0040 0.0044 662 MET 598 O 0.0053 -0.0039 0.0031 663 MET 598 CB 0.0059 -0.0062 0.0051 664 MET 598 CG 0.0061 -0.0053 0.0059 665 MET 598 SD 0.0059 -0.0050 0.0049 666 MET 598 CE 0.0055 -0.0034 0.0038 667 LEU 599 N 0.0021 -0.0027 0.0029 668 LEU 599 CA 0.0031 -0.0034 0.0028 669 LEU 599 C 0.0028 -0.0042 0.0020 670 LEU 599 O 0.0020 -0.0041 0.0017 671 LEU 599 CB 0.0036 -0.0031 0.0033 672 LEU 599 CG 0.0039 -0.0022 0.0042 673 LEU 599 CD1 0.0044 -0.0020 0.0047 674 LEU 599 CD2 0.0047 -0.0023 0.0045 675 LEU 600 N 0.0006 -0.0031 -0.0004 676 LEU 600 CA 0.0014 -0.0047 -0.0037 677 LEU 600 C 0.0048 -0.0064 -0.0029 678 LEU 600 O 0.0064 -0.0068 -0.0016 679 LEU 600 CB 0.0005 -0.0051 -0.0062 680 LEU 600 CG 0.0012 -0.0067 -0.0095 681 LEU 600 CD1 -0.0005 -0.0062 -0.0110 682 LEU 600 CD2 0.0007 -0.0072 -0.0118 683 VAL 601 N 0.0037 -0.0075 -0.0063 684 VAL 601 CA 0.0073 -0.0094 -0.0053 685 VAL 601 C 0.0085 -0.0119 -0.0085 686 VAL 601 O 0.0065 -0.0120 -0.0114 687 VAL 601 CB 0.0078 -0.0083 -0.0023 688 VAL 601 CG1 0.0065 -0.0058 0.0010 689 VAL 601 CG2 0.0060 -0.0079 -0.0039 690 ARG 602 N 0.0130 -0.0133 -0.0096 691 ARG 602 CA 0.0156 -0.0176 -0.0142 692 ARG 602 C 0.0188 -0.0178 -0.0112 693 ARG 602 O 0.0235 -0.0182 -0.0066 694 ARG 602 CB 0.0201 -0.0216 -0.0162 695 ARG 602 CG 0.0223 -0.0261 -0.0216 696 ARG 602 CD 0.0268 -0.0300 -0.0234 697 ARG 602 NE 0.0235 -0.0301 -0.0272 698 ARG 602 CZ 0.0234 -0.0288 -0.0251 699 ARG 602 NH1 0.0264 -0.0273 -0.0192 700 ARG 602 NH2 0.0203 -0.0291 -0.0289 701 PRO 603 N 0.0160 -0.0198 -0.0154 702 PRO 603 CA 0.0179 -0.0197 -0.0138 703 PRO 603 C 0.0223 -0.0229 -0.0142 704 PRO 603 O 0.0232 -0.0256 -0.0170 705 PRO 603 CB 0.0147 -0.0198 -0.0165 706 PRO 603 CG 0.0105 -0.0182 -0.0179 707 PRO 603 CD 0.0119 -0.0197 -0.0187 708 ASN 604 N 0.0217 -0.0273 -0.0149 709 ASN 604 CA 0.0251 -0.0324 -0.0139 710 ASN 604 C 0.0252 -0.0363 -0.0189 711 ASN 604 O 0.0229 -0.0351 -0.0227 712 ASN 604 CB 0.0274 -0.0330 -0.0096 713 ASN 604 CG 0.0264 -0.0322 -0.0108 714 ASN 604 ND2 0.0285 -0.0329 -0.0071 715 ASN 604 OD1 0.0238 -0.0308 -0.0148