USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 75 ASN : amide:sc= 0.892 X(o=1.7,f=1.4) USER MOD Set 1.2: A 104 ASN : amide:sc= 0.788 X(o=1.7,f=1.4) USER MOD Set 2.1: A 6 THR OG1 : rot -160:sc= 0.523 USER MOD Set 2.2: A 29 LYS NZ :NH3+ -139:sc= 0.628 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 149:sc= -0.0842 (180deg=-0.569) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 TYR OH : rot 30:sc= -0.0356 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 51:sc= 0.0509 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -160:sc= 0.418 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 164:sc= -0.056 (180deg=-0.469) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= 0.283 X(o=0.28,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot -38:sc= -0.579 USER MOD Single : A 34 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000369) USER MOD Single : A 37 LYS NZ :NH3+ -136:sc= 1.25 (180deg=-0.605) USER MOD Single : A 39 SER OG : rot 24:sc= 0.0104 USER MOD Single : A 42 THR OG1 : rot 101:sc= 0.0259 USER MOD Single : A 47 MET CE :methyl 160:sc= -0.0343 (180deg=-0.408) USER MOD Single : A 48 TYR OH : rot -100:sc= 0.0506 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -88:sc= 1.27 USER MOD Single : A 51 SER OG : rot -31:sc= 0.0049 USER MOD Single : A 57 GLN : amide:sc= 1.18 K(o=1.2,f=0.059) USER MOD Single : A 59 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 61 ASN : amide:sc= 0.781 K(o=0.78,f=-0.42) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.971 K(o=0.97,f=-0.25) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 74 TYR OH : rot 180:sc=-0.00269 USER MOD Single : A 76 ASN : amide:sc= 0.767 K(o=0.77,f=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 100:sc= 1.48 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 4:sc= 0.666 USER MOD Single : A 96 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.00311) USER MOD Single : A 97 THR OG1 : rot 169:sc= 1.2 USER MOD Single : A 101 GLN : amide:sc= 0.393 X(o=0.39,f=0) USER MOD Single : A 102 MET CE :methyl -174:sc= -0.0942 (180deg=-0.153) USER MOD Single : A 103 LYS NZ :NH3+ -143:sc= 0 (180deg=-1.28) USER MOD Single : A 105 TYR OH : rot -11:sc= 1.17 USER MOD Single : A 111 SER OG : rot -83:sc= 0.657 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0.119 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.153 USER MOD Single : A 119 ASN : amide:sc= -0.86 X(o=-0.86,f=-0.85) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0389) USER MOD Single : A 123 TYR OH : rot 130:sc= -0.207 USER MOD Single : A 125 SER OG : rot -14:sc= 0.0951 USER MOD Single : A 126 HIS : no HD1:sc= -2.28 X(o=-2.3,f=-2.6!) USER MOD Single : A 128 ASN : amide:sc= 0.764 K(o=0.76,f=-0.05) USER MOD Single : A 135 ASN : amide:sc= 0.301 X(o=0.3,f=-0.16) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -174:sc= 1.34 (180deg=1.22) USER MOD Single : A 150 SER OG : rot -46:sc= 0.591 USER MOD Single : A 151 LYS NZ :NH3+ 179:sc= 0.324 (180deg=0.311) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.491 -24.174 -3.483 1.00 2.33 N ATOM 2 CA GLY A 1 -10.370 -24.897 -2.865 1.00 65.10 C ATOM 3 C GLY A 1 -9.178 -23.974 -2.668 1.00 22.43 C ATOM 4 O GLY A 1 -9.100 -23.268 -1.664 1.00 32.24 O ATOM 0 H1 GLY A 1 -12.295 -24.822 -3.609 1.00 2.33 H new ATOM 0 H2 GLY A 1 -11.776 -23.384 -2.869 1.00 2.33 H new ATOM 0 H3 GLY A 1 -11.197 -23.803 -4.409 1.00 2.33 H new ATOM 0 HA2 GLY A 1 -10.681 -25.307 -1.904 1.00 65.10 H new ATOM 0 HA3 GLY A 1 -10.083 -25.740 -3.494 1.00 65.10 H new ATOM 8 N MET A 2 -8.223 -23.986 -3.599 1.00 63.10 N ATOM 9 CA MET A 2 -7.132 -23.021 -3.640 1.00 51.13 C ATOM 10 C MET A 2 -7.727 -21.658 -3.996 1.00 52.30 C ATOM 11 O MET A 2 -8.322 -21.521 -5.065 1.00 44.34 O ATOM 12 CB MET A 2 -6.074 -23.446 -4.671 1.00 4.21 C ATOM 13 CG MET A 2 -5.286 -24.674 -4.203 1.00 64.52 C ATOM 14 SD MET A 2 -4.060 -25.259 -5.405 1.00 54.14 S ATOM 15 CE MET A 2 -3.228 -26.513 -4.395 1.00 54.30 C ATOM 0 H MET A 2 -8.188 -24.674 -4.351 1.00 63.10 H new ATOM 0 HA MET A 2 -6.635 -22.969 -2.672 1.00 51.13 H new ATOM 0 HB2 MET A 2 -6.560 -23.666 -5.621 1.00 4.21 H new ATOM 0 HB3 MET A 2 -5.387 -22.619 -4.849 1.00 4.21 H new ATOM 0 HG2 MET A 2 -4.779 -24.434 -3.268 1.00 64.52 H new ATOM 0 HG3 MET A 2 -5.985 -25.482 -3.988 1.00 64.52 H new ATOM 0 HE1 MET A 2 -2.435 -26.982 -4.978 1.00 54.30 H new ATOM 0 HE2 MET A 2 -2.798 -26.042 -3.511 1.00 54.30 H new ATOM 0 HE3 MET A 2 -3.949 -27.270 -4.088 1.00 54.30 H new ATOM 23 N ALA A 3 -7.607 -20.672 -3.108 1.00 33.21 N ATOM 24 CA ALA A 3 -7.823 -19.257 -3.369 1.00 50.23 C ATOM 25 C ALA A 3 -6.994 -18.480 -2.351 1.00 73.14 C ATOM 26 O ALA A 3 -7.438 -18.263 -1.225 1.00 62.52 O ATOM 27 CB ALA A 3 -9.306 -18.870 -3.301 1.00 64.53 C ATOM 0 H ALA A 3 -7.343 -20.852 -2.139 1.00 33.21 H new ATOM 0 HA ALA A 3 -7.510 -19.016 -4.385 1.00 50.23 H new ATOM 0 HB1 ALA A 3 -9.414 -17.804 -3.503 1.00 64.53 H new ATOM 0 HB2 ALA A 3 -9.865 -19.438 -4.044 1.00 64.53 H new ATOM 0 HB3 ALA A 3 -9.695 -19.092 -2.307 1.00 64.53 H new ATOM 33 N LYS A 4 -5.764 -18.122 -2.727 1.00 21.13 N ATOM 34 CA LYS A 4 -4.950 -17.139 -2.021 1.00 13.04 C ATOM 35 C LYS A 4 -3.952 -16.511 -2.985 1.00 54.11 C ATOM 36 O LYS A 4 -3.370 -17.223 -3.799 1.00 32.31 O ATOM 37 CB LYS A 4 -4.264 -17.751 -0.790 1.00 21.15 C ATOM 38 CG LYS A 4 -3.039 -18.656 -1.008 1.00 11.25 C ATOM 39 CD LYS A 4 -3.282 -19.989 -1.748 1.00 44.02 C ATOM 40 CE LYS A 4 -2.873 -20.048 -3.233 1.00 43.14 C ATOM 41 NZ LYS A 4 -1.490 -19.579 -3.477 1.00 64.22 N ATOM 0 H LYS A 4 -5.301 -18.516 -3.546 1.00 21.13 H new ATOM 0 HA LYS A 4 -5.600 -16.350 -1.643 1.00 13.04 H new ATOM 0 HB2 LYS A 4 -3.960 -16.932 -0.138 1.00 21.15 H new ATOM 0 HB3 LYS A 4 -5.011 -18.329 -0.247 1.00 21.15 H new ATOM 0 HG2 LYS A 4 -2.293 -18.089 -1.565 1.00 11.25 H new ATOM 0 HG3 LYS A 4 -2.606 -18.882 -0.034 1.00 11.25 H new ATOM 0 HD2 LYS A 4 -2.744 -20.775 -1.217 1.00 44.02 H new ATOM 0 HD3 LYS A 4 -4.344 -20.226 -1.679 1.00 44.02 H new ATOM 0 HE2 LYS A 4 -2.970 -21.074 -3.589 1.00 43.14 H new ATOM 0 HE3 LYS A 4 -3.564 -19.441 -3.818 1.00 43.14 H new ATOM 0 HZ1 LYS A 4 -1.089 -20.089 -4.290 1.00 64.22 H new ATOM 0 HZ2 LYS A 4 -1.500 -18.559 -3.679 1.00 64.22 H new ATOM 0 HZ3 LYS A 4 -0.908 -19.760 -2.634 1.00 64.22 H new ATOM 51 N LYS A 5 -3.731 -15.201 -2.905 1.00 22.12 N ATOM 52 CA LYS A 5 -2.765 -14.470 -3.724 1.00 65.24 C ATOM 53 C LYS A 5 -2.222 -13.296 -2.945 1.00 63.43 C ATOM 54 O LYS A 5 -2.723 -12.944 -1.875 1.00 52.04 O ATOM 55 CB LYS A 5 -3.365 -13.919 -5.027 1.00 54.12 C ATOM 56 CG LYS A 5 -4.058 -14.957 -5.891 1.00 50.20 C ATOM 57 CD LYS A 5 -4.318 -14.435 -7.316 1.00 5.45 C ATOM 58 CE LYS A 5 -3.490 -15.291 -8.273 1.00 24.22 C ATOM 59 NZ LYS A 5 -3.541 -14.850 -9.679 1.00 0.04 N ATOM 0 H LYS A 5 -4.233 -14.601 -2.250 1.00 22.12 H new ATOM 0 HA LYS A 5 -1.985 -15.187 -3.981 1.00 65.24 H new ATOM 0 HB2 LYS A 5 -4.081 -13.135 -4.779 1.00 54.12 H new ATOM 0 HB3 LYS A 5 -2.570 -13.453 -5.609 1.00 54.12 H new ATOM 0 HG2 LYS A 5 -3.445 -15.857 -5.940 1.00 50.20 H new ATOM 0 HG3 LYS A 5 -5.004 -15.241 -5.430 1.00 50.20 H new ATOM 0 HD2 LYS A 5 -5.378 -14.500 -7.562 1.00 5.45 H new ATOM 0 HD3 LYS A 5 -4.036 -13.385 -7.398 1.00 5.45 H new ATOM 0 HE2 LYS A 5 -2.452 -15.287 -7.940 1.00 24.22 H new ATOM 0 HE3 LYS A 5 -3.839 -16.322 -8.215 1.00 24.22 H new ATOM 0 HZ1 LYS A 5 -2.955 -15.481 -10.262 1.00 0.04 H new ATOM 0 HZ2 LYS A 5 -4.524 -14.880 -10.017 1.00 0.04 H new ATOM 0 HZ3 LYS A 5 -3.180 -13.877 -9.751 1.00 0.04 H new ATOM 69 N THR A 6 -1.219 -12.653 -3.517 1.00 25.32 N ATOM 70 CA THR A 6 -0.543 -11.511 -2.930 1.00 53.10 C ATOM 71 C THR A 6 -0.105 -10.554 -4.040 1.00 74.33 C ATOM 72 O THR A 6 0.754 -10.887 -4.857 1.00 54.03 O ATOM 73 CB THR A 6 0.602 -12.035 -2.063 1.00 53.13 C ATOM 74 OG1 THR A 6 0.083 -12.851 -1.023 1.00 21.14 O ATOM 75 CG2 THR A 6 1.436 -10.933 -1.413 1.00 52.00 C ATOM 0 H THR A 6 -0.843 -12.919 -4.427 1.00 25.32 H new ATOM 0 HA THR A 6 -1.199 -10.930 -2.281 1.00 53.10 H new ATOM 0 HB THR A 6 1.251 -12.594 -2.737 1.00 53.13 H new ATOM 0 HG1 THR A 6 0.744 -12.923 -0.303 1.00 21.14 H new ATOM 0 HG21 THR A 6 2.228 -11.382 -0.814 1.00 52.00 H new ATOM 0 HG22 THR A 6 1.877 -10.306 -2.188 1.00 52.00 H new ATOM 0 HG23 THR A 6 0.798 -10.324 -0.773 1.00 52.00 H new ATOM 83 N LEU A 7 -0.750 -9.386 -4.096 1.00 72.53 N ATOM 84 CA LEU A 7 -0.365 -8.267 -4.970 1.00 25.15 C ATOM 85 C LEU A 7 0.483 -7.237 -4.198 1.00 32.54 C ATOM 86 O LEU A 7 0.357 -7.125 -2.976 1.00 41.32 O ATOM 87 CB LEU A 7 -1.665 -7.670 -5.524 1.00 21.14 C ATOM 88 CG LEU A 7 -1.545 -6.571 -6.588 1.00 33.24 C ATOM 89 CD1 LEU A 7 -0.665 -6.941 -7.791 1.00 30.25 C ATOM 90 CD2 LEU A 7 -2.965 -6.257 -7.089 1.00 74.13 C ATOM 0 H LEU A 7 -1.571 -9.184 -3.525 1.00 72.53 H new ATOM 0 HA LEU A 7 0.264 -8.601 -5.795 1.00 25.15 H new ATOM 0 HB2 LEU A 7 -2.255 -8.483 -5.946 1.00 21.14 H new ATOM 0 HB3 LEU A 7 -2.233 -7.266 -4.686 1.00 21.14 H new ATOM 0 HG LEU A 7 -1.059 -5.717 -6.117 1.00 33.24 H new ATOM 0 HD11 LEU A 7 -0.637 -6.107 -8.492 1.00 30.25 H new ATOM 0 HD12 LEU A 7 0.346 -7.161 -7.448 1.00 30.25 H new ATOM 0 HD13 LEU A 7 -1.079 -7.818 -8.288 1.00 30.25 H new ATOM 0 HD21 LEU A 7 -2.918 -5.477 -7.849 1.00 74.13 H new ATOM 0 HD22 LEU A 7 -3.407 -7.156 -7.518 1.00 74.13 H new ATOM 0 HD23 LEU A 7 -3.578 -5.915 -6.255 1.00 74.13 H new ATOM 101 N ILE A 8 1.335 -6.473 -4.894 1.00 30.45 N ATOM 102 CA ILE A 8 2.167 -5.412 -4.324 1.00 10.24 C ATOM 103 C ILE A 8 1.942 -4.157 -5.185 1.00 64.33 C ATOM 104 O ILE A 8 2.061 -4.234 -6.411 1.00 65.43 O ATOM 105 CB ILE A 8 3.656 -5.847 -4.283 1.00 72.54 C ATOM 106 CG1 ILE A 8 3.906 -7.217 -3.601 1.00 64.24 C ATOM 107 CG2 ILE A 8 4.492 -4.777 -3.581 1.00 44.02 C ATOM 108 CD1 ILE A 8 5.354 -7.720 -3.726 1.00 73.44 C ATOM 0 H ILE A 8 1.466 -6.582 -5.900 1.00 30.45 H new ATOM 0 HA ILE A 8 1.893 -5.200 -3.291 1.00 10.24 H new ATOM 0 HB ILE A 8 3.956 -5.963 -5.324 1.00 72.54 H new ATOM 0 HG12 ILE A 8 3.649 -7.138 -2.545 1.00 64.24 H new ATOM 0 HG13 ILE A 8 3.236 -7.957 -4.038 1.00 64.24 H new ATOM 0 HG21 ILE A 8 5.536 -5.089 -3.556 1.00 44.02 H new ATOM 0 HG22 ILE A 8 4.408 -3.835 -4.124 1.00 44.02 H new ATOM 0 HG23 ILE A 8 4.129 -4.642 -2.562 1.00 44.02 H new ATOM 0 HD11 ILE A 8 5.449 -8.683 -3.224 1.00 73.44 H new ATOM 0 HD12 ILE A 8 5.610 -7.833 -4.779 1.00 73.44 H new ATOM 0 HD13 ILE A 8 6.030 -7.001 -3.263 1.00 73.44 H new ATOM 119 N LEU A 9 1.584 -3.020 -4.572 1.00 33.54 N ATOM 120 CA LEU A 9 1.110 -1.792 -5.218 1.00 63.52 C ATOM 121 C LEU A 9 1.776 -0.562 -4.576 1.00 54.22 C ATOM 122 O LEU A 9 1.248 -0.032 -3.599 1.00 2.35 O ATOM 123 CB LEU A 9 -0.428 -1.657 -5.065 1.00 74.30 C ATOM 124 CG LEU A 9 -1.286 -2.810 -5.604 1.00 13.40 C ATOM 125 CD1 LEU A 9 -2.720 -2.743 -5.074 1.00 54.14 C ATOM 126 CD2 LEU A 9 -1.333 -2.807 -7.129 1.00 70.21 C ATOM 0 H LEU A 9 1.620 -2.929 -3.557 1.00 33.54 H new ATOM 0 HA LEU A 9 1.370 -1.846 -6.275 1.00 63.52 H new ATOM 0 HB2 LEU A 9 -0.653 -1.534 -4.006 1.00 74.30 H new ATOM 0 HB3 LEU A 9 -0.739 -0.740 -5.566 1.00 74.30 H new ATOM 0 HG LEU A 9 -0.814 -3.729 -5.256 1.00 13.40 H new ATOM 0 HD11 LEU A 9 -3.296 -3.575 -5.478 1.00 54.14 H new ATOM 0 HD12 LEU A 9 -2.709 -2.803 -3.986 1.00 54.14 H new ATOM 0 HD13 LEU A 9 -3.178 -1.802 -5.381 1.00 54.14 H new ATOM 0 HD21 LEU A 9 -1.949 -3.637 -7.476 1.00 70.21 H new ATOM 0 HD22 LEU A 9 -1.761 -1.867 -7.478 1.00 70.21 H new ATOM 0 HD23 LEU A 9 -0.323 -2.915 -7.524 1.00 70.21 H new ATOM 137 N TYR A 10 2.896 -0.048 -5.103 1.00 72.53 N ATOM 138 CA TYR A 10 3.570 1.119 -4.495 1.00 53.13 C ATOM 139 C TYR A 10 3.519 2.355 -5.396 1.00 50.13 C ATOM 140 O TYR A 10 3.260 2.238 -6.597 1.00 41.44 O ATOM 141 CB TYR A 10 5.003 0.778 -4.031 1.00 12.34 C ATOM 142 CG TYR A 10 6.137 0.832 -5.031 1.00 62.21 C ATOM 143 CD1 TYR A 10 5.935 0.731 -6.421 1.00 74.34 C ATOM 144 CD2 TYR A 10 7.444 0.968 -4.530 1.00 52.23 C ATOM 145 CE1 TYR A 10 7.006 0.898 -7.312 1.00 60.54 C ATOM 146 CE2 TYR A 10 8.505 1.166 -5.424 1.00 0.21 C ATOM 147 CZ TYR A 10 8.302 1.135 -6.815 1.00 73.54 C ATOM 148 OH TYR A 10 9.363 1.275 -7.655 1.00 1.22 O ATOM 0 H TYR A 10 3.354 -0.413 -5.938 1.00 72.53 H new ATOM 0 HA TYR A 10 3.008 1.379 -3.598 1.00 53.13 H new ATOM 0 HB2 TYR A 10 5.253 1.456 -3.215 1.00 12.34 H new ATOM 0 HB3 TYR A 10 4.982 -0.229 -3.614 1.00 12.34 H new ATOM 0 HD1 TYR A 10 4.947 0.523 -6.805 1.00 74.34 H new ATOM 0 HD2 TYR A 10 7.628 0.920 -3.467 1.00 52.23 H new ATOM 0 HE1 TYR A 10 6.837 0.845 -8.377 1.00 60.54 H new ATOM 0 HE2 TYR A 10 9.497 1.346 -5.037 1.00 0.21 H new ATOM 0 HH TYR A 10 9.059 1.655 -8.505 1.00 1.22 H new ATOM 157 N TYR A 11 3.823 3.528 -4.841 1.00 72.21 N ATOM 158 CA TYR A 11 4.095 4.758 -5.571 1.00 51.00 C ATOM 159 C TYR A 11 5.587 5.042 -5.443 1.00 20.44 C ATOM 160 O TYR A 11 6.061 5.357 -4.351 1.00 64.24 O ATOM 161 CB TYR A 11 3.253 5.916 -5.013 1.00 31.52 C ATOM 162 CG TYR A 11 3.718 7.308 -5.424 1.00 42.32 C ATOM 163 CD1 TYR A 11 4.117 7.585 -6.749 1.00 0.42 C ATOM 164 CD2 TYR A 11 3.771 8.335 -4.464 1.00 73.35 C ATOM 165 CE1 TYR A 11 4.558 8.871 -7.108 1.00 15.01 C ATOM 166 CE2 TYR A 11 4.170 9.632 -4.823 1.00 73.33 C ATOM 167 CZ TYR A 11 4.573 9.902 -6.146 1.00 55.31 C ATOM 168 OH TYR A 11 4.953 11.164 -6.468 1.00 0.21 O ATOM 0 H TYR A 11 3.888 3.648 -3.830 1.00 72.21 H new ATOM 0 HA TYR A 11 3.825 4.653 -6.622 1.00 51.00 H new ATOM 0 HB2 TYR A 11 2.221 5.784 -5.337 1.00 31.52 H new ATOM 0 HB3 TYR A 11 3.255 5.855 -3.925 1.00 31.52 H new ATOM 0 HD1 TYR A 11 4.083 6.803 -7.493 1.00 0.42 H new ATOM 0 HD2 TYR A 11 3.502 8.123 -3.440 1.00 73.35 H new ATOM 0 HE1 TYR A 11 4.885 9.069 -8.118 1.00 15.01 H new ATOM 0 HE2 TYR A 11 4.168 10.422 -4.086 1.00 73.33 H new ATOM 0 HH TYR A 11 4.897 11.735 -5.674 1.00 0.21 H new ATOM 177 N SER A 12 6.338 4.905 -6.535 1.00 33.23 N ATOM 178 CA SER A 12 7.724 5.332 -6.588 1.00 15.01 C ATOM 179 C SER A 12 7.790 6.851 -6.729 1.00 63.53 C ATOM 180 O SER A 12 7.546 7.376 -7.814 1.00 20.14 O ATOM 181 CB SER A 12 8.483 4.589 -7.691 1.00 74.20 C ATOM 182 OG SER A 12 7.654 4.243 -8.794 1.00 32.31 O ATOM 0 H SER A 12 5.997 4.494 -7.404 1.00 33.23 H new ATOM 0 HA SER A 12 8.224 5.073 -5.655 1.00 15.01 H new ATOM 0 HB2 SER A 12 9.306 5.212 -8.042 1.00 74.20 H new ATOM 0 HB3 SER A 12 8.924 3.683 -7.275 1.00 74.20 H new ATOM 0 HG SER A 12 7.161 5.035 -9.094 1.00 32.31 H new ATOM 187 N TRP A 13 8.135 7.529 -5.627 1.00 42.03 N ATOM 188 CA TRP A 13 8.184 8.980 -5.464 1.00 64.41 C ATOM 189 C TRP A 13 9.025 9.634 -6.564 1.00 64.30 C ATOM 190 O TRP A 13 8.527 10.027 -7.614 1.00 12.43 O ATOM 191 CB TRP A 13 8.722 9.261 -4.057 1.00 22.44 C ATOM 192 CG TRP A 13 8.896 10.696 -3.643 1.00 24.22 C ATOM 193 CD1 TRP A 13 7.901 11.572 -3.379 1.00 41.34 C ATOM 194 CD2 TRP A 13 10.134 11.449 -3.434 1.00 35.33 C ATOM 195 NE1 TRP A 13 8.430 12.756 -2.914 1.00 13.12 N ATOM 196 CE2 TRP A 13 9.805 12.741 -2.931 1.00 4.15 C ATOM 197 CE3 TRP A 13 11.505 11.175 -3.628 1.00 2.22 C ATOM 198 CZ2 TRP A 13 10.782 13.686 -2.587 1.00 45.00 C ATOM 199 CZ3 TRP A 13 12.493 12.133 -3.337 1.00 60.53 C ATOM 200 CH2 TRP A 13 12.135 13.383 -2.808 1.00 53.44 C ATOM 0 H TRP A 13 8.404 7.043 -4.772 1.00 42.03 H new ATOM 0 HA TRP A 13 7.191 9.418 -5.565 1.00 64.41 H new ATOM 0 HB2 TRP A 13 8.051 8.786 -3.342 1.00 22.44 H new ATOM 0 HB3 TRP A 13 9.689 8.767 -3.964 1.00 22.44 H new ATOM 0 HD1 TRP A 13 6.848 11.373 -3.513 1.00 41.34 H new ATOM 0 HE1 TRP A 13 7.870 13.547 -2.596 1.00 13.12 H new ATOM 0 HE3 TRP A 13 11.802 10.209 -4.008 1.00 2.22 H new ATOM 0 HZ2 TRP A 13 10.497 14.635 -2.157 1.00 45.00 H new ATOM 0 HZ3 TRP A 13 13.533 11.906 -3.522 1.00 60.53 H new ATOM 0 HH2 TRP A 13 12.898 14.110 -2.572 1.00 53.44 H new ATOM 210 N SER A 14 10.337 9.689 -6.354 1.00 31.11 N ATOM 211 CA SER A 14 11.302 10.305 -7.250 1.00 54.22 C ATOM 212 C SER A 14 12.640 9.576 -7.052 1.00 44.23 C ATOM 213 O SER A 14 13.684 10.185 -6.803 1.00 75.14 O ATOM 214 CB SER A 14 11.325 11.821 -6.970 1.00 15.21 C ATOM 215 OG SER A 14 11.375 12.555 -8.175 1.00 71.43 O ATOM 0 H SER A 14 10.771 9.289 -5.522 1.00 31.11 H new ATOM 0 HA SER A 14 11.049 10.208 -8.306 1.00 54.22 H new ATOM 0 HB2 SER A 14 10.438 12.104 -6.404 1.00 15.21 H new ATOM 0 HB3 SER A 14 12.189 12.068 -6.353 1.00 15.21 H new ATOM 0 HG SER A 14 11.387 13.514 -7.974 1.00 71.43 H new ATOM 220 N GLY A 15 12.586 8.239 -7.101 1.00 32.41 N ATOM 221 CA GLY A 15 13.760 7.382 -6.977 1.00 41.03 C ATOM 222 C GLY A 15 14.204 7.223 -5.527 1.00 33.12 C ATOM 223 O GLY A 15 15.393 7.312 -5.233 1.00 3.32 O ATOM 0 H GLY A 15 11.716 7.722 -7.229 1.00 32.41 H new ATOM 0 HA2 GLY A 15 13.538 6.401 -7.397 1.00 41.03 H new ATOM 0 HA3 GLY A 15 14.578 7.802 -7.562 1.00 41.03 H new ATOM 227 N GLU A 16 13.254 6.981 -4.620 1.00 2.25 N ATOM 228 CA GLU A 16 13.541 6.516 -3.261 1.00 22.53 C ATOM 229 C GLU A 16 12.857 5.176 -3.049 1.00 55.43 C ATOM 230 O GLU A 16 13.507 4.155 -2.836 1.00 21.45 O ATOM 231 CB GLU A 16 13.040 7.500 -2.196 1.00 32.12 C ATOM 232 CG GLU A 16 13.892 8.774 -2.118 1.00 20.25 C ATOM 233 CD GLU A 16 13.939 9.336 -0.693 1.00 33.41 C ATOM 234 OE1 GLU A 16 12.973 10.007 -0.264 1.00 53.13 O ATOM 235 OE2 GLU A 16 14.933 9.103 0.036 1.00 72.40 O ATOM 0 H GLU A 16 12.259 7.103 -4.809 1.00 2.25 H new ATOM 0 HA GLU A 16 14.623 6.430 -3.156 1.00 22.53 H new ATOM 0 HB2 GLU A 16 12.007 7.771 -2.415 1.00 32.12 H new ATOM 0 HB3 GLU A 16 13.040 7.008 -1.224 1.00 32.12 H new ATOM 0 HG2 GLU A 16 14.905 8.556 -2.457 1.00 20.25 H new ATOM 0 HG3 GLU A 16 13.485 9.527 -2.793 1.00 20.25 H new ATOM 240 N THR A 17 11.531 5.173 -3.182 1.00 0.42 N ATOM 241 CA THR A 17 10.661 4.071 -2.812 1.00 24.42 C ATOM 242 C THR A 17 11.040 2.803 -3.585 1.00 34.33 C ATOM 243 O THR A 17 10.895 1.704 -3.065 1.00 71.31 O ATOM 244 CB THR A 17 9.207 4.497 -3.088 1.00 10.33 C ATOM 245 OG1 THR A 17 9.051 5.915 -3.116 1.00 33.52 O ATOM 246 CG2 THR A 17 8.206 3.862 -2.116 1.00 2.45 C ATOM 0 H THR A 17 11.021 5.969 -3.565 1.00 0.42 H new ATOM 0 HA THR A 17 10.771 3.836 -1.753 1.00 24.42 H new ATOM 0 HB THR A 17 8.979 4.117 -4.084 1.00 10.33 H new ATOM 0 HG1 THR A 17 8.108 6.143 -2.975 1.00 33.52 H new ATOM 0 HG21 THR A 17 7.198 4.199 -2.360 1.00 2.45 H new ATOM 0 HG22 THR A 17 8.256 2.776 -2.200 1.00 2.45 H new ATOM 0 HG23 THR A 17 8.451 4.158 -1.096 1.00 2.45 H new ATOM 254 N LYS A 18 11.590 2.958 -4.799 1.00 1.22 N ATOM 255 CA LYS A 18 12.144 1.908 -5.648 1.00 11.35 C ATOM 256 C LYS A 18 13.099 1.008 -4.866 1.00 72.13 C ATOM 257 O LYS A 18 12.960 -0.211 -4.925 1.00 42.40 O ATOM 258 CB LYS A 18 12.767 2.579 -6.884 1.00 15.42 C ATOM 259 CG LYS A 18 13.587 1.628 -7.772 1.00 32.55 C ATOM 260 CD LYS A 18 13.892 2.200 -9.169 1.00 11.25 C ATOM 261 CE LYS A 18 14.376 3.656 -9.170 1.00 0.14 C ATOM 262 NZ LYS A 18 14.566 4.175 -10.542 1.00 55.20 N ATOM 0 H LYS A 18 11.661 3.878 -5.235 1.00 1.22 H new ATOM 0 HA LYS A 18 11.365 1.230 -5.995 1.00 11.35 H new ATOM 0 HB2 LYS A 18 11.971 3.022 -7.483 1.00 15.42 H new ATOM 0 HB3 LYS A 18 13.410 3.395 -6.555 1.00 15.42 H new ATOM 0 HG2 LYS A 18 14.526 1.395 -7.271 1.00 32.55 H new ATOM 0 HG3 LYS A 18 13.044 0.689 -7.883 1.00 32.55 H new ATOM 0 HD2 LYS A 18 14.651 1.578 -9.644 1.00 11.25 H new ATOM 0 HD3 LYS A 18 12.993 2.129 -9.781 1.00 11.25 H new ATOM 0 HE2 LYS A 18 13.653 4.279 -8.644 1.00 0.14 H new ATOM 0 HE3 LYS A 18 15.316 3.726 -8.622 1.00 0.14 H new ATOM 0 HZ1 LYS A 18 14.893 5.161 -10.498 1.00 55.20 H new ATOM 0 HZ2 LYS A 18 15.275 3.597 -11.037 1.00 55.20 H new ATOM 0 HZ3 LYS A 18 13.664 4.132 -11.057 1.00 55.20 H new ATOM 272 N LYS A 19 14.025 1.575 -4.092 1.00 23.23 N ATOM 273 CA LYS A 19 14.948 0.797 -3.263 1.00 44.33 C ATOM 274 C LYS A 19 14.156 -0.057 -2.267 1.00 43.32 C ATOM 275 O LYS A 19 14.459 -1.231 -2.069 1.00 31.12 O ATOM 276 CB LYS A 19 15.899 1.786 -2.547 1.00 31.32 C ATOM 277 CG LYS A 19 17.352 1.334 -2.329 1.00 63.31 C ATOM 278 CD LYS A 19 17.534 0.075 -1.470 1.00 2.13 C ATOM 279 CE LYS A 19 19.001 -0.055 -1.027 1.00 24.45 C ATOM 280 NZ LYS A 19 19.280 0.604 0.271 1.00 41.31 N ATOM 0 H LYS A 19 14.157 2.584 -4.022 1.00 23.23 H new ATOM 0 HA LYS A 19 15.541 0.114 -3.872 1.00 44.33 H new ATOM 0 HB2 LYS A 19 15.916 2.713 -3.121 1.00 31.32 H new ATOM 0 HB3 LYS A 19 15.469 2.022 -1.573 1.00 31.32 H new ATOM 0 HG2 LYS A 19 17.808 1.156 -3.303 1.00 63.31 H new ATOM 0 HG3 LYS A 19 17.902 2.152 -1.864 1.00 63.31 H new ATOM 0 HD2 LYS A 19 16.885 0.125 -0.596 1.00 2.13 H new ATOM 0 HD3 LYS A 19 17.238 -0.808 -2.037 1.00 2.13 H new ATOM 0 HE2 LYS A 19 19.259 -1.111 -0.954 1.00 24.45 H new ATOM 0 HE3 LYS A 19 19.645 0.378 -1.793 1.00 24.45 H new ATOM 0 HZ1 LYS A 19 20.284 0.481 0.514 1.00 41.31 H new ATOM 0 HZ2 LYS A 19 19.063 1.619 0.199 1.00 41.31 H new ATOM 0 HZ3 LYS A 19 18.689 0.175 1.012 1.00 41.31 H new ATOM 290 N MET A 20 13.127 0.525 -1.649 1.00 13.02 N ATOM 291 CA MET A 20 12.233 -0.119 -0.694 1.00 13.32 C ATOM 292 C MET A 20 11.086 -0.854 -1.405 1.00 30.45 C ATOM 293 O MET A 20 9.945 -0.780 -0.964 1.00 30.24 O ATOM 294 CB MET A 20 11.700 0.947 0.286 1.00 3.25 C ATOM 295 CG MET A 20 11.160 0.330 1.587 1.00 64.32 C ATOM 296 SD MET A 20 12.357 -0.659 2.524 1.00 64.31 S ATOM 297 CE MET A 20 13.621 0.603 2.806 1.00 5.44 C ATOM 0 H MET A 20 12.886 1.503 -1.810 1.00 13.02 H new ATOM 0 HA MET A 20 12.786 -0.875 -0.136 1.00 13.32 H new ATOM 0 HB2 MET A 20 12.499 1.649 0.524 1.00 3.25 H new ATOM 0 HB3 MET A 20 10.908 1.518 -0.198 1.00 3.25 H new ATOM 0 HG2 MET A 20 10.795 1.133 2.227 1.00 64.32 H new ATOM 0 HG3 MET A 20 10.303 -0.299 1.344 1.00 64.32 H new ATOM 0 HE1 MET A 20 14.295 0.273 3.596 1.00 5.44 H new ATOM 0 HE2 MET A 20 14.188 0.762 1.888 1.00 5.44 H new ATOM 0 HE3 MET A 20 13.143 1.536 3.104 1.00 5.44 H new ATOM 305 N ALA A 21 11.348 -1.532 -2.519 1.00 2.24 N ATOM 306 CA ALA A 21 10.352 -2.321 -3.238 1.00 11.23 C ATOM 307 C ALA A 21 10.983 -3.640 -3.664 1.00 31.55 C ATOM 308 O ALA A 21 10.491 -4.714 -3.312 1.00 24.54 O ATOM 309 CB ALA A 21 9.817 -1.542 -4.422 1.00 14.34 C ATOM 0 H ALA A 21 12.271 -1.549 -2.954 1.00 2.24 H new ATOM 0 HA ALA A 21 9.503 -2.536 -2.589 1.00 11.23 H new ATOM 0 HB1 ALA A 21 9.076 -2.143 -4.948 1.00 14.34 H new ATOM 0 HB2 ALA A 21 9.354 -0.620 -4.071 1.00 14.34 H new ATOM 0 HB3 ALA A 21 10.636 -1.302 -5.100 1.00 14.34 H new ATOM 315 N GLU A 22 12.129 -3.543 -4.349 1.00 13.44 N ATOM 316 CA GLU A 22 12.930 -4.680 -4.800 1.00 74.54 C ATOM 317 C GLU A 22 13.222 -5.628 -3.630 1.00 15.34 C ATOM 318 O GLU A 22 13.122 -6.850 -3.766 1.00 73.24 O ATOM 319 CB GLU A 22 14.284 -4.183 -5.351 1.00 44.00 C ATOM 320 CG GLU A 22 14.272 -3.064 -6.405 1.00 21.45 C ATOM 321 CD GLU A 22 15.702 -2.571 -6.671 1.00 41.04 C ATOM 322 OE1 GLU A 22 16.565 -3.394 -7.053 1.00 34.15 O ATOM 323 OE2 GLU A 22 16.027 -1.391 -6.395 1.00 43.33 O ATOM 0 H GLU A 22 12.533 -2.644 -4.611 1.00 13.44 H new ATOM 0 HA GLU A 22 12.367 -5.202 -5.574 1.00 74.54 H new ATOM 0 HB2 GLU A 22 14.881 -3.839 -4.507 1.00 44.00 H new ATOM 0 HB3 GLU A 22 14.803 -5.040 -5.781 1.00 44.00 H new ATOM 0 HG2 GLU A 22 13.828 -3.431 -7.330 1.00 21.45 H new ATOM 0 HG3 GLU A 22 13.652 -2.236 -6.060 1.00 21.45 H new ATOM 328 N LYS A 23 13.547 -5.044 -2.469 1.00 21.53 N ATOM 329 CA LYS A 23 13.835 -5.748 -1.229 1.00 2.42 C ATOM 330 C LYS A 23 12.684 -6.680 -0.875 1.00 65.22 C ATOM 331 O LYS A 23 12.868 -7.883 -0.714 1.00 61.13 O ATOM 332 CB LYS A 23 14.090 -4.729 -0.094 1.00 71.33 C ATOM 333 CG LYS A 23 15.376 -5.068 0.658 1.00 10.43 C ATOM 334 CD LYS A 23 16.600 -4.448 -0.028 1.00 5.44 C ATOM 335 CE LYS A 23 17.850 -5.266 0.296 1.00 22.53 C ATOM 336 NZ LYS A 23 19.074 -4.448 0.356 1.00 24.43 N ATOM 0 H LYS A 23 13.617 -4.031 -2.372 1.00 21.53 H new ATOM 0 HA LYS A 23 14.733 -6.352 -1.359 1.00 2.42 H new ATOM 0 HB2 LYS A 23 14.160 -3.724 -0.510 1.00 71.33 H new ATOM 0 HB3 LYS A 23 13.248 -4.729 0.598 1.00 71.33 H new ATOM 0 HG2 LYS A 23 15.307 -4.704 1.683 1.00 10.43 H new ATOM 0 HG3 LYS A 23 15.495 -6.150 0.711 1.00 10.43 H new ATOM 0 HD2 LYS A 23 16.446 -4.416 -1.107 1.00 5.44 H new ATOM 0 HD3 LYS A 23 16.732 -3.419 0.306 1.00 5.44 H new ATOM 0 HE2 LYS A 23 17.710 -5.770 1.252 1.00 22.53 H new ATOM 0 HE3 LYS A 23 17.975 -6.042 -0.459 1.00 22.53 H new ATOM 0 HZ1 LYS A 23 19.888 -5.056 0.579 1.00 24.43 H new ATOM 0 HZ2 LYS A 23 19.228 -3.986 -0.563 1.00 24.43 H new ATOM 0 HZ3 LYS A 23 18.971 -3.723 1.095 1.00 24.43 H new ATOM 346 N ILE A 24 11.499 -6.090 -0.755 1.00 65.30 N ATOM 347 CA ILE A 24 10.330 -6.726 -0.188 1.00 11.44 C ATOM 348 C ILE A 24 9.886 -7.857 -1.110 1.00 62.40 C ATOM 349 O ILE A 24 9.522 -8.918 -0.614 1.00 62.24 O ATOM 350 CB ILE A 24 9.224 -5.668 0.028 1.00 72.54 C ATOM 351 CG1 ILE A 24 9.701 -4.519 0.952 1.00 10.22 C ATOM 352 CG2 ILE A 24 7.980 -6.337 0.631 1.00 21.21 C ATOM 353 CD1 ILE A 24 8.834 -3.266 0.811 1.00 65.31 C ATOM 0 H ILE A 24 11.328 -5.132 -1.059 1.00 65.30 H new ATOM 0 HA ILE A 24 10.556 -7.161 0.786 1.00 11.44 H new ATOM 0 HB ILE A 24 8.980 -5.235 -0.942 1.00 72.54 H new ATOM 0 HG12 ILE A 24 9.682 -4.857 1.988 1.00 10.22 H new ATOM 0 HG13 ILE A 24 10.736 -4.271 0.716 1.00 10.22 H new ATOM 0 HG21 ILE A 24 7.202 -5.589 0.782 1.00 21.21 H new ATOM 0 HG22 ILE A 24 7.616 -7.107 -0.049 1.00 21.21 H new ATOM 0 HG23 ILE A 24 8.238 -6.790 1.588 1.00 21.21 H new ATOM 0 HD11 ILE A 24 9.207 -2.489 1.478 1.00 65.31 H new ATOM 0 HD12 ILE A 24 8.873 -2.910 -0.219 1.00 65.31 H new ATOM 0 HD13 ILE A 24 7.803 -3.505 1.073 1.00 65.31 H new ATOM 364 N ASN A 25 9.918 -7.655 -2.433 1.00 70.14 N ATOM 365 CA ASN A 25 9.420 -8.670 -3.359 1.00 30.53 C ATOM 366 C ASN A 25 10.203 -9.979 -3.230 1.00 71.34 C ATOM 367 O ASN A 25 9.599 -11.040 -3.310 1.00 24.52 O ATOM 368 CB ASN A 25 9.440 -8.161 -4.808 1.00 71.53 C ATOM 369 CG ASN A 25 8.617 -9.009 -5.790 1.00 15.22 C ATOM 370 OD1 ASN A 25 8.938 -9.070 -6.973 1.00 32.22 O ATOM 371 ND2 ASN A 25 7.517 -9.627 -5.386 1.00 32.52 N ATOM 0 H ASN A 25 10.278 -6.811 -2.878 1.00 70.14 H new ATOM 0 HA ASN A 25 8.384 -8.875 -3.089 1.00 30.53 H new ATOM 0 HB2 ASN A 25 9.064 -7.138 -4.826 1.00 71.53 H new ATOM 0 HB3 ASN A 25 10.473 -8.127 -5.154 1.00 71.53 H new ATOM 0 HD21 ASN A 25 6.948 -10.146 -6.055 1.00 32.52 H new ATOM 0 HD22 ASN A 25 7.239 -9.584 -4.406 1.00 32.52 H new ATOM 377 N SER A 26 11.513 -9.922 -2.970 1.00 31.11 N ATOM 378 CA SER A 26 12.367 -11.061 -2.757 1.00 40.20 C ATOM 379 C SER A 26 12.129 -11.758 -1.415 1.00 61.11 C ATOM 380 O SER A 26 12.508 -12.917 -1.274 1.00 33.51 O ATOM 381 CB SER A 26 13.781 -10.501 -2.767 1.00 1.23 C ATOM 382 OG SER A 26 14.312 -10.352 -4.067 1.00 71.13 O ATOM 0 H SER A 26 12.014 -9.036 -2.902 1.00 31.11 H new ATOM 0 HA SER A 26 12.175 -11.810 -3.525 1.00 40.20 H new ATOM 0 HB2 SER A 26 13.785 -9.532 -2.267 1.00 1.23 H new ATOM 0 HB3 SER A 26 14.430 -11.160 -2.190 1.00 1.23 H new ATOM 0 HG SER A 26 15.220 -9.988 -4.010 1.00 71.13 H new ATOM 387 N GLU A 27 11.583 -11.079 -0.408 1.00 11.32 N ATOM 388 CA GLU A 27 11.178 -11.666 0.862 1.00 21.42 C ATOM 389 C GLU A 27 9.727 -12.162 0.812 1.00 53.34 C ATOM 390 O GLU A 27 9.140 -12.477 1.853 1.00 4.13 O ATOM 391 CB GLU A 27 11.410 -10.607 1.946 1.00 4.02 C ATOM 392 CG GLU A 27 12.893 -10.519 2.316 1.00 70.23 C ATOM 393 CD GLU A 27 13.348 -11.732 3.144 1.00 22.14 C ATOM 394 OE1 GLU A 27 12.839 -11.948 4.268 1.00 45.22 O ATOM 395 OE2 GLU A 27 14.169 -12.536 2.649 1.00 73.34 O ATOM 0 H GLU A 27 11.406 -10.076 -0.458 1.00 11.32 H new ATOM 0 HA GLU A 27 11.772 -12.552 1.089 1.00 21.42 H new ATOM 0 HB2 GLU A 27 11.061 -9.637 1.593 1.00 4.02 H new ATOM 0 HB3 GLU A 27 10.824 -10.853 2.832 1.00 4.02 H new ATOM 0 HG2 GLU A 27 13.491 -10.454 1.407 1.00 70.23 H new ATOM 0 HG3 GLU A 27 13.073 -9.605 2.882 1.00 70.23 H new ATOM 400 N ILE A 28 9.144 -12.239 -0.386 1.00 52.00 N ATOM 401 CA ILE A 28 7.843 -12.819 -0.651 1.00 10.04 C ATOM 402 C ILE A 28 8.057 -13.924 -1.697 1.00 44.20 C ATOM 403 O ILE A 28 9.116 -14.064 -2.317 1.00 32.44 O ATOM 404 CB ILE A 28 6.823 -11.702 -1.030 1.00 33.21 C ATOM 405 CG1 ILE A 28 6.665 -10.710 0.147 1.00 12.05 C ATOM 406 CG2 ILE A 28 5.420 -12.250 -1.358 1.00 31.51 C ATOM 407 CD1 ILE A 28 5.799 -9.479 -0.125 1.00 65.31 C ATOM 0 H ILE A 28 9.592 -11.881 -1.229 1.00 52.00 H new ATOM 0 HA ILE A 28 7.391 -13.288 0.223 1.00 10.04 H new ATOM 0 HB ILE A 28 7.226 -11.218 -1.920 1.00 33.21 H new ATOM 0 HG12 ILE A 28 6.241 -11.248 0.995 1.00 12.05 H new ATOM 0 HG13 ILE A 28 7.657 -10.373 0.447 1.00 12.05 H new ATOM 0 HG21 ILE A 28 4.757 -11.423 -1.614 1.00 31.51 H new ATOM 0 HG22 ILE A 28 5.486 -12.937 -2.202 1.00 31.51 H new ATOM 0 HG23 ILE A 28 5.024 -12.778 -0.491 1.00 31.51 H new ATOM 0 HD11 ILE A 28 5.760 -8.857 0.769 1.00 65.31 H new ATOM 0 HD12 ILE A 28 6.228 -8.906 -0.947 1.00 65.31 H new ATOM 0 HD13 ILE A 28 4.790 -9.795 -0.391 1.00 65.31 H new ATOM 418 N LYS A 29 7.032 -14.755 -1.825 1.00 71.50 N ATOM 419 CA LYS A 29 6.794 -15.762 -2.840 1.00 62.20 C ATOM 420 C LYS A 29 6.609 -15.141 -4.228 1.00 61.22 C ATOM 421 O LYS A 29 6.896 -13.969 -4.456 1.00 12.03 O ATOM 422 CB LYS A 29 5.604 -16.605 -2.340 1.00 74.50 C ATOM 423 CG LYS A 29 4.231 -16.067 -2.766 1.00 3.21 C ATOM 424 CD LYS A 29 3.233 -15.871 -1.637 1.00 1.32 C ATOM 425 CE LYS A 29 1.877 -15.715 -2.319 1.00 1.31 C ATOM 426 NZ LYS A 29 0.771 -15.747 -1.350 1.00 31.25 N ATOM 0 H LYS A 29 6.270 -14.735 -1.148 1.00 71.50 H new ATOM 0 HA LYS A 29 7.655 -16.416 -2.980 1.00 62.20 H new ATOM 0 HB2 LYS A 29 5.714 -17.624 -2.711 1.00 74.50 H new ATOM 0 HB3 LYS A 29 5.641 -16.656 -1.252 1.00 74.50 H new ATOM 0 HG2 LYS A 29 4.374 -15.112 -3.273 1.00 3.21 H new ATOM 0 HG3 LYS A 29 3.800 -16.753 -3.495 1.00 3.21 H new ATOM 0 HD2 LYS A 29 3.236 -16.723 -0.958 1.00 1.32 H new ATOM 0 HD3 LYS A 29 3.478 -14.990 -1.044 1.00 1.32 H new ATOM 0 HE2 LYS A 29 1.852 -14.773 -2.868 1.00 1.31 H new ATOM 0 HE3 LYS A 29 1.744 -16.513 -3.049 1.00 1.31 H new ATOM 0 HZ1 LYS A 29 -0.015 -16.305 -1.739 1.00 31.25 H new ATOM 0 HZ2 LYS A 29 1.098 -16.181 -0.464 1.00 31.25 H new ATOM 0 HZ3 LYS A 29 0.447 -14.777 -1.161 1.00 31.25 H new ATOM 436 N ASP A 30 6.060 -15.941 -5.142 1.00 62.53 N ATOM 437 CA ASP A 30 5.504 -15.607 -6.438 1.00 33.54 C ATOM 438 C ASP A 30 4.337 -14.636 -6.258 1.00 12.42 C ATOM 439 O ASP A 30 3.149 -14.964 -6.217 1.00 10.24 O ATOM 440 CB ASP A 30 5.072 -16.873 -7.184 1.00 32.54 C ATOM 441 CG ASP A 30 4.537 -16.534 -8.574 1.00 24.21 C ATOM 442 OD1 ASP A 30 5.373 -16.266 -9.466 1.00 4.01 O ATOM 443 OD2 ASP A 30 3.304 -16.596 -8.798 1.00 60.14 O ATOM 0 H ASP A 30 5.990 -16.943 -4.966 1.00 62.53 H new ATOM 0 HA ASP A 30 6.268 -15.120 -7.044 1.00 33.54 H new ATOM 0 HB2 ASP A 30 5.919 -17.554 -7.272 1.00 32.54 H new ATOM 0 HB3 ASP A 30 4.304 -17.392 -6.611 1.00 32.54 H new ATOM 447 N SER A 31 4.729 -13.409 -6.001 1.00 2.42 N ATOM 448 CA SER A 31 3.893 -12.224 -5.897 1.00 71.53 C ATOM 449 C SER A 31 4.387 -11.141 -6.841 1.00 71.23 C ATOM 450 O SER A 31 5.589 -10.964 -7.063 1.00 54.11 O ATOM 451 CB SER A 31 3.870 -11.757 -4.451 1.00 65.40 C ATOM 452 OG SER A 31 3.343 -12.829 -3.703 1.00 50.00 O ATOM 0 H SER A 31 5.714 -13.192 -5.847 1.00 2.42 H new ATOM 0 HA SER A 31 2.872 -12.461 -6.195 1.00 71.53 H new ATOM 0 HB2 SER A 31 4.872 -11.498 -4.109 1.00 65.40 H new ATOM 0 HB3 SER A 31 3.255 -10.864 -4.339 1.00 65.40 H new ATOM 0 HG SER A 31 2.628 -13.263 -4.213 1.00 50.00 H new ATOM 457 N GLU A 32 3.427 -10.450 -7.435 1.00 63.32 N ATOM 458 CA GLU A 32 3.641 -9.446 -8.466 1.00 41.21 C ATOM 459 C GLU A 32 4.065 -8.122 -7.833 1.00 73.40 C ATOM 460 O GLU A 32 3.846 -7.926 -6.642 1.00 23.35 O ATOM 461 CB GLU A 32 2.346 -9.269 -9.263 1.00 22.13 C ATOM 462 CG GLU A 32 2.021 -10.474 -10.154 1.00 33.13 C ATOM 463 CD GLU A 32 1.401 -11.698 -9.454 1.00 44.11 C ATOM 464 OE1 GLU A 32 0.898 -11.607 -8.308 1.00 74.13 O ATOM 465 OE2 GLU A 32 1.348 -12.768 -10.102 1.00 61.32 O ATOM 0 H GLU A 32 2.442 -10.577 -7.204 1.00 63.32 H new ATOM 0 HA GLU A 32 4.437 -9.771 -9.136 1.00 41.21 H new ATOM 0 HB2 GLU A 32 1.520 -9.102 -8.571 1.00 22.13 H new ATOM 0 HB3 GLU A 32 2.427 -8.377 -9.884 1.00 22.13 H new ATOM 0 HG2 GLU A 32 1.337 -10.145 -10.936 1.00 33.13 H new ATOM 0 HG3 GLU A 32 2.940 -10.792 -10.647 1.00 33.13 H new ATOM 470 N LEU A 33 4.625 -7.208 -8.631 1.00 21.51 N ATOM 471 CA LEU A 33 5.312 -5.999 -8.166 1.00 42.32 C ATOM 472 C LEU A 33 4.960 -4.821 -9.078 1.00 1.23 C ATOM 473 O LEU A 33 5.628 -4.561 -10.080 1.00 44.13 O ATOM 474 CB LEU A 33 6.829 -6.259 -8.093 1.00 3.45 C ATOM 475 CG LEU A 33 7.615 -5.080 -7.484 1.00 33.54 C ATOM 476 CD1 LEU A 33 7.346 -4.906 -5.986 1.00 15.02 C ATOM 477 CD2 LEU A 33 9.116 -5.268 -7.687 1.00 53.41 C ATOM 0 H LEU A 33 4.613 -7.291 -9.648 1.00 21.51 H new ATOM 0 HA LEU A 33 4.980 -5.739 -7.161 1.00 42.32 H new ATOM 0 HB2 LEU A 33 7.010 -7.155 -7.499 1.00 3.45 H new ATOM 0 HB3 LEU A 33 7.206 -6.460 -9.096 1.00 3.45 H new ATOM 0 HG LEU A 33 7.271 -4.186 -8.004 1.00 33.54 H new ATOM 0 HD11 LEU A 33 7.924 -4.063 -5.608 1.00 15.02 H new ATOM 0 HD12 LEU A 33 6.284 -4.719 -5.826 1.00 15.02 H new ATOM 0 HD13 LEU A 33 7.638 -5.813 -5.456 1.00 15.02 H new ATOM 0 HD21 LEU A 33 9.651 -4.425 -7.250 1.00 53.41 H new ATOM 0 HD22 LEU A 33 9.436 -6.191 -7.203 1.00 53.41 H new ATOM 0 HD23 LEU A 33 9.335 -5.323 -8.753 1.00 53.41 H new ATOM 488 N LYS A 34 3.885 -4.107 -8.753 1.00 44.20 N ATOM 489 CA LYS A 34 3.181 -3.200 -9.667 1.00 43.10 C ATOM 490 C LYS A 34 3.415 -1.752 -9.223 1.00 23.23 C ATOM 491 O LYS A 34 3.511 -1.490 -8.018 1.00 22.54 O ATOM 492 CB LYS A 34 1.696 -3.602 -9.595 1.00 52.13 C ATOM 493 CG LYS A 34 0.823 -3.477 -10.853 1.00 72.13 C ATOM 494 CD LYS A 34 -0.014 -2.190 -10.966 1.00 71.41 C ATOM 495 CE LYS A 34 -1.319 -2.448 -11.737 1.00 55.02 C ATOM 496 NZ LYS A 34 -1.172 -2.483 -13.208 1.00 32.24 N ATOM 0 H LYS A 34 3.466 -4.141 -7.824 1.00 44.20 H new ATOM 0 HA LYS A 34 3.537 -3.271 -10.695 1.00 43.10 H new ATOM 0 HB2 LYS A 34 1.653 -4.641 -9.268 1.00 52.13 H new ATOM 0 HB3 LYS A 34 1.231 -3.002 -8.813 1.00 52.13 H new ATOM 0 HG2 LYS A 34 1.469 -3.545 -11.728 1.00 72.13 H new ATOM 0 HG3 LYS A 34 0.147 -4.331 -10.889 1.00 72.13 H new ATOM 0 HD2 LYS A 34 -0.244 -1.813 -9.970 1.00 71.41 H new ATOM 0 HD3 LYS A 34 0.566 -1.418 -11.473 1.00 71.41 H new ATOM 0 HE2 LYS A 34 -1.739 -3.397 -11.405 1.00 55.02 H new ATOM 0 HE3 LYS A 34 -2.039 -1.672 -11.476 1.00 55.02 H new ATOM 0 HZ1 LYS A 34 -2.101 -2.645 -13.646 1.00 32.24 H new ATOM 0 HZ2 LYS A 34 -0.786 -1.576 -13.540 1.00 32.24 H new ATOM 0 HZ3 LYS A 34 -0.525 -3.253 -13.474 1.00 32.24 H new ATOM 506 N GLU A 35 3.409 -0.769 -10.132 1.00 21.33 N ATOM 507 CA GLU A 35 3.688 0.636 -9.780 1.00 33.42 C ATOM 508 C GLU A 35 2.482 1.557 -10.001 1.00 75.55 C ATOM 509 O GLU A 35 1.651 1.310 -10.876 1.00 62.33 O ATOM 510 CB GLU A 35 4.968 1.157 -10.464 1.00 53.04 C ATOM 511 CG GLU A 35 4.886 1.400 -11.983 1.00 11.33 C ATOM 512 CD GLU A 35 6.067 2.205 -12.552 1.00 62.11 C ATOM 513 OE1 GLU A 35 6.854 2.809 -11.790 1.00 23.12 O ATOM 514 OE2 GLU A 35 6.133 2.372 -13.792 1.00 14.42 O ATOM 0 H GLU A 35 3.213 -0.918 -11.122 1.00 21.33 H new ATOM 0 HA GLU A 35 3.877 0.654 -8.707 1.00 33.42 H new ATOM 0 HB2 GLU A 35 5.255 2.093 -9.984 1.00 53.04 H new ATOM 0 HB3 GLU A 35 5.770 0.443 -10.276 1.00 53.04 H new ATOM 0 HG2 GLU A 35 4.836 0.438 -12.492 1.00 11.33 H new ATOM 0 HG3 GLU A 35 3.959 1.927 -12.207 1.00 11.33 H new ATOM 519 N VAL A 36 2.388 2.626 -9.214 1.00 43.12 N ATOM 520 CA VAL A 36 1.440 3.738 -9.318 1.00 35.31 C ATOM 521 C VAL A 36 2.279 5.011 -9.521 1.00 43.24 C ATOM 522 O VAL A 36 3.439 5.061 -9.103 1.00 61.41 O ATOM 523 CB VAL A 36 0.571 3.831 -8.034 1.00 13.23 C ATOM 524 CG1 VAL A 36 -0.612 4.788 -8.212 1.00 2.31 C ATOM 525 CG2 VAL A 36 -0.021 2.480 -7.607 1.00 22.32 C ATOM 0 H VAL A 36 3.022 2.749 -8.424 1.00 43.12 H new ATOM 0 HA VAL A 36 0.751 3.598 -10.151 1.00 35.31 H new ATOM 0 HB VAL A 36 1.259 4.193 -7.270 1.00 13.23 H new ATOM 0 HG11 VAL A 36 -1.193 4.823 -7.291 1.00 2.31 H new ATOM 0 HG12 VAL A 36 -0.241 5.786 -8.445 1.00 2.31 H new ATOM 0 HG13 VAL A 36 -1.245 4.437 -9.027 1.00 2.31 H new ATOM 0 HG21 VAL A 36 -0.617 2.613 -6.704 1.00 22.32 H new ATOM 0 HG22 VAL A 36 -0.653 2.091 -8.405 1.00 22.32 H new ATOM 0 HG23 VAL A 36 0.787 1.775 -7.408 1.00 22.32 H new ATOM 535 N LYS A 37 1.707 6.045 -10.143 1.00 44.32 N ATOM 536 CA LYS A 37 2.241 7.416 -10.152 1.00 51.01 C ATOM 537 C LYS A 37 1.092 8.369 -9.833 1.00 13.14 C ATOM 538 O LYS A 37 -0.052 7.909 -9.836 1.00 21.32 O ATOM 539 CB LYS A 37 2.875 7.790 -11.503 1.00 41.24 C ATOM 540 CG LYS A 37 3.997 6.878 -12.017 1.00 13.33 C ATOM 541 CD LYS A 37 3.463 5.636 -12.747 1.00 61.14 C ATOM 542 CE LYS A 37 4.515 5.065 -13.693 1.00 31.53 C ATOM 543 NZ LYS A 37 3.975 3.914 -14.443 1.00 4.11 N ATOM 0 H LYS A 37 0.838 5.953 -10.669 1.00 44.32 H new ATOM 0 HA LYS A 37 3.033 7.488 -9.406 1.00 51.01 H new ATOM 0 HB2 LYS A 37 2.085 7.813 -12.254 1.00 41.24 H new ATOM 0 HB3 LYS A 37 3.270 8.803 -11.424 1.00 41.24 H new ATOM 0 HG2 LYS A 37 4.639 7.444 -12.692 1.00 13.33 H new ATOM 0 HG3 LYS A 37 4.617 6.563 -11.178 1.00 13.33 H new ATOM 0 HD2 LYS A 37 3.173 4.878 -12.019 1.00 61.14 H new ATOM 0 HD3 LYS A 37 2.566 5.897 -13.309 1.00 61.14 H new ATOM 0 HE2 LYS A 37 4.842 5.837 -14.389 1.00 31.53 H new ATOM 0 HE3 LYS A 37 5.392 4.756 -13.125 1.00 31.53 H new ATOM 0 HZ1 LYS A 37 4.680 3.149 -14.460 1.00 4.11 H new ATOM 0 HZ2 LYS A 37 3.107 3.575 -13.981 1.00 4.11 H new ATOM 0 HZ3 LYS A 37 3.758 4.206 -15.417 1.00 4.11 H new ATOM 553 N VAL A 38 1.359 9.655 -9.618 1.00 23.22 N ATOM 554 CA VAL A 38 0.348 10.704 -9.468 1.00 22.11 C ATOM 555 C VAL A 38 0.393 11.612 -10.707 1.00 54.02 C ATOM 556 O VAL A 38 0.891 11.204 -11.760 1.00 72.25 O ATOM 557 CB VAL A 38 0.465 11.421 -8.099 1.00 31.33 C ATOM 558 CG1 VAL A 38 0.223 10.441 -6.940 1.00 2.04 C ATOM 559 CG2 VAL A 38 1.801 12.139 -7.865 1.00 20.21 C ATOM 0 H VAL A 38 2.313 10.009 -9.541 1.00 23.22 H new ATOM 0 HA VAL A 38 -0.655 10.279 -9.436 1.00 22.11 H new ATOM 0 HB VAL A 38 -0.309 12.188 -8.127 1.00 31.33 H new ATOM 0 HG11 VAL A 38 0.311 10.971 -5.991 1.00 2.04 H new ATOM 0 HG12 VAL A 38 -0.777 10.015 -7.026 1.00 2.04 H new ATOM 0 HG13 VAL A 38 0.963 9.641 -6.979 1.00 2.04 H new ATOM 0 HG21 VAL A 38 1.793 12.612 -6.883 1.00 20.21 H new ATOM 0 HG22 VAL A 38 2.616 11.416 -7.913 1.00 20.21 H new ATOM 0 HG23 VAL A 38 1.945 12.900 -8.633 1.00 20.21 H new ATOM 569 N SER A 39 -0.217 12.795 -10.656 1.00 1.11 N ATOM 570 CA SER A 39 -0.122 13.799 -11.691 1.00 63.21 C ATOM 571 C SER A 39 1.308 14.360 -11.747 1.00 3.01 C ATOM 572 O SER A 39 2.190 13.983 -10.967 1.00 43.21 O ATOM 573 CB SER A 39 -1.122 14.897 -11.325 1.00 43.33 C ATOM 574 OG SER A 39 -2.276 14.839 -12.122 1.00 51.11 O ATOM 0 H SER A 39 -0.803 13.080 -9.871 1.00 1.11 H new ATOM 0 HA SER A 39 -0.347 13.384 -12.673 1.00 63.21 H new ATOM 0 HB2 SER A 39 -1.400 14.800 -10.276 1.00 43.33 H new ATOM 0 HB3 SER A 39 -0.649 15.872 -11.441 1.00 43.33 H new ATOM 0 HG SER A 39 -2.387 13.930 -12.471 1.00 51.11 H new ATOM 579 N GLU A 40 1.548 15.289 -12.668 1.00 73.54 N ATOM 580 CA GLU A 40 2.770 16.076 -12.654 1.00 73.11 C ATOM 581 C GLU A 40 2.618 17.247 -11.695 1.00 23.40 C ATOM 582 O GLU A 40 1.592 17.939 -11.695 1.00 0.10 O ATOM 583 CB GLU A 40 3.129 16.554 -14.063 1.00 4.11 C ATOM 584 CG GLU A 40 3.819 15.395 -14.786 1.00 71.31 C ATOM 585 CD GLU A 40 4.594 15.787 -16.039 1.00 74.31 C ATOM 586 OE1 GLU A 40 5.161 16.905 -16.100 1.00 75.42 O ATOM 587 OE2 GLU A 40 4.672 14.920 -16.941 1.00 20.51 O ATOM 0 H GLU A 40 0.910 15.513 -13.432 1.00 73.54 H new ATOM 0 HA GLU A 40 3.590 15.448 -12.306 1.00 73.11 H new ATOM 0 HB2 GLU A 40 2.233 16.862 -14.602 1.00 4.11 H new ATOM 0 HB3 GLU A 40 3.787 17.422 -14.016 1.00 4.11 H new ATOM 0 HG2 GLU A 40 4.504 14.909 -14.091 1.00 71.31 H new ATOM 0 HG3 GLU A 40 3.065 14.657 -15.059 1.00 71.31 H new ATOM 592 N GLY A 41 3.673 17.491 -10.913 1.00 64.23 N ATOM 593 CA GLY A 41 3.813 18.686 -10.097 1.00 74.35 C ATOM 594 C GLY A 41 2.884 18.726 -8.887 1.00 74.42 C ATOM 595 O GLY A 41 2.702 19.783 -8.288 1.00 33.42 O ATOM 0 H GLY A 41 4.462 16.850 -10.832 1.00 64.23 H new ATOM 0 HA2 GLY A 41 4.844 18.759 -9.752 1.00 74.35 H new ATOM 0 HA3 GLY A 41 3.622 19.561 -10.718 1.00 74.35 H new ATOM 599 N THR A 42 2.308 17.584 -8.510 1.00 33.10 N ATOM 600 CA THR A 42 1.324 17.452 -7.444 1.00 31.30 C ATOM 601 C THR A 42 1.858 17.944 -6.089 1.00 45.34 C ATOM 602 O THR A 42 1.073 18.401 -5.261 1.00 43.15 O ATOM 603 CB THR A 42 0.914 15.972 -7.414 1.00 73.55 C ATOM 604 OG1 THR A 42 0.534 15.576 -8.720 1.00 53.02 O ATOM 605 CG2 THR A 42 -0.256 15.657 -6.494 1.00 25.34 C ATOM 0 H THR A 42 2.525 16.694 -8.958 1.00 33.10 H new ATOM 0 HA THR A 42 0.458 18.085 -7.638 1.00 31.30 H new ATOM 0 HB THR A 42 1.783 15.434 -7.034 1.00 73.55 H new ATOM 0 HG1 THR A 42 1.267 15.077 -9.137 1.00 53.02 H new ATOM 0 HG21 THR A 42 -0.475 14.590 -6.537 1.00 25.34 H new ATOM 0 HG22 THR A 42 0.000 15.934 -5.471 1.00 25.34 H new ATOM 0 HG23 THR A 42 -1.132 16.221 -6.814 1.00 25.34 H new ATOM 613 N PHE A 43 3.172 17.898 -5.878 1.00 21.34 N ATOM 614 CA PHE A 43 3.885 18.593 -4.809 1.00 53.41 C ATOM 615 C PHE A 43 5.173 19.127 -5.432 1.00 2.23 C ATOM 616 O PHE A 43 5.411 18.920 -6.627 1.00 53.42 O ATOM 617 CB PHE A 43 4.149 17.647 -3.626 1.00 10.11 C ATOM 618 CG PHE A 43 2.877 17.046 -3.056 1.00 21.12 C ATOM 619 CD1 PHE A 43 2.051 17.798 -2.202 1.00 30.14 C ATOM 620 CD2 PHE A 43 2.440 15.788 -3.508 1.00 22.31 C ATOM 621 CE1 PHE A 43 0.791 17.297 -1.827 1.00 61.43 C ATOM 622 CE2 PHE A 43 1.179 15.296 -3.138 1.00 50.05 C ATOM 623 CZ PHE A 43 0.352 16.048 -2.291 1.00 52.33 C ATOM 0 H PHE A 43 3.795 17.352 -6.473 1.00 21.34 H new ATOM 0 HA PHE A 43 3.300 19.416 -4.398 1.00 53.41 H new ATOM 0 HB2 PHE A 43 4.811 16.844 -3.950 1.00 10.11 H new ATOM 0 HB3 PHE A 43 4.671 18.193 -2.840 1.00 10.11 H new ATOM 0 HD1 PHE A 43 2.383 18.758 -1.835 1.00 30.14 H new ATOM 0 HD2 PHE A 43 3.080 15.196 -4.145 1.00 22.31 H new ATOM 0 HE1 PHE A 43 0.156 17.879 -1.176 1.00 61.43 H new ATOM 0 HE2 PHE A 43 0.845 14.337 -3.506 1.00 50.05 H new ATOM 0 HZ PHE A 43 -0.616 15.668 -1.998 1.00 52.33 H new ATOM 632 N ASP A 44 6.027 19.782 -4.648 1.00 54.11 N ATOM 633 CA ASP A 44 7.318 20.279 -5.118 1.00 3.14 C ATOM 634 C ASP A 44 8.405 19.959 -4.102 1.00 31.53 C ATOM 635 O ASP A 44 8.147 19.270 -3.118 1.00 44.12 O ATOM 636 CB ASP A 44 7.257 21.776 -5.446 1.00 44.01 C ATOM 637 CG ASP A 44 8.032 22.001 -6.743 1.00 62.15 C ATOM 638 OD1 ASP A 44 9.266 21.832 -6.773 1.00 35.23 O ATOM 639 OD2 ASP A 44 7.375 22.133 -7.804 1.00 54.02 O ATOM 0 H ASP A 44 5.842 19.984 -3.665 1.00 54.11 H new ATOM 0 HA ASP A 44 7.569 19.769 -6.048 1.00 3.14 H new ATOM 0 HB2 ASP A 44 6.223 22.101 -5.558 1.00 44.01 H new ATOM 0 HB3 ASP A 44 7.690 22.363 -4.636 1.00 44.01 H new ATOM 643 N ALA A 45 9.634 20.402 -4.337 1.00 63.42 N ATOM 644 CA ALA A 45 10.761 20.049 -3.497 1.00 2.35 C ATOM 645 C ALA A 45 10.842 20.868 -2.207 1.00 3.05 C ATOM 646 O ALA A 45 11.555 20.438 -1.300 1.00 32.55 O ATOM 647 CB ALA A 45 12.050 20.211 -4.300 1.00 24.35 C ATOM 0 H ALA A 45 9.873 21.016 -5.116 1.00 63.42 H new ATOM 0 HA ALA A 45 10.621 19.013 -3.190 1.00 2.35 H new ATOM 0 HB1 ALA A 45 12.903 19.947 -3.675 1.00 24.35 H new ATOM 0 HB2 ALA A 45 12.021 19.556 -5.170 1.00 24.35 H new ATOM 0 HB3 ALA A 45 12.147 21.246 -4.628 1.00 24.35 H new ATOM 653 N ASP A 46 10.167 22.019 -2.105 1.00 10.12 N ATOM 654 CA ASP A 46 10.515 23.014 -1.076 1.00 25.24 C ATOM 655 C ASP A 46 9.717 22.834 0.208 1.00 65.42 C ATOM 656 O ASP A 46 8.563 22.393 0.182 1.00 45.02 O ATOM 657 CB ASP A 46 10.360 24.465 -1.559 1.00 25.13 C ATOM 658 CG ASP A 46 11.536 25.319 -1.070 1.00 3.10 C ATOM 659 OD1 ASP A 46 11.841 25.299 0.142 1.00 12.34 O ATOM 660 OD2 ASP A 46 12.222 25.920 -1.927 1.00 52.04 O ATOM 0 H ASP A 46 9.389 22.285 -2.709 1.00 10.12 H new ATOM 0 HA ASP A 46 11.569 22.830 -0.869 1.00 25.24 H new ATOM 0 HB2 ASP A 46 10.312 24.490 -2.648 1.00 25.13 H new ATOM 0 HB3 ASP A 46 9.422 24.880 -1.189 1.00 25.13 H new ATOM 664 N MET A 47 10.310 23.253 1.325 1.00 74.15 N ATOM 665 CA MET A 47 9.729 23.204 2.657 1.00 5.00 C ATOM 666 C MET A 47 8.415 23.992 2.682 1.00 32.31 C ATOM 667 O MET A 47 7.342 23.419 2.883 1.00 1.14 O ATOM 668 CB MET A 47 10.776 23.669 3.699 1.00 52.41 C ATOM 669 CG MET A 47 11.202 25.143 3.606 1.00 24.42 C ATOM 670 SD MET A 47 12.752 25.611 4.417 1.00 44.41 S ATOM 671 CE MET A 47 13.895 24.740 3.330 1.00 14.04 C ATOM 0 H MET A 47 11.249 23.652 1.321 1.00 74.15 H new ATOM 0 HA MET A 47 9.466 22.182 2.930 1.00 5.00 H new ATOM 0 HB2 MET A 47 10.374 23.489 4.696 1.00 52.41 H new ATOM 0 HB3 MET A 47 11.665 23.046 3.596 1.00 52.41 H new ATOM 0 HG2 MET A 47 11.280 25.406 2.551 1.00 24.42 H new ATOM 0 HG3 MET A 47 10.403 25.753 4.028 1.00 24.42 H new ATOM 0 HE1 MET A 47 14.891 25.171 3.430 1.00 14.04 H new ATOM 0 HE2 MET A 47 13.926 23.686 3.605 1.00 14.04 H new ATOM 0 HE3 MET A 47 13.560 24.836 2.297 1.00 14.04 H new ATOM 679 N TYR A 48 8.478 25.301 2.447 1.00 12.40 N ATOM 680 CA TYR A 48 7.351 26.202 2.632 1.00 11.22 C ATOM 681 C TYR A 48 6.261 25.932 1.597 1.00 2.24 C ATOM 682 O TYR A 48 5.078 25.946 1.943 1.00 61.55 O ATOM 683 CB TYR A 48 7.842 27.655 2.615 1.00 44.41 C ATOM 684 CG TYR A 48 8.836 28.010 1.521 1.00 41.15 C ATOM 685 CD1 TYR A 48 8.398 28.334 0.221 1.00 45.02 C ATOM 686 CD2 TYR A 48 10.214 28.009 1.811 1.00 61.32 C ATOM 687 CE1 TYR A 48 9.331 28.644 -0.785 1.00 63.35 C ATOM 688 CE2 TYR A 48 11.151 28.313 0.811 1.00 63.24 C ATOM 689 CZ TYR A 48 10.714 28.643 -0.489 1.00 30.20 C ATOM 690 OH TYR A 48 11.641 28.999 -1.419 1.00 2.13 O ATOM 0 H TYR A 48 9.324 25.767 2.119 1.00 12.40 H new ATOM 0 HA TYR A 48 6.896 26.022 3.606 1.00 11.22 H new ATOM 0 HB2 TYR A 48 6.976 28.309 2.517 1.00 44.41 H new ATOM 0 HB3 TYR A 48 8.300 27.874 3.580 1.00 44.41 H new ATOM 0 HD1 TYR A 48 7.342 28.344 -0.004 1.00 45.02 H new ATOM 0 HD2 TYR A 48 10.552 27.773 2.809 1.00 61.32 H new ATOM 0 HE1 TYR A 48 8.992 28.882 -1.782 1.00 63.35 H new ATOM 0 HE2 TYR A 48 12.207 28.294 1.037 1.00 63.24 H new ATOM 0 HH TYR A 48 12.035 28.193 -1.814 1.00 2.13 H new ATOM 699 N LYS A 49 6.638 25.617 0.353 1.00 61.44 N ATOM 700 CA LYS A 49 5.664 25.356 -0.698 1.00 13.23 C ATOM 701 C LYS A 49 4.836 24.118 -0.357 1.00 71.45 C ATOM 702 O LYS A 49 3.607 24.168 -0.377 1.00 33.30 O ATOM 703 CB LYS A 49 6.374 25.234 -2.057 1.00 1.43 C ATOM 704 CG LYS A 49 5.380 25.311 -3.225 1.00 74.35 C ATOM 705 CD LYS A 49 4.879 26.738 -3.481 1.00 53.22 C ATOM 706 CE LYS A 49 3.912 26.729 -4.668 1.00 74.22 C ATOM 707 NZ LYS A 49 3.492 28.088 -5.052 1.00 45.13 N ATOM 0 H LYS A 49 7.610 25.538 0.055 1.00 61.44 H new ATOM 0 HA LYS A 49 4.970 26.194 -0.770 1.00 13.23 H new ATOM 0 HB2 LYS A 49 7.113 26.030 -2.155 1.00 1.43 H new ATOM 0 HB3 LYS A 49 6.915 24.289 -2.101 1.00 1.43 H new ATOM 0 HG2 LYS A 49 5.856 24.930 -4.128 1.00 74.35 H new ATOM 0 HG3 LYS A 49 4.529 24.663 -3.016 1.00 74.35 H new ATOM 0 HD2 LYS A 49 4.379 27.125 -2.593 1.00 53.22 H new ATOM 0 HD3 LYS A 49 5.720 27.400 -3.687 1.00 53.22 H new ATOM 0 HE2 LYS A 49 4.389 26.243 -5.519 1.00 74.22 H new ATOM 0 HE3 LYS A 49 3.033 26.137 -4.414 1.00 74.22 H new ATOM 0 HZ1 LYS A 49 2.838 28.034 -5.859 1.00 45.13 H new ATOM 0 HZ2 LYS A 49 3.014 28.544 -4.249 1.00 45.13 H new ATOM 0 HZ3 LYS A 49 4.327 28.647 -5.320 1.00 45.13 H new ATOM 717 N THR A 50 5.480 22.999 -0.036 1.00 11.00 N ATOM 718 CA THR A 50 4.759 21.764 0.268 1.00 22.40 C ATOM 719 C THR A 50 3.898 21.894 1.529 1.00 1.10 C ATOM 720 O THR A 50 2.821 21.295 1.588 1.00 51.33 O ATOM 721 CB THR A 50 5.743 20.597 0.362 1.00 65.13 C ATOM 722 OG1 THR A 50 6.740 20.829 1.336 1.00 12.42 O ATOM 723 CG2 THR A 50 6.401 20.370 -0.998 1.00 5.31 C ATOM 0 H THR A 50 6.495 22.921 0.021 1.00 11.00 H new ATOM 0 HA THR A 50 4.065 21.563 -0.548 1.00 22.40 H new ATOM 0 HB THR A 50 5.182 19.711 0.660 1.00 65.13 H new ATOM 0 HG1 THR A 50 7.491 21.307 0.927 1.00 12.42 H new ATOM 0 HG21 THR A 50 7.102 19.538 -0.929 1.00 5.31 H new ATOM 0 HG22 THR A 50 5.635 20.139 -1.739 1.00 5.31 H new ATOM 0 HG23 THR A 50 6.936 21.271 -1.298 1.00 5.31 H new ATOM 731 N SER A 51 4.328 22.725 2.487 1.00 43.25 N ATOM 732 CA SER A 51 3.583 23.062 3.692 1.00 71.34 C ATOM 733 C SER A 51 2.247 23.739 3.364 1.00 51.02 C ATOM 734 O SER A 51 1.388 23.790 4.242 1.00 43.33 O ATOM 735 CB SER A 51 4.467 23.959 4.573 1.00 32.14 C ATOM 736 OG SER A 51 4.005 24.101 5.907 1.00 23.42 O ATOM 0 H SER A 51 5.233 23.192 2.437 1.00 43.25 H new ATOM 0 HA SER A 51 3.335 22.148 4.231 1.00 71.34 H new ATOM 0 HB2 SER A 51 5.477 23.549 4.592 1.00 32.14 H new ATOM 0 HB3 SER A 51 4.533 24.946 4.116 1.00 32.14 H new ATOM 0 HG SER A 51 3.027 24.047 5.922 1.00 23.42 H new ATOM 741 N ASP A 52 2.053 24.254 2.147 1.00 63.52 N ATOM 742 CA ASP A 52 0.801 24.852 1.700 1.00 30.12 C ATOM 743 C ASP A 52 -0.032 23.831 0.941 1.00 42.31 C ATOM 744 O ASP A 52 -1.208 23.651 1.255 1.00 72.12 O ATOM 745 CB ASP A 52 1.094 26.044 0.779 1.00 30.13 C ATOM 746 CG ASP A 52 -0.177 26.813 0.452 1.00 5.33 C ATOM 747 OD1 ASP A 52 -0.501 27.740 1.233 1.00 62.25 O ATOM 748 OD2 ASP A 52 -0.779 26.570 -0.616 1.00 1.02 O ATOM 0 H ASP A 52 2.781 24.265 1.432 1.00 63.52 H new ATOM 0 HA ASP A 52 0.246 25.189 2.576 1.00 30.12 H new ATOM 0 HB2 ASP A 52 1.811 26.710 1.259 1.00 30.13 H new ATOM 0 HB3 ASP A 52 1.555 25.690 -0.143 1.00 30.13 H new ATOM 752 N ILE A 53 0.580 23.166 -0.046 1.00 14.13 N ATOM 753 CA ILE A 53 -0.094 22.292 -1.002 1.00 71.13 C ATOM 754 C ILE A 53 -0.780 21.139 -0.269 1.00 13.14 C ATOM 755 O ILE A 53 -1.986 20.947 -0.400 1.00 31.51 O ATOM 756 CB ILE A 53 0.902 21.768 -2.068 1.00 42.42 C ATOM 757 CG1 ILE A 53 1.580 22.895 -2.880 1.00 45.45 C ATOM 758 CG2 ILE A 53 0.157 20.835 -3.038 1.00 71.45 C ATOM 759 CD1 ILE A 53 2.865 22.418 -3.573 1.00 71.24 C ATOM 0 H ILE A 53 1.586 23.226 -0.202 1.00 14.13 H new ATOM 0 HA ILE A 53 -0.859 22.868 -1.523 1.00 71.13 H new ATOM 0 HB ILE A 53 1.690 21.240 -1.532 1.00 42.42 H new ATOM 0 HG12 ILE A 53 0.883 23.270 -3.629 1.00 45.45 H new ATOM 0 HG13 ILE A 53 1.814 23.728 -2.217 1.00 45.45 H new ATOM 0 HG21 ILE A 53 0.852 20.463 -3.791 1.00 71.45 H new ATOM 0 HG22 ILE A 53 -0.263 19.995 -2.485 1.00 71.45 H new ATOM 0 HG23 ILE A 53 -0.647 21.385 -3.527 1.00 71.45 H new ATOM 0 HD11 ILE A 53 3.306 23.244 -4.131 1.00 71.24 H new ATOM 0 HD12 ILE A 53 3.574 22.068 -2.823 1.00 71.24 H new ATOM 0 HD13 ILE A 53 2.628 21.603 -4.257 1.00 71.24 H new ATOM 770 N ALA A 54 -0.023 20.348 0.496 1.00 10.01 N ATOM 771 CA ALA A 54 -0.597 19.165 1.121 1.00 53.43 C ATOM 772 C ALA A 54 -1.568 19.545 2.239 1.00 65.44 C ATOM 773 O ALA A 54 -2.462 18.759 2.544 1.00 44.03 O ATOM 774 CB ALA A 54 0.518 18.270 1.649 1.00 33.21 C ATOM 0 H ALA A 54 0.966 20.504 0.692 1.00 10.01 H new ATOM 0 HA ALA A 54 -1.165 18.616 0.370 1.00 53.43 H new ATOM 0 HB1 ALA A 54 0.084 17.386 2.116 1.00 33.21 H new ATOM 0 HB2 ALA A 54 1.162 17.966 0.824 1.00 33.21 H new ATOM 0 HB3 ALA A 54 1.106 18.818 2.385 1.00 33.21 H new ATOM 780 N LEU A 55 -1.409 20.737 2.828 1.00 51.35 N ATOM 781 CA LEU A 55 -2.334 21.295 3.802 1.00 32.22 C ATOM 782 C LEU A 55 -3.671 21.593 3.137 1.00 33.41 C ATOM 783 O LEU A 55 -4.738 21.363 3.699 1.00 61.04 O ATOM 784 CB LEU A 55 -1.769 22.606 4.369 1.00 33.13 C ATOM 785 CG LEU A 55 -2.119 22.863 5.839 1.00 74.25 C ATOM 786 CD1 LEU A 55 -2.083 24.354 6.161 1.00 3.54 C ATOM 787 CD2 LEU A 55 -3.491 22.385 6.293 1.00 53.45 C ATOM 0 H LEU A 55 -0.615 21.347 2.632 1.00 51.35 H new ATOM 0 HA LEU A 55 -2.471 20.570 4.605 1.00 32.22 H new ATOM 0 HB2 LEU A 55 -0.684 22.596 4.263 1.00 33.13 H new ATOM 0 HB3 LEU A 55 -2.140 23.437 3.769 1.00 33.13 H new ATOM 0 HG LEU A 55 -1.360 22.284 6.365 1.00 74.25 H new ATOM 0 HD11 LEU A 55 -2.335 24.506 7.210 1.00 3.54 H new ATOM 0 HD12 LEU A 55 -1.084 24.744 5.968 1.00 3.54 H new ATOM 0 HD13 LEU A 55 -2.804 24.879 5.535 1.00 3.54 H new ATOM 0 HD21 LEU A 55 -3.627 22.620 7.349 1.00 53.45 H new ATOM 0 HD22 LEU A 55 -4.263 22.885 5.707 1.00 53.45 H new ATOM 0 HD23 LEU A 55 -3.567 21.307 6.149 1.00 53.45 H new ATOM 798 N ASP A 56 -3.611 22.114 1.921 1.00 32.22 N ATOM 799 CA ASP A 56 -4.776 22.468 1.127 1.00 62.24 C ATOM 800 C ASP A 56 -5.680 21.243 0.962 1.00 50.22 C ATOM 801 O ASP A 56 -6.904 21.339 1.070 1.00 65.51 O ATOM 802 CB ASP A 56 -4.300 22.994 -0.239 1.00 72.52 C ATOM 803 CG ASP A 56 -4.910 24.330 -0.615 1.00 33.50 C ATOM 804 OD1 ASP A 56 -4.817 25.276 0.207 1.00 23.53 O ATOM 805 OD2 ASP A 56 -5.375 24.452 -1.760 1.00 30.33 O ATOM 0 H ASP A 56 -2.728 22.307 1.448 1.00 32.22 H new ATOM 0 HA ASP A 56 -5.353 23.247 1.625 1.00 62.24 H new ATOM 0 HB2 ASP A 56 -3.214 23.090 -0.225 1.00 72.52 H new ATOM 0 HB3 ASP A 56 -4.546 22.261 -1.008 1.00 72.52 H new ATOM 809 N GLN A 57 -5.050 20.078 0.772 1.00 23.12 N ATOM 810 CA GLN A 57 -5.645 18.749 0.627 1.00 65.31 C ATOM 811 C GLN A 57 -5.796 18.035 1.992 1.00 33.11 C ATOM 812 O GLN A 57 -5.900 16.808 2.038 1.00 24.32 O ATOM 813 CB GLN A 57 -4.808 17.917 -0.376 1.00 43.32 C ATOM 814 CG GLN A 57 -4.535 18.641 -1.710 1.00 53.45 C ATOM 815 CD GLN A 57 -3.541 17.882 -2.588 1.00 22.22 C ATOM 816 OE1 GLN A 57 -2.330 17.950 -2.382 1.00 53.43 O ATOM 817 NE2 GLN A 57 -4.001 17.172 -3.601 1.00 71.43 N ATOM 0 H GLN A 57 -4.033 20.040 0.711 1.00 23.12 H new ATOM 0 HA GLN A 57 -6.655 18.856 0.231 1.00 65.31 H new ATOM 0 HB2 GLN A 57 -3.856 17.657 0.087 1.00 43.32 H new ATOM 0 HB3 GLN A 57 -5.328 16.981 -0.581 1.00 43.32 H new ATOM 0 HG2 GLN A 57 -5.473 18.767 -2.251 1.00 53.45 H new ATOM 0 HG3 GLN A 57 -4.148 19.640 -1.507 1.00 53.45 H new ATOM 0 HE21 GLN A 57 -5.005 17.117 -3.771 1.00 71.43 H new ATOM 0 HE22 GLN A 57 -3.352 16.679 -4.214 1.00 71.43 H new ATOM 824 N ILE A 58 -5.790 18.781 3.103 1.00 25.01 N ATOM 825 CA ILE A 58 -6.096 18.349 4.475 1.00 50.24 C ATOM 826 C ILE A 58 -7.258 19.200 4.983 1.00 72.02 C ATOM 827 O ILE A 58 -8.290 18.671 5.394 1.00 30.31 O ATOM 828 CB ILE A 58 -4.835 18.465 5.373 1.00 42.33 C ATOM 829 CG1 ILE A 58 -3.865 17.314 5.053 1.00 54.41 C ATOM 830 CG2 ILE A 58 -5.113 18.529 6.889 1.00 70.13 C ATOM 831 CD1 ILE A 58 -2.423 17.569 5.528 1.00 54.55 C ATOM 0 H ILE A 58 -5.555 19.773 3.066 1.00 25.01 H new ATOM 0 HA ILE A 58 -6.390 17.300 4.500 1.00 50.24 H new ATOM 0 HB ILE A 58 -4.388 19.429 5.131 1.00 42.33 H new ATOM 0 HG12 ILE A 58 -4.235 16.400 5.517 1.00 54.41 H new ATOM 0 HG13 ILE A 58 -3.859 17.145 3.976 1.00 54.41 H new ATOM 0 HG21 ILE A 58 -4.169 18.609 7.429 1.00 70.13 H new ATOM 0 HG22 ILE A 58 -5.732 19.399 7.109 1.00 70.13 H new ATOM 0 HG23 ILE A 58 -5.635 17.624 7.202 1.00 70.13 H new ATOM 0 HD11 ILE A 58 -1.798 16.715 5.268 1.00 54.55 H new ATOM 0 HD12 ILE A 58 -2.034 18.465 5.044 1.00 54.55 H new ATOM 0 HD13 ILE A 58 -2.415 17.708 6.609 1.00 54.55 H new ATOM 842 N GLN A 59 -7.119 20.525 4.929 1.00 44.13 N ATOM 843 CA GLN A 59 -8.146 21.459 5.360 1.00 14.13 C ATOM 844 C GLN A 59 -9.364 21.476 4.429 1.00 4.22 C ATOM 845 O GLN A 59 -10.403 22.017 4.821 1.00 3.40 O ATOM 846 CB GLN A 59 -7.530 22.857 5.556 1.00 3.40 C ATOM 847 CG GLN A 59 -6.886 22.929 6.952 1.00 65.03 C ATOM 848 CD GLN A 59 -6.651 24.356 7.416 1.00 31.43 C ATOM 849 OE1 GLN A 59 -5.490 24.930 7.146 1.00 5.21 O flip ATOM 850 NE2 GLN A 59 -7.540 24.984 7.980 1.00 24.20 N flip ATOM 0 H GLN A 59 -6.276 20.981 4.579 1.00 44.13 H new ATOM 0 HA GLN A 59 -8.532 21.117 6.320 1.00 14.13 H new ATOM 0 HB2 GLN A 59 -6.783 23.051 4.786 1.00 3.40 H new ATOM 0 HB3 GLN A 59 -8.298 23.624 5.455 1.00 3.40 H new ATOM 0 HG2 GLN A 59 -7.528 22.419 7.670 1.00 65.03 H new ATOM 0 HG3 GLN A 59 -5.936 22.395 6.937 1.00 65.03 H new ATOM 0 HE21 GLN A 59 -8.432 24.533 8.184 1.00 24.20 H new ATOM 0 HE22 GLN A 59 -7.388 25.957 8.245 1.00 24.20 H new ATOM 857 N GLY A 60 -9.281 20.851 3.249 1.00 21.34 N ATOM 858 CA GLY A 60 -10.412 20.700 2.341 1.00 65.34 C ATOM 859 C GLY A 60 -10.584 21.917 1.439 1.00 31.21 C ATOM 860 O GLY A 60 -11.679 22.160 0.932 1.00 73.11 O ATOM 0 H GLY A 60 -8.418 20.434 2.899 1.00 21.34 H new ATOM 0 HA2 GLY A 60 -10.268 19.811 1.727 1.00 65.34 H new ATOM 0 HA3 GLY A 60 -11.323 20.545 2.919 1.00 65.34 H new ATOM 864 N ASN A 61 -9.515 22.688 1.238 1.00 24.02 N ATOM 865 CA ASN A 61 -9.469 23.739 0.230 1.00 22.12 C ATOM 866 C ASN A 61 -9.489 23.032 -1.129 1.00 21.54 C ATOM 867 O ASN A 61 -10.392 23.215 -1.950 1.00 51.25 O ATOM 868 CB ASN A 61 -8.199 24.588 0.398 1.00 10.41 C ATOM 869 CG ASN A 61 -8.116 25.319 1.713 1.00 31.02 C ATOM 870 OD1 ASN A 61 -9.119 25.627 2.347 1.00 50.31 O ATOM 871 ND2 ASN A 61 -6.925 25.610 2.160 1.00 25.32 N ATOM 0 H ASN A 61 -8.653 22.598 1.775 1.00 24.02 H new ATOM 0 HA ASN A 61 -10.314 24.421 0.323 1.00 22.12 H new ATOM 0 HB2 ASN A 61 -7.327 23.941 0.299 1.00 10.41 H new ATOM 0 HB3 ASN A 61 -8.151 25.315 -0.413 1.00 10.41 H new ATOM 0 HD21 ASN A 61 -6.819 26.100 3.048 1.00 25.32 H new ATOM 0 HD22 ASN A 61 -6.100 25.347 1.621 1.00 25.32 H new ATOM 877 N LYS A 62 -8.494 22.165 -1.337 1.00 22.33 N ATOM 878 CA LYS A 62 -8.317 21.360 -2.535 1.00 52.43 C ATOM 879 C LYS A 62 -8.657 19.906 -2.235 1.00 12.33 C ATOM 880 O LYS A 62 -9.097 19.580 -1.125 1.00 62.42 O ATOM 881 CB LYS A 62 -6.894 21.588 -3.083 1.00 34.20 C ATOM 882 CG LYS A 62 -6.871 22.620 -4.219 1.00 63.25 C ATOM 883 CD LYS A 62 -7.562 22.102 -5.493 1.00 65.22 C ATOM 884 CE LYS A 62 -7.279 22.977 -6.717 1.00 74.25 C ATOM 885 NZ LYS A 62 -5.985 22.671 -7.367 1.00 10.33 N ATOM 0 H LYS A 62 -7.764 22.003 -0.644 1.00 22.33 H new ATOM 0 HA LYS A 62 -9.004 21.661 -3.326 1.00 52.43 H new ATOM 0 HB2 LYS A 62 -6.244 21.925 -2.275 1.00 34.20 H new ATOM 0 HB3 LYS A 62 -6.489 20.643 -3.444 1.00 34.20 H new ATOM 0 HG2 LYS A 62 -7.364 23.534 -3.887 1.00 63.25 H new ATOM 0 HG3 LYS A 62 -5.838 22.881 -4.449 1.00 63.25 H new ATOM 0 HD2 LYS A 62 -7.228 21.084 -5.694 1.00 65.22 H new ATOM 0 HD3 LYS A 62 -8.638 22.057 -5.325 1.00 65.22 H new ATOM 0 HE2 LYS A 62 -8.082 22.846 -7.442 1.00 74.25 H new ATOM 0 HE3 LYS A 62 -7.288 24.025 -6.416 1.00 74.25 H new ATOM 0 HZ1 LYS A 62 -5.852 23.296 -8.188 1.00 10.33 H new ATOM 0 HZ2 LYS A 62 -5.211 22.822 -6.688 1.00 10.33 H new ATOM 0 HZ3 LYS A 62 -5.981 21.680 -7.682 1.00 10.33 H new ATOM 895 N ASP A 63 -8.525 19.058 -3.248 1.00 54.35 N ATOM 896 CA ASP A 63 -9.042 17.696 -3.269 1.00 44.01 C ATOM 897 C ASP A 63 -7.903 16.724 -3.536 1.00 24.32 C ATOM 898 O ASP A 63 -6.784 17.154 -3.818 1.00 12.01 O ATOM 899 CB ASP A 63 -10.141 17.605 -4.330 1.00 52.42 C ATOM 900 CG ASP A 63 -10.922 16.300 -4.271 1.00 34.50 C ATOM 901 OD1 ASP A 63 -11.058 15.747 -3.155 1.00 42.15 O ATOM 902 OD2 ASP A 63 -11.451 15.901 -5.328 1.00 34.33 O ATOM 0 H ASP A 63 -8.037 19.309 -4.108 1.00 54.35 H new ATOM 0 HA ASP A 63 -9.477 17.430 -2.306 1.00 44.01 H new ATOM 0 HB2 ASP A 63 -10.830 18.440 -4.203 1.00 52.42 H new ATOM 0 HB3 ASP A 63 -9.693 17.709 -5.318 1.00 52.42 H new ATOM 906 N PHE A 64 -8.151 15.424 -3.411 1.00 43.23 N ATOM 907 CA PHE A 64 -7.104 14.414 -3.474 1.00 23.10 C ATOM 908 C PHE A 64 -6.446 14.337 -4.868 1.00 11.40 C ATOM 909 O PHE A 64 -7.071 14.677 -5.873 1.00 51.33 O ATOM 910 CB PHE A 64 -7.684 13.061 -3.028 1.00 2.22 C ATOM 911 CG PHE A 64 -8.981 12.609 -3.685 1.00 53.11 C ATOM 912 CD1 PHE A 64 -9.000 12.209 -5.033 1.00 23.24 C ATOM 913 CD2 PHE A 64 -10.175 12.567 -2.938 1.00 21.10 C ATOM 914 CE1 PHE A 64 -10.208 11.795 -5.624 1.00 1.22 C ATOM 915 CE2 PHE A 64 -11.383 12.174 -3.535 1.00 1.10 C ATOM 916 CZ PHE A 64 -11.400 11.793 -4.884 1.00 61.33 C ATOM 0 H PHE A 64 -9.085 15.042 -3.263 1.00 43.23 H new ATOM 0 HA PHE A 64 -6.302 14.696 -2.792 1.00 23.10 H new ATOM 0 HB2 PHE A 64 -6.930 12.295 -3.207 1.00 2.22 H new ATOM 0 HB3 PHE A 64 -7.847 13.102 -1.951 1.00 2.22 H new ATOM 0 HD1 PHE A 64 -8.089 12.220 -5.613 1.00 23.24 H new ATOM 0 HD2 PHE A 64 -10.161 12.841 -1.893 1.00 21.10 H new ATOM 0 HE1 PHE A 64 -10.218 11.476 -6.656 1.00 1.22 H new ATOM 0 HE2 PHE A 64 -12.296 12.165 -2.957 1.00 1.10 H new ATOM 0 HZ PHE A 64 -12.328 11.499 -5.352 1.00 61.33 H new ATOM 925 N PRO A 65 -5.182 13.888 -4.963 1.00 43.44 N ATOM 926 CA PRO A 65 -4.478 13.747 -6.236 1.00 45.13 C ATOM 927 C PRO A 65 -4.955 12.517 -7.019 1.00 74.23 C ATOM 928 O PRO A 65 -5.261 11.484 -6.417 1.00 43.14 O ATOM 929 CB PRO A 65 -3.012 13.613 -5.832 1.00 21.43 C ATOM 930 CG PRO A 65 -3.067 12.952 -4.456 1.00 34.10 C ATOM 931 CD PRO A 65 -4.309 13.573 -3.841 1.00 21.52 C ATOM 0 HA PRO A 65 -4.657 14.591 -6.902 1.00 45.13 H new ATOM 0 HB2 PRO A 65 -2.455 13.005 -6.545 1.00 21.43 H new ATOM 0 HB3 PRO A 65 -2.519 14.584 -5.789 1.00 21.43 H new ATOM 0 HG2 PRO A 65 -3.150 11.868 -4.530 1.00 34.10 H new ATOM 0 HG3 PRO A 65 -2.174 13.164 -3.868 1.00 34.10 H new ATOM 0 HD2 PRO A 65 -4.792 12.882 -3.150 1.00 21.52 H new ATOM 0 HD3 PRO A 65 -4.060 14.470 -3.274 1.00 21.52 H new ATOM 936 N GLU A 66 -4.919 12.566 -8.355 1.00 54.24 N ATOM 937 CA GLU A 66 -5.194 11.399 -9.199 1.00 72.45 C ATOM 938 C GLU A 66 -4.052 10.375 -9.136 1.00 11.20 C ATOM 939 O GLU A 66 -3.035 10.596 -8.467 1.00 3.12 O ATOM 940 CB GLU A 66 -5.534 11.818 -10.646 1.00 13.23 C ATOM 941 CG GLU A 66 -4.330 12.313 -11.464 1.00 64.45 C ATOM 942 CD GLU A 66 -4.654 12.573 -12.948 1.00 33.52 C ATOM 943 OE1 GLU A 66 -5.850 12.781 -13.288 1.00 11.00 O ATOM 944 OE2 GLU A 66 -3.735 12.550 -13.792 1.00 24.21 O ATOM 0 H GLU A 66 -4.699 13.413 -8.880 1.00 54.24 H new ATOM 0 HA GLU A 66 -6.078 10.901 -8.801 1.00 72.45 H new ATOM 0 HB2 GLU A 66 -5.983 10.969 -11.161 1.00 13.23 H new ATOM 0 HB3 GLU A 66 -6.286 12.607 -10.616 1.00 13.23 H new ATOM 0 HG2 GLU A 66 -3.952 13.233 -11.017 1.00 64.45 H new ATOM 0 HG3 GLU A 66 -3.530 11.575 -11.400 1.00 64.45 H new ATOM 949 N ILE A 67 -4.211 9.257 -9.848 1.00 73.15 N ATOM 950 CA ILE A 67 -3.156 8.280 -10.077 1.00 40.33 C ATOM 951 C ILE A 67 -3.059 7.955 -11.559 1.00 2.22 C ATOM 952 O ILE A 67 -4.007 8.179 -12.311 1.00 21.33 O ATOM 953 CB ILE A 67 -3.367 6.993 -9.243 1.00 20.10 C ATOM 954 CG1 ILE A 67 -4.709 6.288 -9.550 1.00 43.35 C ATOM 955 CG2 ILE A 67 -3.217 7.296 -7.750 1.00 3.02 C ATOM 956 CD1 ILE A 67 -4.922 4.999 -8.749 1.00 34.50 C ATOM 0 H ILE A 67 -5.096 9.005 -10.288 1.00 73.15 H new ATOM 0 HA ILE A 67 -2.215 8.722 -9.748 1.00 40.33 H new ATOM 0 HB ILE A 67 -2.589 6.288 -9.536 1.00 20.10 H new ATOM 0 HG12 ILE A 67 -5.528 6.976 -9.340 1.00 43.35 H new ATOM 0 HG13 ILE A 67 -4.753 6.056 -10.614 1.00 43.35 H new ATOM 0 HG21 ILE A 67 -3.368 6.382 -7.176 1.00 3.02 H new ATOM 0 HG22 ILE A 67 -2.217 7.685 -7.556 1.00 3.02 H new ATOM 0 HG23 ILE A 67 -3.959 8.037 -7.453 1.00 3.02 H new ATOM 0 HD11 ILE A 67 -5.883 4.559 -9.016 1.00 34.50 H new ATOM 0 HD12 ILE A 67 -4.124 4.293 -8.977 1.00 34.50 H new ATOM 0 HD13 ILE A 67 -4.911 5.227 -7.683 1.00 34.50 H new ATOM 967 N GLN A 68 -1.934 7.357 -11.942 1.00 2.10 N ATOM 968 CA GLN A 68 -1.633 6.839 -13.264 1.00 34.52 C ATOM 969 C GLN A 68 -1.571 5.337 -13.072 1.00 31.14 C ATOM 970 O GLN A 68 -0.538 4.717 -12.777 1.00 11.33 O ATOM 971 CB GLN A 68 -0.354 7.434 -13.849 1.00 1.04 C ATOM 972 CG GLN A 68 -0.217 8.922 -13.532 1.00 52.33 C ATOM 973 CD GLN A 68 -1.281 9.839 -14.125 1.00 41.23 C ATOM 974 OE1 GLN A 68 -1.961 9.515 -15.093 1.00 71.43 O ATOM 975 NE2 GLN A 68 -1.443 11.009 -13.534 1.00 62.34 N ATOM 0 H GLN A 68 -1.161 7.215 -11.291 1.00 2.10 H new ATOM 0 HA GLN A 68 -2.388 7.114 -14.000 1.00 34.52 H new ATOM 0 HB2 GLN A 68 0.509 6.898 -13.453 1.00 1.04 H new ATOM 0 HB3 GLN A 68 -0.349 7.292 -14.930 1.00 1.04 H new ATOM 0 HG2 GLN A 68 -0.226 9.043 -12.449 1.00 52.33 H new ATOM 0 HG3 GLN A 68 0.759 9.258 -13.883 1.00 52.33 H new ATOM 0 HE21 GLN A 68 -0.867 11.258 -12.730 1.00 62.34 H new ATOM 0 HE22 GLN A 68 -2.144 11.663 -13.881 1.00 62.34 H new ATOM 982 N LEU A 69 -2.780 4.818 -13.072 1.00 35.52 N ATOM 983 CA LEU A 69 -3.109 3.411 -12.924 1.00 63.15 C ATOM 984 C LEU A 69 -4.329 3.086 -13.786 1.00 41.43 C ATOM 985 O LEU A 69 -4.828 3.935 -14.525 1.00 3.30 O ATOM 986 CB LEU A 69 -3.333 3.072 -11.437 1.00 52.04 C ATOM 987 CG LEU A 69 -2.958 1.620 -11.068 1.00 64.25 C ATOM 988 CD1 LEU A 69 -1.462 1.366 -11.281 1.00 60.35 C ATOM 989 CD2 LEU A 69 -3.306 1.369 -9.604 1.00 14.34 C ATOM 0 H LEU A 69 -3.611 5.399 -13.182 1.00 35.52 H new ATOM 0 HA LEU A 69 -2.281 2.792 -13.269 1.00 63.15 H new ATOM 0 HB2 LEU A 69 -2.745 3.756 -10.825 1.00 52.04 H new ATOM 0 HB3 LEU A 69 -4.381 3.242 -11.189 1.00 52.04 H new ATOM 0 HG LEU A 69 -3.519 0.944 -11.713 1.00 64.25 H new ATOM 0 HD11 LEU A 69 -1.226 0.336 -11.013 1.00 60.35 H new ATOM 0 HD12 LEU A 69 -1.210 1.536 -12.328 1.00 60.35 H new ATOM 0 HD13 LEU A 69 -0.885 2.045 -10.654 1.00 60.35 H new ATOM 0 HD21 LEU A 69 -3.043 0.345 -9.338 1.00 14.34 H new ATOM 0 HD22 LEU A 69 -2.749 2.062 -8.974 1.00 14.34 H new ATOM 0 HD23 LEU A 69 -4.375 1.520 -9.453 1.00 14.34 H new ATOM 1000 N ASP A 70 -4.823 1.861 -13.686 1.00 14.02 N ATOM 1001 CA ASP A 70 -6.004 1.359 -14.363 1.00 34.52 C ATOM 1002 C ASP A 70 -6.808 0.593 -13.320 1.00 1.33 C ATOM 1003 O ASP A 70 -6.270 0.206 -12.277 1.00 42.45 O ATOM 1004 CB ASP A 70 -5.602 0.383 -15.469 1.00 41.41 C ATOM 1005 CG ASP A 70 -4.864 1.013 -16.646 1.00 11.31 C ATOM 1006 OD1 ASP A 70 -3.670 1.381 -16.497 1.00 15.21 O ATOM 1007 OD2 ASP A 70 -5.441 1.060 -17.759 1.00 35.40 O ATOM 0 H ASP A 70 -4.384 1.153 -13.097 1.00 14.02 H new ATOM 0 HA ASP A 70 -6.570 2.179 -14.804 1.00 34.52 H new ATOM 0 HB2 ASP A 70 -4.970 -0.393 -15.037 1.00 41.41 H new ATOM 0 HB3 ASP A 70 -6.500 -0.109 -15.843 1.00 41.41 H new ATOM 1011 N ASN A 71 -8.086 0.361 -13.604 1.00 43.34 N ATOM 1012 CA ASN A 71 -9.003 -0.316 -12.702 1.00 1.00 C ATOM 1013 C ASN A 71 -8.686 -1.811 -12.632 1.00 43.15 C ATOM 1014 O ASN A 71 -8.475 -2.447 -13.672 1.00 22.51 O ATOM 1015 CB ASN A 71 -10.441 -0.078 -13.181 1.00 64.14 C ATOM 1016 CG ASN A 71 -11.413 -0.243 -12.033 1.00 75.52 C ATOM 1017 OD1 ASN A 71 -11.394 0.561 -11.104 1.00 53.32 O ATOM 1018 ND2 ASN A 71 -12.239 -1.264 -12.054 1.00 1.21 N ATOM 0 H ASN A 71 -8.518 0.644 -14.484 1.00 43.34 H new ATOM 0 HA ASN A 71 -8.891 0.088 -11.696 1.00 1.00 H new ATOM 0 HB2 ASN A 71 -10.530 0.924 -13.600 1.00 64.14 H new ATOM 0 HB3 ASN A 71 -10.687 -0.780 -13.978 1.00 64.14 H new ATOM 0 HD21 ASN A 71 -12.891 -1.408 -11.283 1.00 1.21 H new ATOM 0 HD22 ASN A 71 -12.228 -1.913 -12.841 1.00 1.21 H new ATOM 1024 N ILE A 72 -8.647 -2.392 -11.435 1.00 74.33 N ATOM 1025 CA ILE A 72 -8.341 -3.800 -11.185 1.00 51.34 C ATOM 1026 C ILE A 72 -9.246 -4.256 -10.044 1.00 72.43 C ATOM 1027 O ILE A 72 -9.468 -3.500 -9.095 1.00 50.43 O ATOM 1028 CB ILE A 72 -6.841 -3.960 -10.819 1.00 60.21 C ATOM 1029 CG1 ILE A 72 -5.928 -3.537 -11.993 1.00 24.10 C ATOM 1030 CG2 ILE A 72 -6.522 -5.410 -10.399 1.00 31.12 C ATOM 1031 CD1 ILE A 72 -4.450 -3.422 -11.626 1.00 64.23 C ATOM 0 H ILE A 72 -8.835 -1.874 -10.577 1.00 74.33 H new ATOM 0 HA ILE A 72 -8.520 -4.411 -12.070 1.00 51.34 H new ATOM 0 HB ILE A 72 -6.643 -3.301 -9.973 1.00 60.21 H new ATOM 0 HG12 ILE A 72 -6.035 -4.261 -12.801 1.00 24.10 H new ATOM 0 HG13 ILE A 72 -6.271 -2.577 -12.378 1.00 24.10 H new ATOM 0 HG21 ILE A 72 -5.464 -5.492 -10.148 1.00 31.12 H new ATOM 0 HG22 ILE A 72 -7.123 -5.677 -9.530 1.00 31.12 H new ATOM 0 HG23 ILE A 72 -6.753 -6.086 -11.222 1.00 31.12 H new ATOM 0 HD11 ILE A 72 -3.879 -3.121 -12.505 1.00 64.23 H new ATOM 0 HD12 ILE A 72 -4.327 -2.676 -10.841 1.00 64.23 H new ATOM 0 HD13 ILE A 72 -4.087 -4.386 -11.270 1.00 64.23 H new ATOM 1042 N ASP A 73 -9.734 -5.497 -10.104 1.00 14.10 N ATOM 1043 CA ASP A 73 -10.483 -6.071 -8.995 1.00 65.52 C ATOM 1044 C ASP A 73 -9.512 -6.665 -7.988 1.00 25.13 C ATOM 1045 O ASP A 73 -8.931 -7.736 -8.201 1.00 43.01 O ATOM 1046 CB ASP A 73 -11.531 -7.091 -9.443 1.00 30.51 C ATOM 1047 CG ASP A 73 -12.851 -6.719 -8.787 1.00 11.34 C ATOM 1048 OD1 ASP A 73 -12.923 -6.681 -7.537 1.00 4.33 O ATOM 1049 OD2 ASP A 73 -13.779 -6.334 -9.531 1.00 1.14 O ATOM 0 H ASP A 73 -9.622 -6.117 -10.906 1.00 14.10 H new ATOM 0 HA ASP A 73 -11.049 -5.269 -8.521 1.00 65.52 H new ATOM 0 HB2 ASP A 73 -11.629 -7.086 -10.529 1.00 30.51 H new ATOM 0 HB3 ASP A 73 -11.231 -8.099 -9.154 1.00 30.51 H new ATOM 1053 N TYR A 74 -9.286 -5.944 -6.896 1.00 41.05 N ATOM 1054 CA TYR A 74 -8.403 -6.406 -5.837 1.00 33.10 C ATOM 1055 C TYR A 74 -9.018 -7.555 -5.041 1.00 13.21 C ATOM 1056 O TYR A 74 -8.296 -8.271 -4.355 1.00 12.34 O ATOM 1057 CB TYR A 74 -8.063 -5.243 -4.917 1.00 13.11 C ATOM 1058 CG TYR A 74 -7.506 -4.039 -5.639 1.00 12.00 C ATOM 1059 CD1 TYR A 74 -6.305 -4.109 -6.371 1.00 70.21 C ATOM 1060 CD2 TYR A 74 -8.224 -2.842 -5.586 1.00 4.14 C ATOM 1061 CE1 TYR A 74 -5.850 -2.976 -7.069 1.00 54.34 C ATOM 1062 CE2 TYR A 74 -7.739 -1.681 -6.201 1.00 5.14 C ATOM 1063 CZ TYR A 74 -6.578 -1.765 -7.003 1.00 3.21 C ATOM 1064 OH TYR A 74 -6.199 -0.714 -7.773 1.00 32.53 O ATOM 0 H TYR A 74 -9.706 -5.031 -6.722 1.00 41.05 H new ATOM 0 HA TYR A 74 -7.492 -6.788 -6.298 1.00 33.10 H new ATOM 0 HB2 TYR A 74 -8.961 -4.947 -4.374 1.00 13.11 H new ATOM 0 HB3 TYR A 74 -7.338 -5.578 -4.175 1.00 13.11 H new ATOM 0 HD1 TYR A 74 -5.737 -5.027 -6.396 1.00 70.21 H new ATOM 0 HD2 TYR A 74 -9.168 -2.811 -5.062 1.00 4.14 H new ATOM 0 HE1 TYR A 74 -4.945 -3.031 -7.655 1.00 54.34 H new ATOM 0 HE2 TYR A 74 -8.244 -0.736 -6.065 1.00 5.14 H new ATOM 0 HH TYR A 74 -6.801 0.043 -7.613 1.00 32.53 H new ATOM 1073 N ASN A 75 -10.326 -7.796 -5.161 1.00 1.14 N ATOM 1074 CA ASN A 75 -11.060 -8.825 -4.419 1.00 33.41 C ATOM 1075 C ASN A 75 -10.677 -10.264 -4.821 1.00 63.34 C ATOM 1076 O ASN A 75 -11.321 -11.230 -4.421 1.00 21.44 O ATOM 1077 CB ASN A 75 -12.567 -8.568 -4.568 1.00 54.32 C ATOM 1078 CG ASN A 75 -13.297 -8.767 -3.247 1.00 3.33 C ATOM 1079 OD1 ASN A 75 -13.364 -9.864 -2.707 1.00 72.32 O ATOM 1080 ND2 ASN A 75 -13.876 -7.711 -2.699 1.00 10.24 N ATOM 0 H ASN A 75 -10.922 -7.265 -5.796 1.00 1.14 H new ATOM 0 HA ASN A 75 -10.778 -8.748 -3.369 1.00 33.41 H new ATOM 0 HB2 ASN A 75 -12.731 -7.552 -4.927 1.00 54.32 H new ATOM 0 HB3 ASN A 75 -12.980 -9.241 -5.319 1.00 54.32 H new ATOM 0 HD21 ASN A 75 -14.383 -7.807 -1.819 1.00 10.24 H new ATOM 0 HD22 ASN A 75 -13.815 -6.801 -3.156 1.00 10.24 H new ATOM 1086 N ASN A 76 -9.645 -10.428 -5.654 1.00 50.25 N ATOM 1087 CA ASN A 76 -9.036 -11.695 -6.040 1.00 12.44 C ATOM 1088 C ASN A 76 -7.804 -12.036 -5.190 1.00 72.21 C ATOM 1089 O ASN A 76 -7.192 -13.080 -5.431 1.00 13.40 O ATOM 1090 CB ASN A 76 -8.567 -11.603 -7.496 1.00 21.53 C ATOM 1091 CG ASN A 76 -9.684 -11.443 -8.510 1.00 10.13 C ATOM 1092 OD1 ASN A 76 -10.383 -12.399 -8.845 1.00 11.21 O ATOM 1093 ND2 ASN A 76 -9.770 -10.281 -9.129 1.00 32.20 N ATOM 0 H ASN A 76 -9.190 -9.632 -6.100 1.00 50.25 H new ATOM 0 HA ASN A 76 -9.791 -12.468 -5.896 1.00 12.44 H new ATOM 0 HB2 ASN A 76 -7.884 -10.759 -7.591 1.00 21.53 H new ATOM 0 HB3 ASN A 76 -8.000 -12.501 -7.739 1.00 21.53 H new ATOM 0 HD21 ASN A 76 -10.425 -10.162 -9.901 1.00 32.20 H new ATOM 0 HD22 ASN A 76 -9.181 -9.502 -8.835 1.00 32.20 H new ATOM 1099 N TYR A 77 -7.379 -11.165 -4.268 1.00 73.11 N ATOM 1100 CA TYR A 77 -6.077 -11.224 -3.608 1.00 4.42 C ATOM 1101 C TYR A 77 -6.279 -11.327 -2.101 1.00 3.01 C ATOM 1102 O TYR A 77 -7.003 -10.524 -1.519 1.00 61.44 O ATOM 1103 CB TYR A 77 -5.230 -10.014 -4.023 1.00 74.51 C ATOM 1104 CG TYR A 77 -4.903 -9.962 -5.512 1.00 72.12 C ATOM 1105 CD1 TYR A 77 -5.765 -9.307 -6.411 1.00 50.42 C ATOM 1106 CD2 TYR A 77 -3.729 -10.563 -6.004 1.00 30.15 C ATOM 1107 CE1 TYR A 77 -5.459 -9.220 -7.781 1.00 2.31 C ATOM 1108 CE2 TYR A 77 -3.402 -10.475 -7.368 1.00 63.44 C ATOM 1109 CZ TYR A 77 -4.254 -9.784 -8.259 1.00 11.12 C ATOM 1110 OH TYR A 77 -3.886 -9.651 -9.561 1.00 1.41 O ATOM 0 H TYR A 77 -7.949 -10.380 -3.954 1.00 73.11 H new ATOM 0 HA TYR A 77 -5.527 -12.112 -3.919 1.00 4.42 H new ATOM 0 HB2 TYR A 77 -5.759 -9.102 -3.746 1.00 74.51 H new ATOM 0 HB3 TYR A 77 -4.298 -10.026 -3.458 1.00 74.51 H new ATOM 0 HD1 TYR A 77 -6.678 -8.863 -6.042 1.00 50.42 H new ATOM 0 HD2 TYR A 77 -3.075 -11.095 -5.329 1.00 30.15 H new ATOM 0 HE1 TYR A 77 -6.138 -8.727 -8.461 1.00 2.31 H new ATOM 0 HE2 TYR A 77 -2.498 -10.936 -7.736 1.00 63.44 H new ATOM 0 HH TYR A 77 -3.028 -10.102 -9.706 1.00 1.41 H new ATOM 1119 N ASP A 78 -5.652 -12.313 -1.463 1.00 52.14 N ATOM 1120 CA ASP A 78 -5.865 -12.587 -0.032 1.00 11.02 C ATOM 1121 C ASP A 78 -5.040 -11.652 0.858 1.00 64.24 C ATOM 1122 O ASP A 78 -5.424 -11.357 1.992 1.00 1.45 O ATOM 1123 CB ASP A 78 -5.543 -14.055 0.278 1.00 45.33 C ATOM 1124 CG ASP A 78 -6.196 -14.561 1.576 1.00 24.22 C ATOM 1125 OD1 ASP A 78 -7.390 -14.266 1.830 1.00 50.10 O ATOM 1126 OD2 ASP A 78 -5.576 -15.380 2.294 1.00 13.54 O ATOM 0 H ASP A 78 -4.987 -12.942 -1.912 1.00 52.14 H new ATOM 0 HA ASP A 78 -6.915 -12.399 0.190 1.00 11.02 H new ATOM 0 HB2 ASP A 78 -5.876 -14.676 -0.554 1.00 45.33 H new ATOM 0 HB3 ASP A 78 -4.462 -14.175 0.353 1.00 45.33 H new ATOM 1130 N LEU A 79 -3.935 -11.140 0.306 1.00 33.42 N ATOM 1131 CA LEU A 79 -3.048 -10.139 0.897 1.00 22.25 C ATOM 1132 C LEU A 79 -2.725 -9.084 -0.171 1.00 53.42 C ATOM 1133 O LEU A 79 -2.590 -9.436 -1.347 1.00 24.12 O ATOM 1134 CB LEU A 79 -1.759 -10.849 1.365 1.00 43.00 C ATOM 1135 CG LEU A 79 -1.120 -10.330 2.667 1.00 32.55 C ATOM 1136 CD1 LEU A 79 0.268 -10.949 2.829 1.00 1.42 C ATOM 1137 CD2 LEU A 79 -0.960 -8.811 2.765 1.00 25.35 C ATOM 0 H LEU A 79 -3.620 -11.432 -0.619 1.00 33.42 H new ATOM 0 HA LEU A 79 -3.518 -9.649 1.750 1.00 22.25 H new ATOM 0 HB2 LEU A 79 -1.981 -11.908 1.493 1.00 43.00 H new ATOM 0 HB3 LEU A 79 -1.019 -10.772 0.568 1.00 43.00 H new ATOM 0 HG LEU A 79 -1.816 -10.622 3.453 1.00 32.55 H new ATOM 0 HD11 LEU A 79 0.724 -10.584 3.749 1.00 1.42 H new ATOM 0 HD12 LEU A 79 0.179 -12.034 2.873 1.00 1.42 H new ATOM 0 HD13 LEU A 79 0.892 -10.670 1.980 1.00 1.42 H new ATOM 0 HD21 LEU A 79 -0.501 -8.554 3.720 1.00 25.35 H new ATOM 0 HD22 LEU A 79 -0.326 -8.459 1.951 1.00 25.35 H new ATOM 0 HD23 LEU A 79 -1.939 -8.337 2.694 1.00 25.35 H new ATOM 1148 N ILE A 80 -2.549 -7.815 0.203 1.00 74.31 N ATOM 1149 CA ILE A 80 -2.052 -6.746 -0.662 1.00 31.11 C ATOM 1150 C ILE A 80 -1.068 -5.897 0.143 1.00 3.35 C ATOM 1151 O ILE A 80 -1.349 -5.498 1.273 1.00 12.12 O ATOM 1152 CB ILE A 80 -3.219 -5.903 -1.223 1.00 50.22 C ATOM 1153 CG1 ILE A 80 -4.098 -6.789 -2.128 1.00 65.24 C ATOM 1154 CG2 ILE A 80 -2.702 -4.697 -2.033 1.00 4.12 C ATOM 1155 CD1 ILE A 80 -5.269 -6.072 -2.783 1.00 22.40 C ATOM 0 H ILE A 80 -2.756 -7.494 1.149 1.00 74.31 H new ATOM 0 HA ILE A 80 -1.536 -7.168 -1.524 1.00 31.11 H new ATOM 0 HB ILE A 80 -3.802 -5.524 -0.384 1.00 50.22 H new ATOM 0 HG12 ILE A 80 -3.472 -7.220 -2.909 1.00 65.24 H new ATOM 0 HG13 ILE A 80 -4.484 -7.618 -1.535 1.00 65.24 H new ATOM 0 HG21 ILE A 80 -3.548 -4.125 -2.414 1.00 4.12 H new ATOM 0 HG22 ILE A 80 -2.093 -4.061 -1.390 1.00 4.12 H new ATOM 0 HG23 ILE A 80 -2.099 -5.052 -2.869 1.00 4.12 H new ATOM 0 HD11 ILE A 80 -5.828 -6.776 -3.399 1.00 22.40 H new ATOM 0 HD12 ILE A 80 -5.924 -5.665 -2.012 1.00 22.40 H new ATOM 0 HD13 ILE A 80 -4.895 -5.260 -3.407 1.00 22.40 H new ATOM 1166 N LEU A 81 0.081 -5.579 -0.446 1.00 41.20 N ATOM 1167 CA LEU A 81 1.097 -4.734 0.152 1.00 22.12 C ATOM 1168 C LEU A 81 1.176 -3.401 -0.582 1.00 63.33 C ATOM 1169 O LEU A 81 1.159 -3.387 -1.814 1.00 11.45 O ATOM 1170 CB LEU A 81 2.443 -5.448 0.012 1.00 14.14 C ATOM 1171 CG LEU A 81 2.647 -6.733 0.844 1.00 50.20 C ATOM 1172 CD1 LEU A 81 2.058 -6.642 2.254 1.00 23.55 C ATOM 1173 CD2 LEU A 81 2.121 -8.005 0.173 1.00 50.01 C ATOM 0 H LEU A 81 0.333 -5.913 -1.376 1.00 41.20 H new ATOM 0 HA LEU A 81 0.852 -4.549 1.198 1.00 22.12 H new ATOM 0 HB2 LEU A 81 2.585 -5.699 -1.039 1.00 14.14 H new ATOM 0 HB3 LEU A 81 3.230 -4.743 0.280 1.00 14.14 H new ATOM 0 HG LEU A 81 3.732 -6.810 0.914 1.00 50.20 H new ATOM 0 HD11 LEU A 81 2.236 -7.578 2.784 1.00 23.55 H new ATOM 0 HD12 LEU A 81 2.533 -5.823 2.794 1.00 23.55 H new ATOM 0 HD13 LEU A 81 0.985 -6.460 2.189 1.00 23.55 H new ATOM 0 HD21 LEU A 81 2.303 -8.861 0.823 1.00 50.01 H new ATOM 0 HD22 LEU A 81 1.050 -7.906 -0.005 1.00 50.01 H new ATOM 0 HD23 LEU A 81 2.635 -8.154 -0.777 1.00 50.01 H new ATOM 1184 N ILE A 82 1.353 -2.286 0.130 1.00 44.34 N ATOM 1185 CA ILE A 82 1.434 -0.946 -0.453 1.00 63.33 C ATOM 1186 C ILE A 82 2.692 -0.227 0.048 1.00 63.10 C ATOM 1187 O ILE A 82 3.107 -0.426 1.186 1.00 52.42 O ATOM 1188 CB ILE A 82 0.117 -0.184 -0.162 1.00 11.04 C ATOM 1189 CG1 ILE A 82 -1.056 -0.750 -1.002 1.00 12.14 C ATOM 1190 CG2 ILE A 82 0.215 1.322 -0.427 1.00 64.31 C ATOM 1191 CD1 ILE A 82 -2.082 -1.477 -0.137 1.00 30.52 C ATOM 0 H ILE A 82 1.446 -2.290 1.146 1.00 44.34 H new ATOM 0 HA ILE A 82 1.535 -1.000 -1.537 1.00 63.33 H new ATOM 0 HB ILE A 82 -0.068 -0.332 0.902 1.00 11.04 H new ATOM 0 HG12 ILE A 82 -1.545 0.065 -1.536 1.00 12.14 H new ATOM 0 HG13 ILE A 82 -0.665 -1.436 -1.754 1.00 12.14 H new ATOM 0 HG21 ILE A 82 -0.742 1.794 -0.203 1.00 64.31 H new ATOM 0 HG22 ILE A 82 0.990 1.753 0.207 1.00 64.31 H new ATOM 0 HG23 ILE A 82 0.467 1.492 -1.474 1.00 64.31 H new ATOM 0 HD11 ILE A 82 -2.886 -1.857 -0.768 1.00 30.52 H new ATOM 0 HD12 ILE A 82 -1.600 -2.309 0.377 1.00 30.52 H new ATOM 0 HD13 ILE A 82 -2.494 -0.785 0.598 1.00 30.52 H new ATOM 1202 N GLY A 83 3.276 0.647 -0.781 1.00 14.14 N ATOM 1203 CA GLY A 83 4.503 1.387 -0.502 1.00 42.41 C ATOM 1204 C GLY A 83 4.363 2.858 -0.900 1.00 23.52 C ATOM 1205 O GLY A 83 3.790 3.133 -1.959 1.00 53.03 O ATOM 0 H GLY A 83 2.888 0.863 -1.699 1.00 14.14 H new ATOM 0 HA2 GLY A 83 4.741 1.315 0.559 1.00 42.41 H new ATOM 0 HA3 GLY A 83 5.334 0.938 -1.046 1.00 42.41 H new ATOM 1209 N SER A 84 4.888 3.816 -0.118 1.00 54.10 N ATOM 1210 CA SER A 84 4.723 5.235 -0.421 1.00 52.41 C ATOM 1211 C SER A 84 5.758 6.119 0.307 1.00 25.35 C ATOM 1212 O SER A 84 6.306 5.718 1.330 1.00 2.42 O ATOM 1213 CB SER A 84 3.280 5.673 -0.089 1.00 61.30 C ATOM 1214 OG SER A 84 2.592 4.836 0.826 1.00 1.22 O ATOM 0 H SER A 84 5.428 3.627 0.726 1.00 54.10 H new ATOM 0 HA SER A 84 4.903 5.373 -1.487 1.00 52.41 H new ATOM 0 HB2 SER A 84 3.308 6.684 0.318 1.00 61.30 H new ATOM 0 HB3 SER A 84 2.708 5.719 -1.016 1.00 61.30 H new ATOM 0 HG SER A 84 2.623 5.235 1.721 1.00 1.22 H new ATOM 1219 N PRO A 85 6.022 7.342 -0.182 1.00 72.40 N ATOM 1220 CA PRO A 85 6.943 8.306 0.431 1.00 4.24 C ATOM 1221 C PRO A 85 6.335 9.042 1.636 1.00 73.53 C ATOM 1222 O PRO A 85 5.112 9.113 1.760 1.00 31.32 O ATOM 1223 CB PRO A 85 7.222 9.292 -0.705 1.00 70.32 C ATOM 1224 CG PRO A 85 5.918 9.307 -1.502 1.00 23.32 C ATOM 1225 CD PRO A 85 5.512 7.846 -1.447 1.00 31.51 C ATOM 0 HA PRO A 85 7.831 7.814 0.828 1.00 4.24 H new ATOM 0 HB2 PRO A 85 7.469 10.283 -0.323 1.00 70.32 H new ATOM 0 HB3 PRO A 85 8.062 8.968 -1.319 1.00 70.32 H new ATOM 0 HG2 PRO A 85 5.169 9.958 -1.051 1.00 23.32 H new ATOM 0 HG3 PRO A 85 6.067 9.653 -2.525 1.00 23.32 H new ATOM 0 HD2 PRO A 85 4.429 7.739 -1.503 1.00 31.51 H new ATOM 0 HD3 PRO A 85 5.931 7.292 -2.287 1.00 31.51 H new ATOM 1230 N VAL A 86 7.166 9.717 2.443 1.00 30.45 N ATOM 1231 CA VAL A 86 6.742 10.610 3.531 1.00 10.24 C ATOM 1232 C VAL A 86 7.449 11.967 3.398 1.00 14.04 C ATOM 1233 O VAL A 86 8.672 12.044 3.544 1.00 63.51 O ATOM 1234 CB VAL A 86 7.022 9.981 4.910 1.00 22.12 C ATOM 1235 CG1 VAL A 86 6.567 10.901 6.042 1.00 52.14 C ATOM 1236 CG2 VAL A 86 6.284 8.661 5.074 1.00 34.13 C ATOM 0 H VAL A 86 8.180 9.655 2.354 1.00 30.45 H new ATOM 0 HA VAL A 86 5.666 10.763 3.452 1.00 10.24 H new ATOM 0 HB VAL A 86 8.099 9.822 4.961 1.00 22.12 H new ATOM 0 HG11 VAL A 86 6.778 10.429 7.002 1.00 52.14 H new ATOM 0 HG12 VAL A 86 7.102 11.849 5.978 1.00 52.14 H new ATOM 0 HG13 VAL A 86 5.496 11.083 5.955 1.00 52.14 H new ATOM 0 HG21 VAL A 86 6.502 8.242 6.056 1.00 34.13 H new ATOM 0 HG22 VAL A 86 5.211 8.830 4.981 1.00 34.13 H new ATOM 0 HG23 VAL A 86 6.610 7.964 4.302 1.00 34.13 H new ATOM 1246 N TRP A 87 6.678 13.033 3.180 1.00 30.35 N ATOM 1247 CA TRP A 87 7.118 14.423 3.149 1.00 45.30 C ATOM 1248 C TRP A 87 7.363 14.945 4.576 1.00 23.21 C ATOM 1249 O TRP A 87 7.492 14.165 5.526 1.00 45.33 O ATOM 1250 CB TRP A 87 6.082 15.265 2.351 1.00 4.33 C ATOM 1251 CG TRP A 87 6.597 15.952 1.102 1.00 33.34 C ATOM 1252 CD1 TRP A 87 7.380 17.059 1.043 1.00 70.22 C ATOM 1253 CD2 TRP A 87 6.401 15.558 -0.300 1.00 5.01 C ATOM 1254 NE1 TRP A 87 7.719 17.319 -0.275 1.00 74.41 N ATOM 1255 CE2 TRP A 87 7.204 16.389 -1.133 1.00 54.21 C ATOM 1256 CE3 TRP A 87 5.640 14.578 -0.969 1.00 43.14 C ATOM 1257 CZ2 TRP A 87 7.318 16.220 -2.520 1.00 14.20 C ATOM 1258 CZ3 TRP A 87 5.725 14.400 -2.366 1.00 21.50 C ATOM 1259 CH2 TRP A 87 6.579 15.203 -3.141 1.00 12.21 C ATOM 0 H TRP A 87 5.676 12.942 3.012 1.00 30.35 H new ATOM 0 HA TRP A 87 8.075 14.509 2.634 1.00 45.30 H new ATOM 0 HB2 TRP A 87 5.256 14.613 2.067 1.00 4.33 H new ATOM 0 HB3 TRP A 87 5.673 16.025 3.016 1.00 4.33 H new ATOM 0 HD1 TRP A 87 7.691 17.647 1.894 1.00 70.22 H new ATOM 0 HE1 TRP A 87 8.287 18.113 -0.570 1.00 74.41 H new ATOM 0 HE3 TRP A 87 4.975 13.947 -0.398 1.00 43.14 H new ATOM 0 HZ2 TRP A 87 7.964 16.862 -3.100 1.00 14.20 H new ATOM 0 HZ3 TRP A 87 5.127 13.638 -2.845 1.00 21.50 H new ATOM 0 HH2 TRP A 87 6.665 15.038 -4.205 1.00 12.21 H new ATOM 1269 N SER A 88 7.492 16.262 4.749 1.00 41.04 N ATOM 1270 CA SER A 88 7.681 16.936 6.027 1.00 43.33 C ATOM 1271 C SER A 88 6.434 16.796 6.914 1.00 51.33 C ATOM 1272 O SER A 88 5.575 17.677 6.968 1.00 2.42 O ATOM 1273 CB SER A 88 8.031 18.404 5.777 1.00 32.34 C ATOM 1274 OG SER A 88 9.133 18.527 4.893 1.00 61.11 O ATOM 0 H SER A 88 7.466 16.913 3.964 1.00 41.04 H new ATOM 0 HA SER A 88 8.506 16.466 6.563 1.00 43.33 H new ATOM 0 HB2 SER A 88 7.167 18.920 5.359 1.00 32.34 H new ATOM 0 HB3 SER A 88 8.265 18.891 6.724 1.00 32.34 H new ATOM 0 HG SER A 88 9.333 19.476 4.750 1.00 61.11 H new ATOM 1279 N GLY A 89 6.335 15.662 7.596 1.00 44.53 N ATOM 1280 CA GLY A 89 5.323 15.330 8.583 1.00 44.32 C ATOM 1281 C GLY A 89 4.308 14.337 8.053 1.00 72.23 C ATOM 1282 O GLY A 89 3.917 13.441 8.804 1.00 30.24 O ATOM 0 H GLY A 89 7.004 14.903 7.464 1.00 44.53 H new ATOM 0 HA2 GLY A 89 5.804 14.916 9.469 1.00 44.32 H new ATOM 0 HA3 GLY A 89 4.810 16.240 8.894 1.00 44.32 H new ATOM 1286 N TYR A 90 3.897 14.442 6.786 1.00 63.02 N ATOM 1287 CA TYR A 90 2.836 13.605 6.241 1.00 30.43 C ATOM 1288 C TYR A 90 3.215 13.099 4.846 1.00 12.23 C ATOM 1289 O TYR A 90 4.138 13.632 4.233 1.00 70.34 O ATOM 1290 CB TYR A 90 1.517 14.396 6.236 1.00 30.03 C ATOM 1291 CG TYR A 90 1.611 15.861 5.855 1.00 52.52 C ATOM 1292 CD1 TYR A 90 2.226 16.254 4.650 1.00 73.54 C ATOM 1293 CD2 TYR A 90 1.085 16.838 6.720 1.00 42.44 C ATOM 1294 CE1 TYR A 90 2.375 17.612 4.345 1.00 22.13 C ATOM 1295 CE2 TYR A 90 1.199 18.200 6.401 1.00 42.43 C ATOM 1296 CZ TYR A 90 1.859 18.594 5.219 1.00 50.42 C ATOM 1297 OH TYR A 90 2.028 19.915 4.933 1.00 54.22 O ATOM 0 H TYR A 90 4.290 15.105 6.118 1.00 63.02 H new ATOM 0 HA TYR A 90 2.699 12.724 6.868 1.00 30.43 H new ATOM 0 HB2 TYR A 90 0.828 13.907 5.547 1.00 30.03 H new ATOM 0 HB3 TYR A 90 1.075 14.329 7.230 1.00 30.03 H new ATOM 0 HD1 TYR A 90 2.584 15.505 3.959 1.00 73.54 H new ATOM 0 HD2 TYR A 90 0.592 16.539 7.633 1.00 42.44 H new ATOM 0 HE1 TYR A 90 2.885 17.909 3.441 1.00 22.13 H new ATOM 0 HE2 TYR A 90 0.781 18.946 7.061 1.00 42.43 H new ATOM 0 HH TYR A 90 1.612 20.458 5.635 1.00 54.22 H new ATOM 1306 N PRO A 91 2.539 12.057 4.340 1.00 62.22 N ATOM 1307 CA PRO A 91 2.704 11.582 2.970 1.00 25.34 C ATOM 1308 C PRO A 91 2.139 12.553 1.911 1.00 32.14 C ATOM 1309 O PRO A 91 1.451 13.523 2.223 1.00 23.44 O ATOM 1310 CB PRO A 91 2.023 10.209 2.939 1.00 41.44 C ATOM 1311 CG PRO A 91 1.031 10.249 4.101 1.00 61.13 C ATOM 1312 CD PRO A 91 1.700 11.158 5.115 1.00 50.12 C ATOM 0 HA PRO A 91 3.759 11.515 2.704 1.00 25.34 H new ATOM 0 HB2 PRO A 91 1.516 10.039 1.989 1.00 41.44 H new ATOM 0 HB3 PRO A 91 2.747 9.404 3.062 1.00 41.44 H new ATOM 0 HG2 PRO A 91 0.064 10.642 3.788 1.00 61.13 H new ATOM 0 HG3 PRO A 91 0.854 9.254 4.510 1.00 61.13 H new ATOM 0 HD2 PRO A 91 0.960 11.712 5.693 1.00 50.12 H new ATOM 0 HD3 PRO A 91 2.294 10.583 5.826 1.00 50.12 H new ATOM 1317 N ALA A 92 2.362 12.233 0.637 1.00 11.12 N ATOM 1318 CA ALA A 92 1.858 12.896 -0.573 1.00 13.21 C ATOM 1319 C ALA A 92 0.360 12.613 -0.831 1.00 50.23 C ATOM 1320 O ALA A 92 -0.116 12.703 -1.962 1.00 54.04 O ATOM 1321 CB ALA A 92 2.684 12.348 -1.745 1.00 31.33 C ATOM 0 H ALA A 92 2.951 11.434 0.401 1.00 11.12 H new ATOM 0 HA ALA A 92 1.953 13.976 -0.457 1.00 13.21 H new ATOM 0 HB1 ALA A 92 2.349 12.810 -2.674 1.00 31.33 H new ATOM 0 HB2 ALA A 92 3.738 12.576 -1.586 1.00 31.33 H new ATOM 0 HB3 ALA A 92 2.553 11.268 -1.809 1.00 31.33 H new ATOM 1327 N THR A 93 -0.367 12.108 0.169 1.00 22.52 N ATOM 1328 CA THR A 93 -1.680 11.457 0.054 1.00 13.11 C ATOM 1329 C THR A 93 -1.721 10.486 -1.154 1.00 73.11 C ATOM 1330 O THR A 93 -2.670 10.539 -1.932 1.00 21.32 O ATOM 1331 CB THR A 93 -2.780 12.555 0.022 1.00 34.14 C ATOM 1332 OG1 THR A 93 -2.573 13.495 -1.015 1.00 21.54 O ATOM 1333 CG2 THR A 93 -2.813 13.395 1.304 1.00 71.13 C ATOM 0 H THR A 93 -0.040 12.143 1.134 1.00 22.52 H new ATOM 0 HA THR A 93 -1.872 10.827 0.923 1.00 13.11 H new ATOM 0 HB THR A 93 -3.704 11.993 -0.116 1.00 34.14 H new ATOM 0 HG1 THR A 93 -1.794 13.229 -1.547 1.00 21.54 H new ATOM 0 HG21 THR A 93 -3.599 14.146 1.227 1.00 71.13 H new ATOM 0 HG22 THR A 93 -3.012 12.748 2.158 1.00 71.13 H new ATOM 0 HG23 THR A 93 -1.851 13.890 1.440 1.00 71.13 H new ATOM 1341 N PRO A 94 -0.772 9.542 -1.339 1.00 43.31 N ATOM 1342 CA PRO A 94 -0.660 8.852 -2.629 1.00 52.31 C ATOM 1343 C PRO A 94 -1.457 7.557 -2.709 1.00 73.43 C ATOM 1344 O PRO A 94 -1.545 6.975 -3.790 1.00 5.12 O ATOM 1345 CB PRO A 94 0.833 8.557 -2.786 1.00 74.53 C ATOM 1346 CG PRO A 94 1.246 8.258 -1.345 1.00 53.41 C ATOM 1347 CD PRO A 94 0.420 9.259 -0.545 1.00 63.23 C ATOM 0 HA PRO A 94 -1.071 9.478 -3.421 1.00 52.31 H new ATOM 0 HB2 PRO A 94 1.015 7.710 -3.448 1.00 74.53 H new ATOM 0 HB3 PRO A 94 1.376 9.407 -3.199 1.00 74.53 H new ATOM 0 HG2 PRO A 94 1.019 7.230 -1.064 1.00 53.41 H new ATOM 0 HG3 PRO A 94 2.316 8.402 -1.192 1.00 53.41 H new ATOM 0 HD2 PRO A 94 0.150 8.849 0.428 1.00 63.23 H new ATOM 0 HD3 PRO A 94 0.988 10.171 -0.360 1.00 63.23 H new ATOM 1352 N ILE A 95 -2.042 7.104 -1.601 1.00 33.54 N ATOM 1353 CA ILE A 95 -2.911 5.936 -1.578 1.00 14.10 C ATOM 1354 C ILE A 95 -4.379 6.401 -1.497 1.00 23.20 C ATOM 1355 O ILE A 95 -5.283 5.583 -1.620 1.00 31.53 O ATOM 1356 CB ILE A 95 -2.461 4.953 -0.460 1.00 11.04 C ATOM 1357 CG1 ILE A 95 -0.924 4.782 -0.337 1.00 61.32 C ATOM 1358 CG2 ILE A 95 -3.129 3.581 -0.660 1.00 63.13 C ATOM 1359 CD1 ILE A 95 -0.189 4.362 -1.620 1.00 13.34 C ATOM 0 H ILE A 95 -1.923 7.543 -0.688 1.00 33.54 H new ATOM 0 HA ILE A 95 -2.831 5.360 -2.500 1.00 14.10 H new ATOM 0 HB ILE A 95 -2.787 5.403 0.478 1.00 11.04 H new ATOM 0 HG12 ILE A 95 -0.500 5.725 0.009 1.00 61.32 H new ATOM 0 HG13 ILE A 95 -0.721 4.039 0.434 1.00 61.32 H new ATOM 0 HG21 ILE A 95 -2.807 2.901 0.128 1.00 63.13 H new ATOM 0 HG22 ILE A 95 -4.212 3.695 -0.621 1.00 63.13 H new ATOM 0 HG23 ILE A 95 -2.842 3.174 -1.630 1.00 63.13 H new ATOM 0 HD11 ILE A 95 0.878 4.273 -1.416 1.00 13.34 H new ATOM 0 HD12 ILE A 95 -0.574 3.401 -1.962 1.00 13.34 H new ATOM 0 HD13 ILE A 95 -0.349 5.113 -2.393 1.00 13.34 H new ATOM 1370 N LYS A 96 -4.652 7.708 -1.360 1.00 61.11 N ATOM 1371 CA LYS A 96 -5.985 8.268 -1.168 1.00 22.21 C ATOM 1372 C LYS A 96 -6.945 7.832 -2.281 1.00 23.33 C ATOM 1373 O LYS A 96 -8.023 7.323 -1.991 1.00 12.44 O ATOM 1374 CB LYS A 96 -5.826 9.794 -1.066 1.00 74.54 C ATOM 1375 CG LYS A 96 -7.106 10.587 -0.794 1.00 30.31 C ATOM 1376 CD LYS A 96 -7.832 10.252 0.520 1.00 65.55 C ATOM 1377 CE LYS A 96 -8.152 11.504 1.358 1.00 13.50 C ATOM 1378 NZ LYS A 96 -9.221 12.357 0.795 1.00 65.32 N ATOM 0 H LYS A 96 -3.923 8.421 -1.382 1.00 61.11 H new ATOM 0 HA LYS A 96 -6.438 7.892 -0.251 1.00 22.21 H new ATOM 0 HB2 LYS A 96 -5.112 10.012 -0.272 1.00 74.54 H new ATOM 0 HB3 LYS A 96 -5.389 10.156 -1.996 1.00 74.54 H new ATOM 0 HG2 LYS A 96 -6.860 11.649 -0.791 1.00 30.31 H new ATOM 0 HG3 LYS A 96 -7.796 10.422 -1.621 1.00 30.31 H new ATOM 0 HD2 LYS A 96 -8.759 9.724 0.294 1.00 65.55 H new ATOM 0 HD3 LYS A 96 -7.214 9.574 1.109 1.00 65.55 H new ATOM 0 HE2 LYS A 96 -8.443 11.191 2.361 1.00 13.50 H new ATOM 0 HE3 LYS A 96 -7.245 12.099 1.461 1.00 13.50 H new ATOM 0 HZ1 LYS A 96 -9.493 13.079 1.493 1.00 65.32 H new ATOM 0 HZ2 LYS A 96 -8.875 12.823 -0.068 1.00 65.32 H new ATOM 0 HZ3 LYS A 96 -10.048 11.770 0.564 1.00 65.32 H new ATOM 1388 N THR A 97 -6.554 7.993 -3.540 1.00 41.04 N ATOM 1389 CA THR A 97 -7.402 7.655 -4.683 1.00 52.01 C ATOM 1390 C THR A 97 -7.442 6.137 -4.917 1.00 10.32 C ATOM 1391 O THR A 97 -8.441 5.621 -5.422 1.00 61.13 O ATOM 1392 CB THR A 97 -6.906 8.466 -5.893 1.00 31.40 C ATOM 1393 OG1 THR A 97 -7.083 9.819 -5.543 1.00 62.13 O ATOM 1394 CG2 THR A 97 -7.638 8.206 -7.211 1.00 54.05 C ATOM 0 H THR A 97 -5.639 8.362 -3.800 1.00 41.04 H new ATOM 0 HA THR A 97 -8.441 7.928 -4.497 1.00 52.01 H new ATOM 0 HB THR A 97 -5.874 8.173 -6.086 1.00 31.40 H new ATOM 0 HG1 THR A 97 -6.630 10.389 -6.200 1.00 62.13 H new ATOM 0 HG21 THR A 97 -7.208 8.829 -7.995 1.00 54.05 H new ATOM 0 HG22 THR A 97 -7.534 7.156 -7.484 1.00 54.05 H new ATOM 0 HG23 THR A 97 -8.694 8.447 -7.094 1.00 54.05 H new ATOM 1402 N LEU A 98 -6.406 5.393 -4.521 1.00 62.53 N ATOM 1403 CA LEU A 98 -6.369 3.933 -4.620 1.00 62.25 C ATOM 1404 C LEU A 98 -7.277 3.277 -3.576 1.00 65.55 C ATOM 1405 O LEU A 98 -7.956 2.314 -3.903 1.00 11.20 O ATOM 1406 CB LEU A 98 -4.916 3.458 -4.430 1.00 13.10 C ATOM 1407 CG LEU A 98 -4.683 1.985 -4.829 1.00 30.33 C ATOM 1408 CD1 LEU A 98 -4.660 1.840 -6.353 1.00 14.14 C ATOM 1409 CD2 LEU A 98 -3.344 1.492 -4.267 1.00 65.53 C ATOM 0 H LEU A 98 -5.559 5.793 -4.118 1.00 62.53 H new ATOM 0 HA LEU A 98 -6.735 3.639 -5.604 1.00 62.25 H new ATOM 0 HB2 LEU A 98 -4.256 4.093 -5.021 1.00 13.10 H new ATOM 0 HB3 LEU A 98 -4.634 3.590 -3.385 1.00 13.10 H new ATOM 0 HG LEU A 98 -5.499 1.390 -4.419 1.00 30.33 H new ATOM 0 HD11 LEU A 98 -4.495 0.795 -6.617 1.00 14.14 H new ATOM 0 HD12 LEU A 98 -5.613 2.172 -6.764 1.00 14.14 H new ATOM 0 HD13 LEU A 98 -3.856 2.450 -6.764 1.00 14.14 H new ATOM 0 HD21 LEU A 98 -3.190 0.452 -4.554 1.00 65.53 H new ATOM 0 HD22 LEU A 98 -2.535 2.103 -4.667 1.00 65.53 H new ATOM 0 HD23 LEU A 98 -3.355 1.570 -3.180 1.00 65.53 H new ATOM 1420 N LEU A 99 -7.340 3.787 -2.341 1.00 4.33 N ATOM 1421 CA LEU A 99 -8.125 3.199 -1.262 1.00 21.54 C ATOM 1422 C LEU A 99 -9.605 3.157 -1.650 1.00 53.02 C ATOM 1423 O LEU A 99 -10.293 2.178 -1.360 1.00 72.52 O ATOM 1424 CB LEU A 99 -7.805 3.933 0.054 1.00 21.30 C ATOM 1425 CG LEU A 99 -8.799 5.044 0.457 1.00 61.34 C ATOM 1426 CD1 LEU A 99 -9.870 4.412 1.339 1.00 53.51 C ATOM 1427 CD2 LEU A 99 -8.138 6.212 1.179 1.00 43.54 C ATOM 0 H LEU A 99 -6.839 4.631 -2.064 1.00 4.33 H new ATOM 0 HA LEU A 99 -7.855 2.157 -1.092 1.00 21.54 H new ATOM 0 HB2 LEU A 99 -7.763 3.198 0.858 1.00 21.30 H new ATOM 0 HB3 LEU A 99 -6.811 4.372 -0.028 1.00 21.30 H new ATOM 0 HG LEU A 99 -9.229 5.466 -0.451 1.00 61.34 H new ATOM 0 HD11 LEU A 99 -10.589 5.174 1.641 1.00 53.51 H new ATOM 0 HD12 LEU A 99 -10.384 3.628 0.782 1.00 53.51 H new ATOM 0 HD13 LEU A 99 -9.404 3.982 2.225 1.00 53.51 H new ATOM 0 HD21 LEU A 99 -8.892 6.956 1.434 1.00 43.54 H new ATOM 0 HD22 LEU A 99 -7.660 5.853 2.091 1.00 43.54 H new ATOM 0 HD23 LEU A 99 -7.388 6.663 0.530 1.00 43.54 H new ATOM 1438 N ASP A 100 -10.085 4.182 -2.357 1.00 63.42 N ATOM 1439 CA ASP A 100 -11.480 4.304 -2.756 1.00 45.44 C ATOM 1440 C ASP A 100 -11.859 3.127 -3.654 1.00 22.23 C ATOM 1441 O ASP A 100 -12.872 2.455 -3.456 1.00 70.11 O ATOM 1442 CB ASP A 100 -11.700 5.649 -3.453 1.00 4.23 C ATOM 1443 CG ASP A 100 -13.123 6.148 -3.220 1.00 44.31 C ATOM 1444 OD1 ASP A 100 -14.088 5.607 -3.803 1.00 74.55 O ATOM 1445 OD2 ASP A 100 -13.291 7.070 -2.387 1.00 74.11 O ATOM 0 H ASP A 100 -9.504 4.959 -2.671 1.00 63.42 H new ATOM 0 HA ASP A 100 -12.126 4.276 -1.879 1.00 45.44 H new ATOM 0 HB2 ASP A 100 -10.986 6.381 -3.076 1.00 4.23 H new ATOM 0 HB3 ASP A 100 -11.516 5.545 -4.522 1.00 4.23 H new ATOM 1449 N GLN A 101 -10.963 2.799 -4.578 1.00 33.44 N ATOM 1450 CA GLN A 101 -11.098 1.723 -5.544 1.00 34.21 C ATOM 1451 C GLN A 101 -10.785 0.334 -4.967 1.00 30.23 C ATOM 1452 O GLN A 101 -10.891 -0.660 -5.683 1.00 32.22 O ATOM 1453 CB GLN A 101 -10.384 2.111 -6.836 1.00 1.10 C ATOM 1454 CG GLN A 101 -8.946 2.508 -6.696 1.00 3.41 C ATOM 1455 CD GLN A 101 -8.433 3.053 -8.017 1.00 72.32 C ATOM 1456 OE1 GLN A 101 -8.223 2.311 -8.972 1.00 23.54 O ATOM 1457 NE2 GLN A 101 -8.344 4.369 -8.135 1.00 52.45 N ATOM 0 H GLN A 101 -10.081 3.303 -4.676 1.00 33.44 H new ATOM 0 HA GLN A 101 -12.147 1.598 -5.811 1.00 34.21 H new ATOM 0 HB2 GLN A 101 -10.443 1.270 -7.527 1.00 1.10 H new ATOM 0 HB3 GLN A 101 -10.926 2.939 -7.293 1.00 1.10 H new ATOM 0 HG2 GLN A 101 -8.841 3.262 -5.916 1.00 3.41 H new ATOM 0 HG3 GLN A 101 -8.350 1.648 -6.390 1.00 3.41 H new ATOM 0 HE21 GLN A 101 -8.523 4.967 -7.328 1.00 52.45 H new ATOM 0 HE22 GLN A 101 -8.097 4.785 -9.033 1.00 52.45 H new ATOM 1464 N MET A 102 -10.495 0.236 -3.664 1.00 13.14 N ATOM 1465 CA MET A 102 -10.352 -1.026 -2.941 1.00 1.01 C ATOM 1466 C MET A 102 -11.223 -1.082 -1.672 1.00 44.33 C ATOM 1467 O MET A 102 -11.050 -1.983 -0.867 1.00 64.51 O ATOM 1468 CB MET A 102 -8.864 -1.360 -2.696 1.00 31.11 C ATOM 1469 CG MET A 102 -8.125 -0.351 -1.846 1.00 44.24 C ATOM 1470 SD MET A 102 -6.381 -0.666 -1.412 1.00 42.11 S ATOM 1471 CE MET A 102 -6.370 -2.432 -0.977 1.00 65.33 C ATOM 0 H MET A 102 -10.350 1.054 -3.072 1.00 13.14 H new ATOM 0 HA MET A 102 -10.743 -1.821 -3.576 1.00 1.01 H new ATOM 0 HB2 MET A 102 -8.798 -2.337 -2.217 1.00 31.11 H new ATOM 0 HB3 MET A 102 -8.360 -1.443 -3.659 1.00 31.11 H new ATOM 0 HG2 MET A 102 -8.167 0.608 -2.363 1.00 44.24 H new ATOM 0 HG3 MET A 102 -8.680 -0.236 -0.915 1.00 44.24 H new ATOM 0 HE1 MET A 102 -5.387 -2.707 -0.596 1.00 65.33 H new ATOM 0 HE2 MET A 102 -7.122 -2.623 -0.212 1.00 65.33 H new ATOM 0 HE3 MET A 102 -6.595 -3.026 -1.863 1.00 65.33 H new ATOM 1479 N LYS A 103 -12.193 -0.179 -1.457 1.00 30.43 N ATOM 1480 CA LYS A 103 -13.070 -0.181 -0.277 1.00 72.43 C ATOM 1481 C LYS A 103 -13.704 -1.544 0.008 1.00 63.33 C ATOM 1482 O LYS A 103 -13.797 -1.977 1.152 1.00 32.21 O ATOM 1483 CB LYS A 103 -14.171 0.879 -0.455 1.00 11.43 C ATOM 1484 CG LYS A 103 -14.353 1.790 0.759 1.00 61.11 C ATOM 1485 CD LYS A 103 -13.228 2.828 0.894 1.00 3.34 C ATOM 1486 CE LYS A 103 -13.724 4.113 1.566 1.00 10.40 C ATOM 1487 NZ LYS A 103 -14.034 3.962 2.999 1.00 62.41 N ATOM 0 H LYS A 103 -12.392 0.582 -2.106 1.00 30.43 H new ATOM 0 HA LYS A 103 -12.443 0.055 0.583 1.00 72.43 H new ATOM 0 HB2 LYS A 103 -13.935 1.492 -1.325 1.00 11.43 H new ATOM 0 HB3 LYS A 103 -15.115 0.377 -0.665 1.00 11.43 H new ATOM 0 HG2 LYS A 103 -15.310 2.305 0.681 1.00 61.11 H new ATOM 0 HG3 LYS A 103 -14.391 1.182 1.663 1.00 61.11 H new ATOM 0 HD2 LYS A 103 -12.410 2.405 1.476 1.00 3.34 H new ATOM 0 HD3 LYS A 103 -12.829 3.063 -0.093 1.00 3.34 H new ATOM 0 HE2 LYS A 103 -12.966 4.887 1.449 1.00 10.40 H new ATOM 0 HE3 LYS A 103 -14.617 4.460 1.047 1.00 10.40 H new ATOM 0 HZ1 LYS A 103 -14.867 4.538 3.237 1.00 62.41 H new ATOM 0 HZ2 LYS A 103 -14.233 2.963 3.208 1.00 62.41 H new ATOM 0 HZ3 LYS A 103 -13.221 4.279 3.565 1.00 62.41 H new ATOM 1497 N ASN A 104 -14.140 -2.212 -1.054 1.00 71.44 N ATOM 1498 CA ASN A 104 -14.818 -3.507 -1.002 1.00 23.10 C ATOM 1499 C ASN A 104 -13.891 -4.677 -0.644 1.00 34.33 C ATOM 1500 O ASN A 104 -14.361 -5.811 -0.559 1.00 23.41 O ATOM 1501 CB ASN A 104 -15.558 -3.775 -2.324 1.00 52.44 C ATOM 1502 CG ASN A 104 -14.632 -3.985 -3.519 1.00 1.22 C ATOM 1503 OD1 ASN A 104 -14.203 -5.093 -3.817 1.00 13.03 O ATOM 1504 ND2 ASN A 104 -14.317 -2.937 -4.264 1.00 73.15 N ATOM 0 H ASN A 104 -14.029 -1.859 -2.005 1.00 71.44 H new ATOM 0 HA ASN A 104 -15.540 -3.444 -0.188 1.00 23.10 H new ATOM 0 HB2 ASN A 104 -16.187 -4.657 -2.205 1.00 52.44 H new ATOM 0 HB3 ASN A 104 -16.222 -2.936 -2.534 1.00 52.44 H new ATOM 0 HD21 ASN A 104 -13.719 -3.054 -5.082 1.00 73.15 H new ATOM 0 HD22 ASN A 104 -14.672 -2.012 -4.020 1.00 73.15 H new ATOM 1510 N TYR A 105 -12.593 -4.434 -0.456 1.00 34.13 N ATOM 1511 CA TYR A 105 -11.589 -5.451 -0.199 1.00 72.03 C ATOM 1512 C TYR A 105 -11.735 -6.041 1.211 1.00 45.12 C ATOM 1513 O TYR A 105 -12.039 -5.333 2.179 1.00 13.34 O ATOM 1514 CB TYR A 105 -10.219 -4.797 -0.399 1.00 44.33 C ATOM 1515 CG TYR A 105 -9.057 -5.740 -0.291 1.00 33.32 C ATOM 1516 CD1 TYR A 105 -8.792 -6.616 -1.353 1.00 52.34 C ATOM 1517 CD2 TYR A 105 -8.262 -5.760 0.868 1.00 5.52 C ATOM 1518 CE1 TYR A 105 -7.779 -7.573 -1.228 1.00 32.53 C ATOM 1519 CE2 TYR A 105 -7.226 -6.700 0.978 1.00 13.23 C ATOM 1520 CZ TYR A 105 -7.004 -7.633 -0.053 1.00 52.22 C ATOM 1521 OH TYR A 105 -6.089 -8.620 0.108 1.00 31.45 O ATOM 0 H TYR A 105 -12.206 -3.491 -0.481 1.00 34.13 H new ATOM 0 HA TYR A 105 -11.711 -6.288 -0.887 1.00 72.03 H new ATOM 0 HB2 TYR A 105 -10.196 -4.324 -1.381 1.00 44.33 H new ATOM 0 HB3 TYR A 105 -10.097 -4.005 0.340 1.00 44.33 H new ATOM 0 HD1 TYR A 105 -9.368 -6.552 -2.264 1.00 52.34 H new ATOM 0 HD2 TYR A 105 -8.447 -5.058 1.667 1.00 5.52 H new ATOM 0 HE1 TYR A 105 -7.591 -8.267 -2.034 1.00 32.53 H new ATOM 0 HE2 TYR A 105 -6.597 -6.708 1.856 1.00 13.23 H new ATOM 0 HH TYR A 105 -6.213 -9.298 -0.589 1.00 31.45 H new ATOM 1530 N ARG A 106 -11.487 -7.347 1.327 1.00 63.44 N ATOM 1531 CA ARG A 106 -11.775 -8.216 2.473 1.00 70.04 C ATOM 1532 C ARG A 106 -10.556 -9.075 2.858 1.00 50.13 C ATOM 1533 O ARG A 106 -10.707 -10.054 3.588 1.00 63.14 O ATOM 1534 CB ARG A 106 -12.971 -9.114 2.100 1.00 11.23 C ATOM 1535 CG ARG A 106 -14.318 -8.385 1.977 1.00 43.31 C ATOM 1536 CD ARG A 106 -15.080 -8.272 3.308 1.00 30.41 C ATOM 1537 NE ARG A 106 -16.523 -8.482 3.103 1.00 44.44 N ATOM 1538 CZ ARG A 106 -17.427 -7.592 2.682 1.00 61.43 C ATOM 1539 NH1 ARG A 106 -17.099 -6.316 2.521 1.00 24.11 N ATOM 1540 NH2 ARG A 106 -18.656 -8.021 2.413 1.00 5.21 N ATOM 0 H ARG A 106 -11.047 -7.865 0.566 1.00 63.44 H new ATOM 0 HA ARG A 106 -12.013 -7.601 3.341 1.00 70.04 H new ATOM 0 HB2 ARG A 106 -12.754 -9.607 1.152 1.00 11.23 H new ATOM 0 HB3 ARG A 106 -13.066 -9.897 2.852 1.00 11.23 H new ATOM 0 HG2 ARG A 106 -14.145 -7.384 1.581 1.00 43.31 H new ATOM 0 HG3 ARG A 106 -14.942 -8.911 1.254 1.00 43.31 H new ATOM 0 HD2 ARG A 106 -14.697 -9.008 4.015 1.00 30.41 H new ATOM 0 HD3 ARG A 106 -14.910 -7.289 3.748 1.00 30.41 H new ATOM 0 HE ARG A 106 -16.874 -9.418 3.306 1.00 44.44 H new ATOM 0 HH11 ARG A 106 -16.148 -6.005 2.719 1.00 24.11 H new ATOM 0 HH12 ARG A 106 -17.798 -5.646 2.199 1.00 24.11 H new ATOM 0 HH21 ARG A 106 -18.889 -9.007 2.530 1.00 5.21 H new ATOM 0 HH22 ARG A 106 -19.366 -7.364 2.090 1.00 5.21 H new ATOM 1551 N GLY A 107 -9.360 -8.762 2.355 1.00 11.21 N ATOM 1552 CA GLY A 107 -8.117 -9.436 2.722 1.00 12.24 C ATOM 1553 C GLY A 107 -7.276 -8.548 3.632 1.00 24.43 C ATOM 1554 O GLY A 107 -7.784 -7.592 4.232 1.00 21.30 O ATOM 0 H GLY A 107 -9.228 -8.019 1.669 1.00 11.21 H new ATOM 0 HA2 GLY A 107 -8.341 -10.375 3.227 1.00 12.24 H new ATOM 0 HA3 GLY A 107 -7.552 -9.684 1.823 1.00 12.24 H new ATOM 1558 N GLU A 108 -5.995 -8.875 3.771 1.00 30.32 N ATOM 1559 CA GLU A 108 -5.029 -8.140 4.588 1.00 44.43 C ATOM 1560 C GLU A 108 -4.387 -7.026 3.764 1.00 34.21 C ATOM 1561 O GLU A 108 -4.132 -7.223 2.575 1.00 73.21 O ATOM 1562 CB GLU A 108 -3.963 -9.113 5.105 1.00 34.35 C ATOM 1563 CG GLU A 108 -4.566 -10.133 6.083 1.00 50.12 C ATOM 1564 CD GLU A 108 -3.535 -10.999 6.816 1.00 4.13 C ATOM 1565 OE1 GLU A 108 -2.315 -10.970 6.521 1.00 54.31 O ATOM 1566 OE2 GLU A 108 -3.960 -11.756 7.716 1.00 22.25 O ATOM 0 H GLU A 108 -5.585 -9.684 3.304 1.00 30.32 H new ATOM 0 HA GLU A 108 -5.538 -7.685 5.438 1.00 44.43 H new ATOM 0 HB2 GLU A 108 -3.508 -9.637 4.265 1.00 34.35 H new ATOM 0 HB3 GLU A 108 -3.169 -8.556 5.601 1.00 34.35 H new ATOM 0 HG2 GLU A 108 -5.164 -9.599 6.822 1.00 50.12 H new ATOM 0 HG3 GLU A 108 -5.245 -10.786 5.534 1.00 50.12 H new ATOM 1571 N VAL A 109 -4.093 -5.879 4.385 1.00 50.40 N ATOM 1572 CA VAL A 109 -3.445 -4.750 3.725 1.00 14.24 C ATOM 1573 C VAL A 109 -2.366 -4.194 4.652 1.00 5.24 C ATOM 1574 O VAL A 109 -2.638 -3.911 5.823 1.00 64.34 O ATOM 1575 CB VAL A 109 -4.480 -3.671 3.334 1.00 42.23 C ATOM 1576 CG1 VAL A 109 -3.864 -2.667 2.354 1.00 71.40 C ATOM 1577 CG2 VAL A 109 -5.723 -4.238 2.639 1.00 13.11 C ATOM 0 H VAL A 109 -4.302 -5.711 5.369 1.00 50.40 H new ATOM 0 HA VAL A 109 -2.977 -5.082 2.798 1.00 14.24 H new ATOM 0 HB VAL A 109 -4.773 -3.208 4.276 1.00 42.23 H new ATOM 0 HG11 VAL A 109 -4.607 -1.914 2.089 1.00 71.40 H new ATOM 0 HG12 VAL A 109 -3.007 -2.182 2.821 1.00 71.40 H new ATOM 0 HG13 VAL A 109 -3.540 -3.189 1.454 1.00 71.40 H new ATOM 0 HG21 VAL A 109 -6.406 -3.424 2.394 1.00 13.11 H new ATOM 0 HG22 VAL A 109 -5.426 -4.751 1.724 1.00 13.11 H new ATOM 0 HG23 VAL A 109 -6.222 -4.942 3.304 1.00 13.11 H new ATOM 1587 N ALA A 110 -1.148 -3.974 4.161 1.00 72.44 N ATOM 1588 CA ALA A 110 -0.128 -3.220 4.892 1.00 34.13 C ATOM 1589 C ALA A 110 0.403 -2.090 4.016 1.00 73.30 C ATOM 1590 O ALA A 110 0.239 -2.127 2.796 1.00 61.12 O ATOM 1591 CB ALA A 110 0.982 -4.150 5.376 1.00 11.32 C ATOM 0 H ALA A 110 -0.840 -4.311 3.249 1.00 72.44 H new ATOM 0 HA ALA A 110 -0.572 -2.770 5.780 1.00 34.13 H new ATOM 0 HB1 ALA A 110 1.731 -3.572 5.917 1.00 11.32 H new ATOM 0 HB2 ALA A 110 0.560 -4.907 6.038 1.00 11.32 H new ATOM 0 HB3 ALA A 110 1.448 -4.636 4.519 1.00 11.32 H new ATOM 1597 N SER A 111 1.018 -1.086 4.643 1.00 51.40 N ATOM 1598 CA SER A 111 1.368 0.172 4.000 1.00 52.30 C ATOM 1599 C SER A 111 2.734 0.612 4.525 1.00 73.54 C ATOM 1600 O SER A 111 2.943 0.699 5.738 1.00 44.50 O ATOM 1601 CB SER A 111 0.247 1.179 4.283 1.00 11.45 C ATOM 1602 OG SER A 111 0.284 2.270 3.389 1.00 11.34 O ATOM 0 H SER A 111 1.289 -1.129 5.625 1.00 51.40 H new ATOM 0 HA SER A 111 1.455 0.082 2.917 1.00 52.30 H new ATOM 0 HB2 SER A 111 -0.719 0.679 4.206 1.00 11.45 H new ATOM 0 HB3 SER A 111 0.336 1.544 5.306 1.00 11.45 H new ATOM 0 HG SER A 111 0.930 2.934 3.709 1.00 11.34 H new ATOM 1607 N PHE A 112 3.687 0.843 3.627 1.00 62.10 N ATOM 1608 CA PHE A 112 5.112 0.862 3.924 1.00 64.33 C ATOM 1609 C PHE A 112 5.714 2.173 3.480 1.00 22.14 C ATOM 1610 O PHE A 112 5.453 2.647 2.373 1.00 12.33 O ATOM 1611 CB PHE A 112 5.779 -0.270 3.138 1.00 10.23 C ATOM 1612 CG PHE A 112 5.184 -1.636 3.381 1.00 13.12 C ATOM 1613 CD1 PHE A 112 4.712 -2.009 4.654 1.00 50.12 C ATOM 1614 CD2 PHE A 112 5.105 -2.540 2.312 1.00 51.32 C ATOM 1615 CE1 PHE A 112 4.185 -3.287 4.851 1.00 52.24 C ATOM 1616 CE2 PHE A 112 4.623 -3.839 2.528 1.00 12.01 C ATOM 1617 CZ PHE A 112 4.186 -4.218 3.805 1.00 32.51 C ATOM 0 H PHE A 112 3.481 1.027 2.645 1.00 62.10 H new ATOM 0 HA PHE A 112 5.265 0.739 4.996 1.00 64.33 H new ATOM 0 HB2 PHE A 112 5.714 -0.044 2.074 1.00 10.23 H new ATOM 0 HB3 PHE A 112 6.838 -0.298 3.394 1.00 10.23 H new ATOM 0 HD1 PHE A 112 4.757 -1.309 5.475 1.00 50.12 H new ATOM 0 HD2 PHE A 112 5.415 -2.236 1.323 1.00 51.32 H new ATOM 0 HE1 PHE A 112 3.775 -3.558 5.813 1.00 52.24 H new ATOM 0 HE2 PHE A 112 4.589 -4.546 1.712 1.00 12.01 H new ATOM 0 HZ PHE A 112 3.850 -5.229 3.982 1.00 32.51 H new ATOM 1626 N PHE A 113 6.579 2.749 4.302 1.00 14.31 N ATOM 1627 CA PHE A 113 7.084 4.095 4.082 1.00 34.23 C ATOM 1628 C PHE A 113 8.608 4.100 4.134 1.00 21.44 C ATOM 1629 O PHE A 113 9.208 3.028 4.194 1.00 71.10 O ATOM 1630 CB PHE A 113 6.359 5.048 5.039 1.00 54.13 C ATOM 1631 CG PHE A 113 4.855 5.121 4.765 1.00 72.53 C ATOM 1632 CD1 PHE A 113 3.999 4.105 5.242 1.00 41.02 C ATOM 1633 CD2 PHE A 113 4.315 6.132 3.944 1.00 1.04 C ATOM 1634 CE1 PHE A 113 2.646 4.076 4.870 1.00 14.02 C ATOM 1635 CE2 PHE A 113 2.948 6.132 3.620 1.00 2.42 C ATOM 1636 CZ PHE A 113 2.114 5.094 4.066 1.00 52.41 C ATOM 0 H PHE A 113 6.949 2.297 5.138 1.00 14.31 H new ATOM 0 HA PHE A 113 6.863 4.466 3.081 1.00 34.23 H new ATOM 0 HB2 PHE A 113 6.523 4.721 6.066 1.00 54.13 H new ATOM 0 HB3 PHE A 113 6.790 6.045 4.950 1.00 54.13 H new ATOM 0 HD1 PHE A 113 4.389 3.342 5.900 1.00 41.02 H new ATOM 0 HD2 PHE A 113 4.957 6.912 3.561 1.00 1.04 H new ATOM 0 HE1 PHE A 113 2.013 3.267 5.204 1.00 14.02 H new ATOM 0 HE2 PHE A 113 2.537 6.934 3.025 1.00 2.42 H new ATOM 0 HZ PHE A 113 1.070 5.080 3.791 1.00 52.41 H new ATOM 1645 N THR A 114 9.247 5.269 4.040 1.00 3.15 N ATOM 1646 CA THR A 114 10.714 5.353 3.943 1.00 42.14 C ATOM 1647 C THR A 114 11.355 6.563 4.656 1.00 33.21 C ATOM 1648 O THR A 114 12.410 7.043 4.239 1.00 51.44 O ATOM 1649 CB THR A 114 11.094 5.391 2.455 1.00 5.31 C ATOM 1650 OG1 THR A 114 10.469 6.488 1.807 1.00 70.12 O ATOM 1651 CG2 THR A 114 10.731 4.118 1.697 1.00 63.24 C ATOM 0 H THR A 114 8.775 6.173 4.029 1.00 3.15 H new ATOM 0 HA THR A 114 11.104 4.475 4.458 1.00 42.14 H new ATOM 0 HB THR A 114 12.179 5.492 2.437 1.00 5.31 H new ATOM 0 HG1 THR A 114 10.724 6.497 0.861 1.00 70.12 H new ATOM 0 HG21 THR A 114 11.029 4.218 0.653 1.00 63.24 H new ATOM 0 HG22 THR A 114 11.249 3.269 2.142 1.00 63.24 H new ATOM 0 HG23 THR A 114 9.655 3.956 1.753 1.00 63.24 H new ATOM 1659 N SER A 115 10.670 7.146 5.634 1.00 3.14 N ATOM 1660 CA SER A 115 10.959 8.486 6.159 1.00 12.45 C ATOM 1661 C SER A 115 12.389 8.677 6.705 1.00 53.12 C ATOM 1662 O SER A 115 13.099 7.724 7.026 1.00 53.43 O ATOM 1663 CB SER A 115 9.940 8.878 7.241 1.00 1.42 C ATOM 1664 OG SER A 115 8.863 7.966 7.386 1.00 72.24 O ATOM 0 H SER A 115 9.881 6.695 6.097 1.00 3.14 H new ATOM 0 HA SER A 115 10.876 9.145 5.295 1.00 12.45 H new ATOM 0 HB2 SER A 115 10.458 8.966 8.196 1.00 1.42 H new ATOM 0 HB3 SER A 115 9.537 9.863 7.005 1.00 1.42 H new ATOM 0 HG SER A 115 8.260 8.281 8.091 1.00 72.24 H new ATOM 1669 N ALA A 116 12.764 9.935 6.955 1.00 70.44 N ATOM 1670 CA ALA A 116 14.069 10.375 7.435 1.00 13.34 C ATOM 1671 C ALA A 116 14.137 10.313 8.970 1.00 63.12 C ATOM 1672 O ALA A 116 14.794 11.140 9.618 1.00 71.31 O ATOM 1673 CB ALA A 116 14.292 11.796 6.909 1.00 13.45 C ATOM 0 H ALA A 116 12.123 10.717 6.818 1.00 70.44 H new ATOM 0 HA ALA A 116 14.859 9.719 7.070 1.00 13.34 H new ATOM 0 HB1 ALA A 116 15.261 12.162 7.248 1.00 13.45 H new ATOM 0 HB2 ALA A 116 14.268 11.789 5.819 1.00 13.45 H new ATOM 0 HB3 ALA A 116 13.506 12.451 7.285 1.00 13.45 H new ATOM 1679 N GLY A 117 13.384 9.383 9.567 1.00 53.31 N ATOM 1680 CA GLY A 117 13.346 9.156 11.004 1.00 2.12 C ATOM 1681 C GLY A 117 12.634 10.252 11.795 1.00 2.12 C ATOM 1682 O GLY A 117 12.554 10.217 13.028 1.00 54.33 O ATOM 0 H GLY A 117 12.772 8.755 9.046 1.00 53.31 H new ATOM 0 HA2 GLY A 117 12.850 8.205 11.197 1.00 2.12 H new ATOM 0 HA3 GLY A 117 14.368 9.063 11.373 1.00 2.12 H new ATOM 1686 N THR A 118 12.110 11.247 11.103 1.00 63.12 N ATOM 1687 CA THR A 118 11.334 12.355 11.606 1.00 31.25 C ATOM 1688 C THR A 118 9.856 11.966 11.585 1.00 71.44 C ATOM 1689 O THR A 118 9.457 11.084 10.817 1.00 45.50 O ATOM 1690 CB THR A 118 11.628 13.543 10.675 1.00 70.40 C ATOM 1691 OG1 THR A 118 11.714 13.087 9.330 1.00 21.23 O ATOM 1692 CG2 THR A 118 12.966 14.185 11.048 1.00 11.33 C ATOM 0 H THR A 118 12.229 11.301 10.091 1.00 63.12 H new ATOM 0 HA THR A 118 11.587 12.620 12.633 1.00 31.25 H new ATOM 0 HB THR A 118 10.824 14.271 10.779 1.00 70.40 H new ATOM 0 HG1 THR A 118 11.900 13.846 8.739 1.00 21.23 H new ATOM 0 HG21 THR A 118 13.164 15.025 10.383 1.00 11.33 H new ATOM 0 HG22 THR A 118 12.925 14.540 12.078 1.00 11.33 H new ATOM 0 HG23 THR A 118 13.763 13.448 10.950 1.00 11.33 H new ATOM 1700 N ASN A 119 9.035 12.631 12.405 1.00 41.42 N ATOM 1701 CA ASN A 119 7.574 12.541 12.399 1.00 73.43 C ATOM 1702 C ASN A 119 7.076 11.089 12.378 1.00 14.44 C ATOM 1703 O ASN A 119 6.108 10.739 11.696 1.00 44.22 O ATOM 1704 CB ASN A 119 7.023 13.415 11.263 1.00 70.42 C ATOM 1705 CG ASN A 119 7.229 14.884 11.596 1.00 72.34 C ATOM 1706 OD1 ASN A 119 6.481 15.457 12.376 1.00 10.22 O ATOM 1707 ND2 ASN A 119 8.244 15.533 11.057 1.00 64.41 N ATOM 0 H ASN A 119 9.385 13.271 13.118 1.00 41.42 H new ATOM 0 HA ASN A 119 7.180 12.935 13.336 1.00 73.43 H new ATOM 0 HB2 ASN A 119 7.526 13.171 10.327 1.00 70.42 H new ATOM 0 HB3 ASN A 119 5.962 13.211 11.117 1.00 70.42 H new ATOM 0 HD21 ASN A 119 8.405 16.513 11.291 1.00 64.41 H new ATOM 0 HD22 ASN A 119 8.868 15.055 10.407 1.00 64.41 H new ATOM 1713 N HIS A 120 7.776 10.209 13.099 1.00 41.13 N ATOM 1714 CA HIS A 120 7.610 8.763 12.974 1.00 43.43 C ATOM 1715 C HIS A 120 6.327 8.237 13.621 1.00 2.42 C ATOM 1716 O HIS A 120 5.991 7.067 13.454 1.00 70.41 O ATOM 1717 CB HIS A 120 8.821 8.052 13.584 1.00 44.52 C ATOM 1718 CG HIS A 120 8.795 7.955 15.095 1.00 41.23 C ATOM 1719 ND1 HIS A 120 9.022 8.981 15.982 1.00 72.04 N ATOM 1720 CD2 HIS A 120 8.507 6.837 15.828 1.00 42.31 C ATOM 1721 CE1 HIS A 120 8.860 8.501 17.224 1.00 11.11 C ATOM 1722 NE2 HIS A 120 8.569 7.188 17.182 1.00 5.31 N ATOM 0 H HIS A 120 8.476 10.483 13.788 1.00 41.13 H new ATOM 0 HA HIS A 120 7.532 8.549 11.908 1.00 43.43 H new ATOM 0 HB2 HIS A 120 8.883 7.046 13.169 1.00 44.52 H new ATOM 0 HB3 HIS A 120 9.726 8.578 13.282 1.00 44.52 H new ATOM 0 HD2 HIS A 120 8.274 5.859 15.433 1.00 42.31 H new ATOM 0 HE1 HIS A 120 8.950 9.085 18.128 1.00 11.11 H new ATOM 0 HE2 HIS A 120 8.422 6.570 17.980 1.00 5.31 H new ATOM 1729 N LYS A 121 5.597 9.061 14.367 1.00 12.55 N ATOM 1730 CA LYS A 121 4.225 8.751 14.752 1.00 22.13 C ATOM 1731 C LYS A 121 3.261 9.439 13.791 1.00 50.51 C ATOM 1732 O LYS A 121 2.299 8.802 13.362 1.00 25.32 O ATOM 1733 CB LYS A 121 3.998 9.155 16.214 1.00 24.44 C ATOM 1734 CG LYS A 121 3.769 7.950 17.141 1.00 14.25 C ATOM 1735 CD LYS A 121 2.387 7.281 16.994 1.00 43.40 C ATOM 1736 CE LYS A 121 2.322 6.026 16.110 1.00 1.53 C ATOM 1737 NZ LYS A 121 3.095 4.891 16.652 1.00 21.35 N ATOM 0 H LYS A 121 5.937 9.956 14.719 1.00 12.55 H new ATOM 0 HA LYS A 121 4.039 7.679 14.684 1.00 22.13 H new ATOM 0 HB2 LYS A 121 4.861 9.720 16.567 1.00 24.44 H new ATOM 0 HB3 LYS A 121 3.136 9.820 16.272 1.00 24.44 H new ATOM 0 HG2 LYS A 121 4.541 7.206 16.945 1.00 14.25 H new ATOM 0 HG3 LYS A 121 3.893 8.274 18.174 1.00 14.25 H new ATOM 0 HD2 LYS A 121 2.029 7.016 17.989 1.00 43.40 H new ATOM 0 HD3 LYS A 121 1.693 8.018 16.591 1.00 43.40 H new ATOM 0 HE2 LYS A 121 1.281 5.725 15.994 1.00 1.53 H new ATOM 0 HE3 LYS A 121 2.696 6.270 15.116 1.00 1.53 H new ATOM 0 HZ1 LYS A 121 2.917 4.043 16.077 1.00 21.35 H new ATOM 0 HZ2 LYS A 121 4.109 5.119 16.628 1.00 21.35 H new ATOM 0 HZ3 LYS A 121 2.804 4.710 17.634 1.00 21.35 H new ATOM 1747 N ALA A 122 3.544 10.688 13.405 1.00 45.41 N ATOM 1748 CA ALA A 122 2.621 11.496 12.616 1.00 54.20 C ATOM 1749 C ALA A 122 2.342 10.880 11.242 1.00 22.31 C ATOM 1750 O ALA A 122 1.214 10.928 10.777 1.00 30.31 O ATOM 1751 CB ALA A 122 3.118 12.944 12.494 1.00 42.51 C ATOM 0 H ALA A 122 4.418 11.162 13.632 1.00 45.41 H new ATOM 0 HA ALA A 122 1.671 11.512 13.150 1.00 54.20 H new ATOM 0 HB1 ALA A 122 2.410 13.523 11.901 1.00 42.51 H new ATOM 0 HB2 ALA A 122 3.204 13.384 13.487 1.00 42.51 H new ATOM 0 HB3 ALA A 122 4.093 12.954 12.007 1.00 42.51 H new ATOM 1757 N TYR A 123 3.326 10.240 10.605 1.00 22.33 N ATOM 1758 CA TYR A 123 3.134 9.548 9.329 1.00 41.54 C ATOM 1759 C TYR A 123 2.050 8.474 9.496 1.00 2.44 C ATOM 1760 O TYR A 123 1.096 8.434 8.712 1.00 23.23 O ATOM 1761 CB TYR A 123 4.503 9.009 8.867 1.00 41.31 C ATOM 1762 CG TYR A 123 4.899 7.581 9.169 1.00 50.51 C ATOM 1763 CD1 TYR A 123 5.608 7.282 10.339 1.00 10.54 C ATOM 1764 CD2 TYR A 123 4.665 6.569 8.227 1.00 23.31 C ATOM 1765 CE1 TYR A 123 6.102 5.985 10.570 1.00 65.04 C ATOM 1766 CE2 TYR A 123 5.105 5.260 8.468 1.00 33.23 C ATOM 1767 CZ TYR A 123 5.836 4.966 9.636 1.00 12.42 C ATOM 1768 OH TYR A 123 6.269 3.700 9.857 1.00 71.14 O ATOM 0 H TYR A 123 4.280 10.187 10.961 1.00 22.33 H new ATOM 0 HA TYR A 123 2.773 10.213 8.544 1.00 41.54 H new ATOM 0 HB2 TYR A 123 4.552 9.136 7.786 1.00 41.31 H new ATOM 0 HB3 TYR A 123 5.267 9.655 9.299 1.00 41.31 H new ATOM 0 HD1 TYR A 123 5.778 8.056 11.073 1.00 10.54 H new ATOM 0 HD2 TYR A 123 4.143 6.799 7.310 1.00 23.31 H new ATOM 0 HE1 TYR A 123 6.681 5.773 11.457 1.00 65.04 H new ATOM 0 HE2 TYR A 123 4.884 4.477 7.758 1.00 33.23 H new ATOM 0 HH TYR A 123 5.526 3.074 9.732 1.00 71.14 H new ATOM 1777 N VAL A 124 2.151 7.663 10.556 1.00 42.24 N ATOM 1778 CA VAL A 124 1.230 6.575 10.844 1.00 31.13 C ATOM 1779 C VAL A 124 -0.174 7.142 11.106 1.00 73.04 C ATOM 1780 O VAL A 124 -1.168 6.553 10.681 1.00 5.25 O ATOM 1781 CB VAL A 124 1.710 5.738 12.057 1.00 70.02 C ATOM 1782 CG1 VAL A 124 0.929 4.422 12.184 1.00 32.43 C ATOM 1783 CG2 VAL A 124 3.203 5.396 11.992 1.00 31.33 C ATOM 0 H VAL A 124 2.895 7.753 11.248 1.00 42.24 H new ATOM 0 HA VAL A 124 1.196 5.913 9.978 1.00 31.13 H new ATOM 0 HB VAL A 124 1.528 6.370 12.926 1.00 70.02 H new ATOM 0 HG11 VAL A 124 1.295 3.864 13.046 1.00 32.43 H new ATOM 0 HG12 VAL A 124 -0.131 4.639 12.315 1.00 32.43 H new ATOM 0 HG13 VAL A 124 1.068 3.828 11.281 1.00 32.43 H new ATOM 0 HG21 VAL A 124 3.480 4.809 12.868 1.00 31.33 H new ATOM 0 HG22 VAL A 124 3.405 4.819 11.090 1.00 31.33 H new ATOM 0 HG23 VAL A 124 3.787 6.316 11.972 1.00 31.33 H new ATOM 1793 N SER A 125 -0.279 8.259 11.836 1.00 74.43 N ATOM 1794 CA SER A 125 -1.570 8.833 12.189 1.00 10.13 C ATOM 1795 C SER A 125 -2.229 9.503 10.983 1.00 11.30 C ATOM 1796 O SER A 125 -3.442 9.409 10.800 1.00 12.22 O ATOM 1797 CB SER A 125 -1.386 9.822 13.351 1.00 13.33 C ATOM 1798 OG SER A 125 -0.569 10.923 13.055 1.00 14.51 O ATOM 0 H SER A 125 0.522 8.780 12.192 1.00 74.43 H new ATOM 0 HA SER A 125 -2.239 8.034 12.509 1.00 10.13 H new ATOM 0 HB2 SER A 125 -2.366 10.186 13.660 1.00 13.33 H new ATOM 0 HB3 SER A 125 -0.961 9.289 14.201 1.00 13.33 H new ATOM 0 HG SER A 125 -0.076 10.751 12.225 1.00 14.51 H new ATOM 1803 N HIS A 126 -1.437 10.195 10.165 1.00 52.21 N ATOM 1804 CA HIS A 126 -1.944 11.005 9.071 1.00 25.22 C ATOM 1805 C HIS A 126 -2.627 10.134 8.044 1.00 5.44 C ATOM 1806 O HIS A 126 -3.819 10.312 7.808 1.00 1.12 O ATOM 1807 CB HIS A 126 -0.856 11.846 8.391 1.00 32.32 C ATOM 1808 CG HIS A 126 -1.480 13.032 7.710 1.00 73.44 C ATOM 1809 ND1 HIS A 126 -1.630 13.237 6.356 1.00 4.43 N ATOM 1810 CD2 HIS A 126 -2.109 14.060 8.359 1.00 74.05 C ATOM 1811 CE1 HIS A 126 -2.320 14.375 6.203 1.00 65.42 C ATOM 1812 NE2 HIS A 126 -2.664 14.895 7.392 1.00 24.42 N ATOM 0 H HIS A 126 -0.420 10.206 10.248 1.00 52.21 H new ATOM 0 HA HIS A 126 -2.661 11.699 9.509 1.00 25.22 H new ATOM 0 HB2 HIS A 126 -0.128 12.181 9.130 1.00 32.32 H new ATOM 0 HB3 HIS A 126 -0.316 11.240 7.663 1.00 32.32 H new ATOM 0 HD2 HIS A 126 -2.165 14.199 9.429 1.00 74.05 H new ATOM 0 HE1 HIS A 126 -2.567 14.816 5.249 1.00 65.42 H new ATOM 0 HE2 HIS A 126 -3.221 15.734 7.555 1.00 24.42 H new ATOM 1819 N PHE A 127 -1.891 9.191 7.440 1.00 72.02 N ATOM 1820 CA PHE A 127 -2.423 8.446 6.314 1.00 10.21 C ATOM 1821 C PHE A 127 -3.702 7.723 6.732 1.00 42.43 C ATOM 1822 O PHE A 127 -4.597 7.621 5.911 1.00 54.15 O ATOM 1823 CB PHE A 127 -1.373 7.501 5.709 1.00 5.34 C ATOM 1824 CG PHE A 127 -1.418 6.071 6.203 1.00 34.02 C ATOM 1825 CD1 PHE A 127 -1.090 5.786 7.539 1.00 30.04 C ATOM 1826 CD2 PHE A 127 -1.854 5.038 5.350 1.00 2.13 C ATOM 1827 CE1 PHE A 127 -1.196 4.474 8.030 1.00 65.43 C ATOM 1828 CE2 PHE A 127 -1.968 3.727 5.848 1.00 2.43 C ATOM 1829 CZ PHE A 127 -1.644 3.445 7.186 1.00 32.31 C ATOM 0 H PHE A 127 -0.942 8.936 7.714 1.00 72.02 H new ATOM 0 HA PHE A 127 -2.681 9.144 5.518 1.00 10.21 H new ATOM 0 HB2 PHE A 127 -1.496 7.496 4.626 1.00 5.34 H new ATOM 0 HB3 PHE A 127 -0.383 7.907 5.916 1.00 5.34 H new ATOM 0 HD1 PHE A 127 -0.755 6.579 8.191 1.00 30.04 H new ATOM 0 HD2 PHE A 127 -2.099 5.251 4.320 1.00 2.13 H new ATOM 0 HE1 PHE A 127 -0.933 4.257 9.055 1.00 65.43 H new ATOM 0 HE2 PHE A 127 -2.306 2.933 5.198 1.00 2.43 H new ATOM 0 HZ PHE A 127 -1.739 2.438 7.565 1.00 32.31 H new ATOM 1838 N ASN A 128 -3.814 7.315 8.005 1.00 43.51 N ATOM 1839 CA ASN A 128 -4.979 6.654 8.573 1.00 31.30 C ATOM 1840 C ASN A 128 -6.251 7.466 8.357 1.00 10.51 C ATOM 1841 O ASN A 128 -7.220 6.917 7.847 1.00 30.22 O ATOM 1842 CB ASN A 128 -4.767 6.337 10.065 1.00 52.34 C ATOM 1843 CG ASN A 128 -4.429 4.871 10.261 1.00 51.51 C ATOM 1844 OD1 ASN A 128 -5.252 4.014 9.963 1.00 32.00 O ATOM 1845 ND2 ASN A 128 -3.242 4.549 10.746 1.00 30.03 N ATOM 0 H ASN A 128 -3.064 7.445 8.684 1.00 43.51 H new ATOM 0 HA ASN A 128 -5.105 5.709 8.045 1.00 31.30 H new ATOM 0 HB2 ASN A 128 -3.963 6.957 10.462 1.00 52.34 H new ATOM 0 HB3 ASN A 128 -5.668 6.585 10.626 1.00 52.34 H new ATOM 0 HD21 ASN A 128 -2.994 3.569 10.879 1.00 30.03 H new ATOM 0 HD22 ASN A 128 -2.574 5.281 10.987 1.00 30.03 H new ATOM 1851 N GLU A 129 -6.276 8.767 8.673 1.00 71.41 N ATOM 1852 CA GLU A 129 -7.448 9.614 8.458 1.00 4.23 C ATOM 1853 C GLU A 129 -7.875 9.675 6.992 1.00 63.33 C ATOM 1854 O GLU A 129 -9.026 9.966 6.680 1.00 5.30 O ATOM 1855 CB GLU A 129 -7.089 11.024 8.947 1.00 54.45 C ATOM 1856 CG GLU A 129 -8.002 11.449 10.085 1.00 22.24 C ATOM 1857 CD GLU A 129 -9.354 11.971 9.579 1.00 63.45 C ATOM 1858 OE1 GLU A 129 -9.421 13.113 9.074 1.00 25.32 O ATOM 1859 OE2 GLU A 129 -10.375 11.257 9.716 1.00 44.22 O ATOM 0 H GLU A 129 -5.483 9.259 9.085 1.00 71.41 H new ATOM 0 HA GLU A 129 -8.290 9.192 9.007 1.00 4.23 H new ATOM 0 HB2 GLU A 129 -6.051 11.045 9.280 1.00 54.45 H new ATOM 0 HB3 GLU A 129 -7.174 11.732 8.123 1.00 54.45 H new ATOM 0 HG2 GLU A 129 -8.168 10.602 10.751 1.00 22.24 H new ATOM 0 HG3 GLU A 129 -7.511 12.225 10.672 1.00 22.24 H new ATOM 1864 N TRP A 130 -6.951 9.359 6.095 1.00 24.44 N ATOM 1865 CA TRP A 130 -7.097 9.412 4.660 1.00 61.44 C ATOM 1866 C TRP A 130 -6.926 7.998 4.087 1.00 64.22 C ATOM 1867 O TRP A 130 -6.451 7.866 2.959 1.00 45.43 O ATOM 1868 CB TRP A 130 -6.048 10.405 4.143 1.00 42.34 C ATOM 1869 CG TRP A 130 -5.963 11.723 4.854 1.00 24.21 C ATOM 1870 CD1 TRP A 130 -4.890 12.139 5.563 1.00 34.10 C ATOM 1871 CD2 TRP A 130 -6.952 12.797 4.970 1.00 70.11 C ATOM 1872 NE1 TRP A 130 -5.141 13.374 6.114 1.00 64.02 N ATOM 1873 CE2 TRP A 130 -6.371 13.852 5.735 1.00 12.43 C ATOM 1874 CE3 TRP A 130 -8.273 13.000 4.518 1.00 5.51 C ATOM 1875 CZ2 TRP A 130 -7.030 15.059 5.989 1.00 41.13 C ATOM 1876 CZ3 TRP A 130 -8.941 14.218 4.751 1.00 73.01 C ATOM 1877 CH2 TRP A 130 -8.324 15.246 5.482 1.00 12.13 C ATOM 0 H TRP A 130 -6.024 9.040 6.375 1.00 24.44 H new ATOM 0 HA TRP A 130 -8.084 9.754 4.347 1.00 61.44 H new ATOM 0 HB2 TRP A 130 -5.070 9.926 4.196 1.00 42.34 H new ATOM 0 HB3 TRP A 130 -6.252 10.599 3.090 1.00 42.34 H new ATOM 0 HD1 TRP A 130 -3.971 11.584 5.680 1.00 34.10 H new ATOM 0 HE1 TRP A 130 -4.495 13.872 6.727 1.00 64.02 H new ATOM 0 HE3 TRP A 130 -8.780 12.209 3.985 1.00 5.51 H new ATOM 0 HZ2 TRP A 130 -6.550 15.835 6.567 1.00 41.13 H new ATOM 0 HZ3 TRP A 130 -9.939 14.363 4.363 1.00 73.01 H new ATOM 0 HH2 TRP A 130 -8.844 16.177 5.653 1.00 12.13 H new ATOM 1887 N ALA A 131 -7.217 6.950 4.872 1.00 64.31 N ATOM 1888 CA ALA A 131 -7.090 5.533 4.534 1.00 13.41 C ATOM 1889 C ALA A 131 -8.131 4.660 5.241 1.00 74.23 C ATOM 1890 O ALA A 131 -8.288 3.497 4.859 1.00 33.23 O ATOM 1891 CB ALA A 131 -5.701 5.014 4.916 1.00 31.30 C ATOM 0 H ALA A 131 -7.570 7.083 5.820 1.00 64.31 H new ATOM 0 HA ALA A 131 -7.251 5.464 3.458 1.00 13.41 H new ATOM 0 HB1 ALA A 131 -5.623 3.958 4.658 1.00 31.30 H new ATOM 0 HB2 ALA A 131 -4.941 5.577 4.374 1.00 31.30 H new ATOM 0 HB3 ALA A 131 -5.549 5.137 5.988 1.00 31.30 H new ATOM 1897 N ASP A 132 -8.781 5.161 6.293 1.00 3.40 N ATOM 1898 CA ASP A 132 -9.646 4.358 7.134 1.00 52.11 C ATOM 1899 C ASP A 132 -10.875 3.955 6.330 1.00 5.40 C ATOM 1900 O ASP A 132 -11.530 4.776 5.677 1.00 2.24 O ATOM 1901 CB ASP A 132 -9.975 5.055 8.469 1.00 24.00 C ATOM 1902 CG ASP A 132 -10.073 4.059 9.629 1.00 13.41 C ATOM 1903 OD1 ASP A 132 -9.261 3.104 9.693 1.00 25.43 O ATOM 1904 OD2 ASP A 132 -10.959 4.245 10.496 1.00 11.12 O ATOM 0 H ASP A 132 -8.717 6.138 6.580 1.00 3.40 H new ATOM 0 HA ASP A 132 -9.126 3.447 7.431 1.00 52.11 H new ATOM 0 HB2 ASP A 132 -9.206 5.795 8.691 1.00 24.00 H new ATOM 0 HB3 ASP A 132 -10.918 5.594 8.374 1.00 24.00 H new ATOM 1908 N GLY A 133 -11.108 2.652 6.304 1.00 4.23 N ATOM 1909 CA GLY A 133 -11.963 1.967 5.360 1.00 50.43 C ATOM 1910 C GLY A 133 -11.328 0.687 4.822 1.00 32.01 C ATOM 1911 O GLY A 133 -12.024 -0.048 4.121 1.00 21.40 O ATOM 0 H GLY A 133 -10.682 2.015 6.977 1.00 4.23 H new ATOM 0 HA2 GLY A 133 -12.910 1.725 5.841 1.00 50.43 H new ATOM 0 HA3 GLY A 133 -12.189 2.634 4.528 1.00 50.43 H new ATOM 1915 N LEU A 134 -10.047 0.417 5.114 1.00 22.23 N ATOM 1916 CA LEU A 134 -9.312 -0.772 4.686 1.00 30.23 C ATOM 1917 C LEU A 134 -8.682 -1.457 5.902 1.00 22.10 C ATOM 1918 O LEU A 134 -8.327 -0.800 6.884 1.00 3.41 O ATOM 1919 CB LEU A 134 -8.208 -0.409 3.669 1.00 30.14 C ATOM 1920 CG LEU A 134 -8.594 -0.452 2.180 1.00 70.01 C ATOM 1921 CD1 LEU A 134 -9.085 -1.838 1.756 1.00 11.24 C ATOM 1922 CD2 LEU A 134 -9.623 0.611 1.789 1.00 23.43 C ATOM 0 H LEU A 134 -9.477 1.048 5.677 1.00 22.23 H new ATOM 0 HA LEU A 134 -10.015 -1.450 4.203 1.00 30.23 H new ATOM 0 HB2 LEU A 134 -7.852 0.595 3.899 1.00 30.14 H new ATOM 0 HB3 LEU A 134 -7.369 -1.088 3.822 1.00 30.14 H new ATOM 0 HG LEU A 134 -7.674 -0.225 1.641 1.00 70.01 H new ATOM 0 HD11 LEU A 134 -9.347 -1.823 0.698 1.00 11.24 H new ATOM 0 HD12 LEU A 134 -8.296 -2.571 1.924 1.00 11.24 H new ATOM 0 HD13 LEU A 134 -9.963 -2.108 2.343 1.00 11.24 H new ATOM 0 HD21 LEU A 134 -9.850 0.524 0.726 1.00 23.43 H new ATOM 0 HD22 LEU A 134 -10.535 0.465 2.368 1.00 23.43 H new ATOM 0 HD23 LEU A 134 -9.218 1.602 1.994 1.00 23.43 H new ATOM 1933 N ASN A 135 -8.542 -2.780 5.812 1.00 22.22 N ATOM 1934 CA ASN A 135 -8.022 -3.662 6.856 1.00 54.33 C ATOM 1935 C ASN A 135 -6.503 -3.592 6.988 1.00 32.23 C ATOM 1936 O ASN A 135 -5.784 -4.282 6.262 1.00 23.02 O ATOM 1937 CB ASN A 135 -8.452 -5.097 6.559 1.00 62.13 C ATOM 1938 CG ASN A 135 -7.848 -6.080 7.551 1.00 53.24 C ATOM 1939 OD1 ASN A 135 -7.815 -5.833 8.751 1.00 25.34 O ATOM 1940 ND2 ASN A 135 -7.374 -7.209 7.066 1.00 73.30 N ATOM 0 H ASN A 135 -8.801 -3.290 4.967 1.00 22.22 H new ATOM 0 HA ASN A 135 -8.436 -3.326 7.807 1.00 54.33 H new ATOM 0 HB2 ASN A 135 -9.539 -5.166 6.594 1.00 62.13 H new ATOM 0 HB3 ASN A 135 -8.148 -5.367 5.548 1.00 62.13 H new ATOM 0 HD21 ASN A 135 -6.967 -7.903 7.693 1.00 73.30 H new ATOM 0 HD22 ASN A 135 -7.414 -7.390 6.063 1.00 73.30 H new ATOM 1946 N VAL A 136 -6.000 -2.771 7.906 1.00 73.10 N ATOM 1947 CA VAL A 136 -4.568 -2.661 8.151 1.00 53.42 C ATOM 1948 C VAL A 136 -4.101 -3.862 8.987 1.00 24.21 C ATOM 1949 O VAL A 136 -4.726 -4.206 9.993 1.00 14.54 O ATOM 1950 CB VAL A 136 -4.223 -1.308 8.810 1.00 10.55 C ATOM 1951 CG1 VAL A 136 -2.699 -1.116 8.910 1.00 2.55 C ATOM 1952 CG2 VAL A 136 -4.793 -0.132 8.005 1.00 43.14 C ATOM 0 H VAL A 136 -6.571 -2.167 8.497 1.00 73.10 H new ATOM 0 HA VAL A 136 -4.030 -2.683 7.203 1.00 53.42 H new ATOM 0 HB VAL A 136 -4.667 -1.324 9.805 1.00 10.55 H new ATOM 0 HG11 VAL A 136 -2.483 -0.155 9.378 1.00 2.55 H new ATOM 0 HG12 VAL A 136 -2.270 -1.917 9.512 1.00 2.55 H new ATOM 0 HG13 VAL A 136 -2.263 -1.139 7.911 1.00 2.55 H new ATOM 0 HG21 VAL A 136 -4.532 0.805 8.496 1.00 43.14 H new ATOM 0 HG22 VAL A 136 -4.374 -0.143 6.999 1.00 43.14 H new ATOM 0 HG23 VAL A 136 -5.878 -0.222 7.948 1.00 43.14 H new ATOM 1962 N ILE A 137 -2.952 -4.448 8.634 1.00 41.13 N ATOM 1963 CA ILE A 137 -2.255 -5.466 9.424 1.00 25.33 C ATOM 1964 C ILE A 137 -0.845 -5.016 9.859 1.00 1.44 C ATOM 1965 O ILE A 137 -0.152 -5.772 10.545 1.00 44.20 O ATOM 1966 CB ILE A 137 -2.212 -6.790 8.641 1.00 72.20 C ATOM 1967 CG1 ILE A 137 -1.553 -6.587 7.259 1.00 11.22 C ATOM 1968 CG2 ILE A 137 -3.619 -7.393 8.510 1.00 44.13 C ATOM 1969 CD1 ILE A 137 -0.555 -7.681 6.904 1.00 24.15 C ATOM 0 H ILE A 137 -2.468 -4.220 7.766 1.00 41.13 H new ATOM 0 HA ILE A 137 -2.816 -5.618 10.346 1.00 25.33 H new ATOM 0 HB ILE A 137 -1.600 -7.499 9.199 1.00 72.20 H new ATOM 0 HG12 ILE A 137 -2.330 -6.551 6.495 1.00 11.22 H new ATOM 0 HG13 ILE A 137 -1.046 -5.622 7.244 1.00 11.22 H new ATOM 0 HG21 ILE A 137 -3.564 -8.328 7.953 1.00 44.13 H new ATOM 0 HG22 ILE A 137 -4.026 -7.585 9.503 1.00 44.13 H new ATOM 0 HG23 ILE A 137 -4.267 -6.694 7.981 1.00 44.13 H new ATOM 0 HD11 ILE A 137 -0.128 -7.479 5.922 1.00 24.15 H new ATOM 0 HD12 ILE A 137 0.241 -7.703 7.648 1.00 24.15 H new ATOM 0 HD13 ILE A 137 -1.063 -8.645 6.888 1.00 24.15 H new ATOM 1980 N GLY A 138 -0.391 -3.816 9.481 1.00 25.04 N ATOM 1981 CA GLY A 138 0.861 -3.228 9.950 1.00 43.10 C ATOM 1982 C GLY A 138 1.239 -2.000 9.123 1.00 45.31 C ATOM 1983 O GLY A 138 0.706 -1.799 8.026 1.00 11.54 O ATOM 0 H GLY A 138 -0.896 -3.217 8.828 1.00 25.04 H new ATOM 0 HA2 GLY A 138 0.764 -2.947 10.999 1.00 43.10 H new ATOM 0 HA3 GLY A 138 1.658 -3.969 9.891 1.00 43.10 H new ATOM 1987 N VAL A 139 2.174 -1.203 9.647 1.00 63.03 N ATOM 1988 CA VAL A 139 2.754 -0.020 9.011 1.00 11.35 C ATOM 1989 C VAL A 139 4.223 0.022 9.457 1.00 3.21 C ATOM 1990 O VAL A 139 4.495 -0.182 10.646 1.00 65.42 O ATOM 1991 CB VAL A 139 1.980 1.271 9.419 1.00 41.12 C ATOM 1992 CG1 VAL A 139 2.412 2.498 8.603 1.00 53.50 C ATOM 1993 CG2 VAL A 139 0.457 1.146 9.265 1.00 23.31 C ATOM 0 H VAL A 139 2.566 -1.375 10.573 1.00 63.03 H new ATOM 0 HA VAL A 139 2.684 -0.071 7.924 1.00 11.35 H new ATOM 0 HB VAL A 139 2.232 1.401 10.471 1.00 41.12 H new ATOM 0 HG11 VAL A 139 1.843 3.369 8.927 1.00 53.50 H new ATOM 0 HG12 VAL A 139 3.475 2.682 8.757 1.00 53.50 H new ATOM 0 HG13 VAL A 139 2.225 2.315 7.545 1.00 53.50 H new ATOM 0 HG21 VAL A 139 -0.017 2.080 9.566 1.00 23.31 H new ATOM 0 HG22 VAL A 139 0.213 0.934 8.224 1.00 23.31 H new ATOM 0 HG23 VAL A 139 0.093 0.335 9.895 1.00 23.31 H new ATOM 2003 N ALA A 140 5.182 0.283 8.562 1.00 50.41 N ATOM 2004 CA ALA A 140 6.565 0.607 8.941 1.00 51.44 C ATOM 2005 C ALA A 140 7.186 1.615 7.958 1.00 41.11 C ATOM 2006 O ALA A 140 6.448 2.254 7.202 1.00 63.42 O ATOM 2007 CB ALA A 140 7.425 -0.647 9.171 1.00 13.54 C ATOM 0 H ALA A 140 5.023 0.276 7.554 1.00 50.41 H new ATOM 0 HA ALA A 140 6.536 1.102 9.912 1.00 51.44 H new ATOM 0 HB1 ALA A 140 8.436 -0.349 9.448 1.00 13.54 H new ATOM 0 HB2 ALA A 140 6.990 -1.244 9.972 1.00 13.54 H new ATOM 0 HB3 ALA A 140 7.459 -1.238 8.256 1.00 13.54 H new ATOM 2013 N ARG A 141 8.487 1.901 8.072 1.00 10.42 N ATOM 2014 CA ARG A 141 9.246 2.918 7.340 1.00 43.34 C ATOM 2015 C ARG A 141 10.488 2.303 6.682 1.00 51.33 C ATOM 2016 O ARG A 141 11.537 2.953 6.603 1.00 14.43 O ATOM 2017 CB ARG A 141 9.614 4.016 8.343 1.00 73.44 C ATOM 2018 CG ARG A 141 10.503 3.434 9.468 1.00 43.22 C ATOM 2019 CD ARG A 141 10.711 4.417 10.593 1.00 21.12 C ATOM 2020 NE ARG A 141 12.011 5.123 10.610 1.00 25.33 N ATOM 2021 CZ ARG A 141 12.855 5.525 9.646 1.00 70.20 C ATOM 2022 NH1 ARG A 141 12.610 5.366 8.350 1.00 13.35 N ATOM 2023 NH2 ARG A 141 13.988 6.113 10.008 1.00 14.44 N ATOM 0 H ARG A 141 9.080 1.390 8.726 1.00 10.42 H new ATOM 0 HA ARG A 141 8.652 3.341 6.530 1.00 43.34 H new ATOM 0 HB2 ARG A 141 10.141 4.823 7.833 1.00 73.44 H new ATOM 0 HB3 ARG A 141 8.709 4.447 8.771 1.00 73.44 H new ATOM 0 HG2 ARG A 141 10.043 2.527 9.860 1.00 43.22 H new ATOM 0 HG3 ARG A 141 11.470 3.148 9.054 1.00 43.22 H new ATOM 0 HD2 ARG A 141 9.917 5.162 10.548 1.00 21.12 H new ATOM 0 HD3 ARG A 141 10.597 3.886 11.538 1.00 21.12 H new ATOM 0 HE ARG A 141 12.333 5.352 11.550 1.00 25.33 H new ATOM 0 HH11 ARG A 141 11.745 4.919 8.046 1.00 13.35 H new ATOM 0 HH12 ARG A 141 13.287 5.691 7.659 1.00 13.35 H new ATOM 0 HH21 ARG A 141 14.199 6.249 10.997 1.00 14.44 H new ATOM 0 HH22 ARG A 141 14.648 6.429 9.298 1.00 14.44 H new ATOM 2034 N ASP A 142 10.393 1.016 6.372 1.00 42.04 N ATOM 2035 CA ASP A 142 11.483 0.060 6.254 1.00 72.10 C ATOM 2036 C ASP A 142 10.949 -1.349 6.015 1.00 23.33 C ATOM 2037 O ASP A 142 9.772 -1.635 6.229 1.00 23.51 O ATOM 2038 CB ASP A 142 12.442 0.026 7.469 1.00 3.23 C ATOM 2039 CG ASP A 142 11.897 0.303 8.878 1.00 72.22 C ATOM 2040 OD1 ASP A 142 10.671 0.354 9.123 1.00 32.43 O ATOM 2041 OD2 ASP A 142 12.750 0.547 9.759 1.00 30.02 O ATOM 0 H ASP A 142 9.488 0.584 6.184 1.00 42.04 H new ATOM 0 HA ASP A 142 12.062 0.408 5.398 1.00 72.10 H new ATOM 0 HB2 ASP A 142 12.908 -0.959 7.488 1.00 3.23 H new ATOM 0 HB3 ASP A 142 13.234 0.750 7.278 1.00 3.23 H new ATOM 2045 N ASP A 143 11.856 -2.236 5.611 1.00 54.24 N ATOM 2046 CA ASP A 143 11.644 -3.671 5.360 1.00 45.41 C ATOM 2047 C ASP A 143 11.869 -4.536 6.616 1.00 63.31 C ATOM 2048 O ASP A 143 11.963 -5.763 6.535 1.00 2.04 O ATOM 2049 CB ASP A 143 12.540 -4.144 4.200 1.00 21.43 C ATOM 2050 CG ASP A 143 14.034 -4.075 4.521 1.00 3.33 C ATOM 2051 OD1 ASP A 143 14.556 -4.881 5.324 1.00 33.21 O ATOM 2052 OD2 ASP A 143 14.708 -3.149 4.014 1.00 71.22 O ATOM 0 H ASP A 143 12.822 -1.960 5.437 1.00 54.24 H new ATOM 0 HA ASP A 143 10.598 -3.799 5.081 1.00 45.41 H new ATOM 0 HB2 ASP A 143 12.278 -5.170 3.943 1.00 21.43 H new ATOM 0 HB3 ASP A 143 12.336 -3.533 3.320 1.00 21.43 H new ATOM 2056 N SER A 144 11.962 -3.914 7.792 1.00 24.33 N ATOM 2057 CA SER A 144 12.218 -4.544 9.079 1.00 43.53 C ATOM 2058 C SER A 144 11.040 -5.348 9.666 1.00 45.43 C ATOM 2059 O SER A 144 11.190 -5.867 10.772 1.00 30.05 O ATOM 2060 CB SER A 144 12.671 -3.430 10.029 1.00 10.22 C ATOM 2061 OG SER A 144 14.032 -3.116 9.772 1.00 34.11 O ATOM 0 H SER A 144 11.854 -2.903 7.872 1.00 24.33 H new ATOM 0 HA SER A 144 12.986 -5.305 8.940 1.00 43.53 H new ATOM 0 HB2 SER A 144 12.050 -2.545 9.892 1.00 10.22 H new ATOM 0 HB3 SER A 144 12.549 -3.748 11.064 1.00 10.22 H new ATOM 0 HG SER A 144 14.323 -2.402 10.377 1.00 34.11 H new ATOM 2066 N GLU A 145 9.888 -5.448 8.988 1.00 12.55 N ATOM 2067 CA GLU A 145 8.742 -6.237 9.466 1.00 42.52 C ATOM 2068 C GLU A 145 8.078 -7.047 8.334 1.00 1.53 C ATOM 2069 O GLU A 145 6.948 -7.510 8.490 1.00 1.41 O ATOM 2070 CB GLU A 145 7.734 -5.342 10.225 1.00 63.43 C ATOM 2071 CG GLU A 145 8.315 -4.696 11.488 1.00 23.44 C ATOM 2072 CD GLU A 145 7.350 -3.756 12.216 1.00 71.24 C ATOM 2073 OE1 GLU A 145 6.119 -4.008 12.249 1.00 74.13 O ATOM 2074 OE2 GLU A 145 7.846 -2.780 12.821 1.00 12.51 O ATOM 0 H GLU A 145 9.724 -4.985 8.094 1.00 12.55 H new ATOM 0 HA GLU A 145 9.120 -6.973 10.175 1.00 42.52 H new ATOM 0 HB2 GLU A 145 7.382 -4.558 9.555 1.00 63.43 H new ATOM 0 HB3 GLU A 145 6.865 -5.940 10.500 1.00 63.43 H new ATOM 0 HG2 GLU A 145 8.624 -5.483 12.175 1.00 23.44 H new ATOM 0 HG3 GLU A 145 9.212 -4.139 11.217 1.00 23.44 H new ATOM 2079 N VAL A 146 8.757 -7.266 7.205 1.00 33.23 N ATOM 2080 CA VAL A 146 8.263 -8.119 6.120 1.00 32.11 C ATOM 2081 C VAL A 146 7.910 -9.521 6.629 1.00 53.30 C ATOM 2082 O VAL A 146 6.944 -10.129 6.162 1.00 74.01 O ATOM 2083 CB VAL A 146 9.296 -8.139 4.972 1.00 43.32 C ATOM 2084 CG1 VAL A 146 8.820 -8.983 3.787 1.00 33.54 C ATOM 2085 CG2 VAL A 146 9.577 -6.734 4.425 1.00 45.30 C ATOM 0 H VAL A 146 9.671 -6.854 7.016 1.00 33.23 H new ATOM 0 HA VAL A 146 7.335 -7.705 5.726 1.00 32.11 H new ATOM 0 HB VAL A 146 10.198 -8.566 5.411 1.00 43.32 H new ATOM 0 HG11 VAL A 146 9.577 -8.969 3.003 1.00 33.54 H new ATOM 0 HG12 VAL A 146 8.655 -10.010 4.114 1.00 33.54 H new ATOM 0 HG13 VAL A 146 7.888 -8.572 3.399 1.00 33.54 H new ATOM 0 HG21 VAL A 146 10.309 -6.797 3.620 1.00 45.30 H new ATOM 0 HG22 VAL A 146 8.653 -6.301 4.042 1.00 45.30 H new ATOM 0 HG23 VAL A 146 9.969 -6.104 5.224 1.00 45.30 H new ATOM 2095 N ASP A 147 8.616 -9.981 7.657 1.00 21.21 N ATOM 2096 CA ASP A 147 8.469 -11.298 8.259 1.00 11.34 C ATOM 2097 C ASP A 147 7.042 -11.501 8.771 1.00 2.51 C ATOM 2098 O ASP A 147 6.476 -12.592 8.657 1.00 25.33 O ATOM 2099 CB ASP A 147 9.478 -11.476 9.414 1.00 23.04 C ATOM 2100 CG ASP A 147 10.957 -11.473 9.001 1.00 54.41 C ATOM 2101 OD1 ASP A 147 11.274 -11.421 7.793 1.00 70.12 O ATOM 2102 OD2 ASP A 147 11.852 -11.427 9.877 1.00 5.15 O ATOM 0 H ASP A 147 9.337 -9.420 8.112 1.00 21.21 H new ATOM 0 HA ASP A 147 8.673 -12.048 7.495 1.00 11.34 H new ATOM 0 HB2 ASP A 147 9.319 -10.678 10.139 1.00 23.04 H new ATOM 0 HB3 ASP A 147 9.262 -12.416 9.922 1.00 23.04 H new ATOM 2106 N LYS A 148 6.412 -10.445 9.299 1.00 25.23 N ATOM 2107 CA LYS A 148 5.070 -10.533 9.883 1.00 2.53 C ATOM 2108 C LYS A 148 3.980 -10.172 8.889 1.00 24.32 C ATOM 2109 O LYS A 148 2.795 -10.309 9.211 1.00 14.23 O ATOM 2110 CB LYS A 148 4.959 -9.654 11.131 1.00 2.33 C ATOM 2111 CG LYS A 148 5.277 -8.180 10.873 1.00 12.42 C ATOM 2112 CD LYS A 148 4.801 -7.212 11.957 1.00 13.22 C ATOM 2113 CE LYS A 148 5.761 -7.202 13.147 1.00 32.45 C ATOM 2114 NZ LYS A 148 5.528 -6.022 13.995 1.00 4.32 N ATOM 0 H LYS A 148 6.817 -9.509 9.333 1.00 25.23 H new ATOM 0 HA LYS A 148 4.921 -11.575 10.167 1.00 2.53 H new ATOM 0 HB2 LYS A 148 3.949 -9.734 11.533 1.00 2.33 H new ATOM 0 HB3 LYS A 148 5.637 -10.035 11.895 1.00 2.33 H new ATOM 0 HG2 LYS A 148 6.356 -8.072 10.760 1.00 12.42 H new ATOM 0 HG3 LYS A 148 4.826 -7.888 9.924 1.00 12.42 H new ATOM 0 HD2 LYS A 148 4.721 -6.207 11.542 1.00 13.22 H new ATOM 0 HD3 LYS A 148 3.804 -7.499 12.292 1.00 13.22 H new ATOM 0 HE2 LYS A 148 5.628 -8.110 13.735 1.00 32.45 H new ATOM 0 HE3 LYS A 148 6.791 -7.201 12.790 1.00 32.45 H new ATOM 0 HZ1 LYS A 148 6.254 -5.980 14.738 1.00 4.32 H new ATOM 0 HZ2 LYS A 148 5.577 -5.161 13.413 1.00 4.32 H new ATOM 0 HZ3 LYS A 148 4.587 -6.090 14.433 1.00 4.32 H new ATOM 2124 N TRP A 149 4.334 -9.685 7.707 1.00 14.21 N ATOM 2125 CA TRP A 149 3.380 -9.424 6.648 1.00 53.41 C ATOM 2126 C TRP A 149 3.362 -10.591 5.658 1.00 42.41 C ATOM 2127 O TRP A 149 2.885 -10.424 4.541 1.00 5.41 O ATOM 2128 CB TRP A 149 3.689 -8.086 5.989 1.00 22.35 C ATOM 2129 CG TRP A 149 3.809 -6.944 6.952 1.00 22.01 C ATOM 2130 CD1 TRP A 149 3.065 -6.752 8.065 1.00 12.35 C ATOM 2131 CD2 TRP A 149 4.789 -5.874 6.952 1.00 73.14 C ATOM 2132 NE1 TRP A 149 3.530 -5.651 8.743 1.00 23.03 N ATOM 2133 CE2 TRP A 149 4.544 -5.022 8.064 1.00 73.30 C ATOM 2134 CE3 TRP A 149 5.868 -5.546 6.117 1.00 72.31 C ATOM 2135 CZ2 TRP A 149 5.287 -3.857 8.293 1.00 64.03 C ATOM 2136 CZ3 TRP A 149 6.682 -4.431 6.382 1.00 41.40 C ATOM 2137 CH2 TRP A 149 6.367 -3.571 7.442 1.00 54.14 C ATOM 0 H TRP A 149 5.297 -9.460 7.459 1.00 14.21 H new ATOM 0 HA TRP A 149 2.374 -9.348 7.061 1.00 53.41 H new ATOM 0 HB2 TRP A 149 4.620 -8.175 5.429 1.00 22.35 H new ATOM 0 HB3 TRP A 149 2.904 -7.858 5.268 1.00 22.35 H new ATOM 0 HD1 TRP A 149 2.234 -7.369 8.373 1.00 12.35 H new ATOM 0 HE1 TRP A 149 3.165 -5.338 9.643 1.00 23.03 H new ATOM 0 HE3 TRP A 149 6.077 -6.162 5.255 1.00 72.31 H new ATOM 0 HZ2 TRP A 149 5.035 -3.193 9.106 1.00 64.03 H new ATOM 0 HZ3 TRP A 149 7.550 -4.237 5.769 1.00 41.40 H new ATOM 0 HH2 TRP A 149 6.958 -2.682 7.606 1.00 54.14 H new ATOM 2147 N SER A 150 3.890 -11.762 6.017 1.00 33.22 N ATOM 2148 CA SER A 150 3.717 -12.996 5.264 1.00 70.11 C ATOM 2149 C SER A 150 3.647 -14.179 6.240 1.00 44.50 C ATOM 2150 O SER A 150 4.299 -15.203 6.022 1.00 33.45 O ATOM 2151 CB SER A 150 4.831 -13.115 4.210 1.00 30.32 C ATOM 2152 OG SER A 150 4.687 -14.317 3.471 1.00 25.13 O ATOM 0 H SER A 150 4.460 -11.877 6.855 1.00 33.22 H new ATOM 0 HA SER A 150 2.777 -12.996 4.713 1.00 70.11 H new ATOM 0 HB2 SER A 150 4.795 -12.260 3.535 1.00 30.32 H new ATOM 0 HB3 SER A 150 5.805 -13.095 4.698 1.00 30.32 H new ATOM 0 HG SER A 150 4.518 -15.061 4.086 1.00 25.13 H new ATOM 2157 N LYS A 151 2.869 -14.050 7.321 1.00 71.10 N ATOM 2158 CA LYS A 151 2.593 -15.183 8.202 1.00 1.12 C ATOM 2159 C LYS A 151 1.618 -16.146 7.545 1.00 33.31 C ATOM 2160 O LYS A 151 1.493 -17.294 8.014 1.00 5.31 O ATOM 2161 CB LYS A 151 2.142 -14.741 9.605 1.00 45.10 C ATOM 2162 CG LYS A 151 0.735 -14.138 9.750 1.00 21.34 C ATOM 2163 CD LYS A 151 0.725 -12.612 9.607 1.00 72.11 C ATOM 2164 CE LYS A 151 -0.654 -12.017 9.905 1.00 10.54 C ATOM 2165 NZ LYS A 151 -1.672 -12.441 8.925 1.00 72.21 N ATOM 0 H LYS A 151 2.423 -13.177 7.603 1.00 71.10 H new ATOM 0 HA LYS A 151 3.528 -15.721 8.357 1.00 1.12 H new ATOM 0 HB2 LYS A 151 2.205 -15.606 10.265 1.00 45.10 H new ATOM 0 HB3 LYS A 151 2.860 -14.007 9.972 1.00 45.10 H new ATOM 0 HG2 LYS A 151 0.079 -14.573 8.996 1.00 21.34 H new ATOM 0 HG3 LYS A 151 0.327 -14.410 10.723 1.00 21.34 H new ATOM 0 HD2 LYS A 151 1.461 -12.180 10.285 1.00 72.11 H new ATOM 0 HD3 LYS A 151 1.026 -12.341 8.595 1.00 72.11 H new ATOM 0 HE2 LYS A 151 -0.968 -12.317 10.905 1.00 10.54 H new ATOM 0 HE3 LYS A 151 -0.585 -10.929 9.906 1.00 10.54 H new ATOM 0 HZ1 LYS A 151 -2.592 -12.027 9.178 1.00 72.21 H new ATOM 0 HZ2 LYS A 151 -1.396 -12.118 7.976 1.00 72.21 H new ATOM 0 HZ3 LYS A 151 -1.747 -13.478 8.929 1.00 72.21 H new TER 2175 LYS A 151