USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1022 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 28 TYR OH : rot 15:sc= -0.797! USER MOD Set 1.2: A 47 SER OG : rot -139:sc= 1.68 USER MOD Set 2.1: A 19 SER OG : rot 80:sc= -0.687 USER MOD Set 2.2: A 21 MET CE :methyl -138:sc= -1.25 (180deg=-4.65!) USER MOD Single : A 12 SER OG : rot 130:sc= -0.101 USER MOD Single : A 20 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.079) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0269 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 88:sc= 1.17 USER MOD Single : A 35 ASN : amide:sc= -2.29! C(o=-2.3!,f=-5.7!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 34:sc= 1.26 USER MOD Single : A 48 SER OG : rot 18:sc= -0.503 USER MOD Single : A 52 THR OG1 : rot 37:sc= -0.172 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 56 THR OG1 : rot 130:sc= -0.825 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.391 X(o=-0.39,f=-0.053) USER MOD Single : A 63 LYS NZ :NH3+ -166:sc= -0.868 (180deg=-1.25) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.43 X(o=-1.4,f=-1.4) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.642 X(o=-0.64,f=-0.32) USER MOD Single : A 100 MET CE :methyl 154:sc= -5.34! (180deg=-7.49!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -141:sc= -1.75 (180deg=-4.52!) USER MOD Single : A 112 THR OG1 : rot -68:sc= 1.22 USER MOD Single : A 113 MET CE :methyl 142:sc= -2.78 (180deg=-4.47!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= -0.506 X(o=-0.51,f=-0.39) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.165 USER MOD Single : A 123 THR OG1 : rot -61:sc= 0.869 USER MOD Single : A 127 LYS NZ :NH3+ -166:sc= -0.0376 (180deg=-0.268) USER MOD Single : A 132 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.4) USER MOD Single : A 134 THR OG1 : rot 3:sc= 0.78! USER MOD Single : A 138 THR OG1 : rot 62:sc= 0.12 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 4.027 -0.566 3.185 1.00 10.54 N ATOM 2 CA SER A 12 3.996 -0.540 1.728 1.00 52.12 C ATOM 3 C SER A 12 3.391 -1.827 1.175 1.00 50.34 C ATOM 4 O SER A 12 2.460 -1.793 0.371 1.00 32.04 O ATOM 5 CB SER A 12 5.407 -0.345 1.170 1.00 70.32 C ATOM 6 OG SER A 12 5.539 -0.950 -0.105 1.00 22.11 O ATOM 0 HA SER A 12 3.372 0.298 1.417 1.00 52.12 H new ATOM 0 HB2 SER A 12 5.628 0.720 1.095 1.00 70.32 H new ATOM 0 HB3 SER A 12 6.136 -0.775 1.857 1.00 70.32 H new ATOM 0 HG SER A 12 5.929 -0.307 -0.733 1.00 22.11 H new ATOM 12 N GLY A 13 3.929 -2.962 1.612 1.00 54.35 N ATOM 13 CA GLY A 13 3.430 -4.244 1.150 1.00 24.33 C ATOM 14 C GLY A 13 4.543 -5.244 0.905 1.00 31.20 C ATOM 15 O GLY A 13 5.712 -4.871 0.804 1.00 44.21 O ATOM 0 H GLY A 13 4.701 -3.016 2.277 1.00 54.35 H new ATOM 0 HA2 GLY A 13 2.738 -4.649 1.888 1.00 24.33 H new ATOM 0 HA3 GLY A 13 2.865 -4.100 0.229 1.00 24.33 H new ATOM 19 N LEU A 14 4.180 -6.519 0.811 1.00 44.33 N ATOM 20 CA LEU A 14 5.157 -7.577 0.577 1.00 3.24 C ATOM 21 C LEU A 14 5.256 -7.909 -0.908 1.00 43.51 C ATOM 22 O LEU A 14 4.498 -7.384 -1.724 1.00 44.11 O ATOM 23 CB LEU A 14 4.779 -8.831 1.368 1.00 53.35 C ATOM 24 CG LEU A 14 5.219 -8.860 2.831 1.00 4.05 C ATOM 25 CD1 LEU A 14 4.328 -7.962 3.675 1.00 1.13 C ATOM 26 CD2 LEU A 14 5.202 -10.285 3.365 1.00 10.12 C ATOM 0 H LEU A 14 3.217 -6.845 0.893 1.00 44.33 H new ATOM 0 HA LEU A 14 6.130 -7.221 0.916 1.00 3.24 H new ATOM 0 HB2 LEU A 14 3.696 -8.945 1.333 1.00 53.35 H new ATOM 0 HB3 LEU A 14 5.207 -9.697 0.864 1.00 53.35 H new ATOM 0 HG LEU A 14 6.240 -8.483 2.890 1.00 4.05 H new ATOM 0 HD11 LEU A 14 4.657 -7.996 4.714 1.00 1.13 H new ATOM 0 HD12 LEU A 14 4.391 -6.938 3.307 1.00 1.13 H new ATOM 0 HD13 LEU A 14 3.296 -8.308 3.610 1.00 1.13 H new ATOM 0 HD21 LEU A 14 5.518 -10.286 4.408 1.00 10.12 H new ATOM 0 HD22 LEU A 14 4.192 -10.689 3.291 1.00 10.12 H new ATOM 0 HD23 LEU A 14 5.883 -10.901 2.779 1.00 10.12 H new ATOM 38 N VAL A 15 6.195 -8.785 -1.252 1.00 53.12 N ATOM 39 CA VAL A 15 6.391 -9.190 -2.639 1.00 50.21 C ATOM 40 C VAL A 15 5.713 -10.525 -2.923 1.00 33.31 C ATOM 41 O VAL A 15 5.538 -11.362 -2.037 1.00 24.03 O ATOM 42 CB VAL A 15 7.888 -9.303 -2.984 1.00 72.13 C ATOM 43 CG1 VAL A 15 8.614 -8.012 -2.641 1.00 4.23 C ATOM 44 CG2 VAL A 15 8.513 -10.485 -2.260 1.00 22.53 C ATOM 0 H VAL A 15 6.832 -9.228 -0.589 1.00 53.12 H new ATOM 0 HA VAL A 15 5.939 -8.417 -3.261 1.00 50.21 H new ATOM 0 HB VAL A 15 7.984 -9.471 -4.057 1.00 72.13 H new ATOM 0 HG11 VAL A 15 9.670 -8.111 -2.892 1.00 4.23 H new ATOM 0 HG12 VAL A 15 8.181 -7.189 -3.210 1.00 4.23 H new ATOM 0 HG13 VAL A 15 8.512 -7.809 -1.575 1.00 4.23 H new ATOM 0 HG21 VAL A 15 9.571 -10.550 -2.515 1.00 22.53 H new ATOM 0 HG22 VAL A 15 8.407 -10.350 -1.184 1.00 22.53 H new ATOM 0 HG23 VAL A 15 8.010 -11.404 -2.562 1.00 22.53 H new ATOM 54 N PRO A 16 5.320 -10.732 -4.189 1.00 22.44 N ATOM 55 CA PRO A 16 4.655 -11.966 -4.620 1.00 3.35 C ATOM 56 C PRO A 16 5.597 -13.165 -4.612 1.00 30.01 C ATOM 57 O PRO A 16 5.879 -13.751 -5.657 1.00 63.02 O ATOM 58 CB PRO A 16 4.207 -11.647 -6.048 1.00 42.30 C ATOM 59 CG PRO A 16 5.150 -10.591 -6.514 1.00 33.12 C ATOM 60 CD PRO A 16 5.496 -9.779 -5.297 1.00 13.42 C ATOM 0 HA PRO A 16 3.838 -12.243 -3.954 1.00 3.35 H new ATOM 0 HB2 PRO A 16 4.256 -12.530 -6.685 1.00 42.30 H new ATOM 0 HB3 PRO A 16 3.176 -11.295 -6.070 1.00 42.30 H new ATOM 0 HG2 PRO A 16 6.043 -11.033 -6.955 1.00 33.12 H new ATOM 0 HG3 PRO A 16 4.690 -9.968 -7.281 1.00 33.12 H new ATOM 0 HD2 PRO A 16 6.517 -9.401 -5.343 1.00 13.42 H new ATOM 0 HD3 PRO A 16 4.841 -8.914 -5.191 1.00 13.42 H new ATOM 68 N ARG A 17 6.080 -13.525 -3.427 1.00 74.12 N ATOM 69 CA ARG A 17 6.990 -14.655 -3.284 1.00 43.44 C ATOM 70 C ARG A 17 6.699 -15.430 -2.003 1.00 15.42 C ATOM 71 O ARG A 17 7.614 -15.855 -1.300 1.00 65.14 O ATOM 72 CB ARG A 17 8.441 -14.170 -3.281 1.00 3.22 C ATOM 73 CG ARG A 17 8.786 -13.270 -4.456 1.00 53.13 C ATOM 74 CD ARG A 17 10.205 -13.511 -4.946 1.00 21.55 C ATOM 75 NE ARG A 17 11.158 -13.597 -3.842 1.00 15.23 N ATOM 76 CZ ARG A 17 12.361 -14.148 -3.950 1.00 62.15 C ATOM 77 NH1 ARG A 17 12.758 -14.660 -5.108 1.00 14.43 N ATOM 78 NH2 ARG A 17 13.171 -14.188 -2.900 1.00 44.14 N ATOM 0 H ARG A 17 5.856 -13.050 -2.552 1.00 74.12 H new ATOM 0 HA ARG A 17 6.838 -15.322 -4.133 1.00 43.44 H new ATOM 0 HB2 ARG A 17 8.633 -13.631 -2.353 1.00 3.22 H new ATOM 0 HB3 ARG A 17 9.104 -15.035 -3.290 1.00 3.22 H new ATOM 0 HG2 ARG A 17 8.084 -13.448 -5.270 1.00 53.13 H new ATOM 0 HG3 ARG A 17 8.674 -12.227 -4.161 1.00 53.13 H new ATOM 0 HD2 ARG A 17 10.237 -14.434 -5.525 1.00 21.55 H new ATOM 0 HD3 ARG A 17 10.499 -12.704 -5.617 1.00 21.55 H new ATOM 0 HE ARG A 17 10.884 -13.212 -2.938 1.00 15.23 H new ATOM 0 HH11 ARG A 17 12.138 -14.631 -5.918 1.00 14.43 H new ATOM 0 HH12 ARG A 17 13.683 -15.083 -5.188 1.00 14.43 H new ATOM 0 HH21 ARG A 17 12.870 -13.795 -2.008 1.00 44.14 H new ATOM 0 HH22 ARG A 17 14.095 -14.612 -2.985 1.00 44.14 H new ATOM 92 N GLY A 18 5.415 -15.609 -1.705 1.00 1.45 N ATOM 93 CA GLY A 18 5.025 -16.331 -0.508 1.00 25.31 C ATOM 94 C GLY A 18 5.401 -15.595 0.762 1.00 1.45 C ATOM 95 O GLY A 18 4.690 -14.688 1.196 1.00 41.14 O ATOM 0 H GLY A 18 4.639 -15.267 -2.271 1.00 1.45 H new ATOM 0 HA2 GLY A 18 3.948 -16.497 -0.523 1.00 25.31 H new ATOM 0 HA3 GLY A 18 5.499 -17.313 -0.509 1.00 25.31 H new ATOM 99 N SER A 19 6.521 -15.985 1.362 1.00 31.53 N ATOM 100 CA SER A 19 6.987 -15.359 2.594 1.00 30.41 C ATOM 101 C SER A 19 7.596 -13.990 2.311 1.00 43.24 C ATOM 102 O SER A 19 7.589 -13.517 1.173 1.00 34.43 O ATOM 103 CB SER A 19 8.016 -16.254 3.288 1.00 33.03 C ATOM 104 OG SER A 19 8.284 -15.797 4.603 1.00 64.44 O ATOM 0 H SER A 19 7.123 -16.732 1.015 1.00 31.53 H new ATOM 0 HA SER A 19 6.128 -15.226 3.252 1.00 30.41 H new ATOM 0 HB2 SER A 19 7.646 -17.279 3.324 1.00 33.03 H new ATOM 0 HB3 SER A 19 8.940 -16.268 2.709 1.00 33.03 H new ATOM 0 HG SER A 19 7.570 -16.094 5.205 1.00 64.44 H new ATOM 110 N HIS A 20 8.124 -13.356 3.353 1.00 31.44 N ATOM 111 CA HIS A 20 8.739 -12.041 3.218 1.00 54.43 C ATOM 112 C HIS A 20 9.821 -12.055 2.143 1.00 41.13 C ATOM 113 O HIS A 20 9.545 -11.814 0.968 1.00 65.12 O ATOM 114 CB HIS A 20 9.335 -11.593 4.553 1.00 52.15 C ATOM 115 CG HIS A 20 8.311 -11.112 5.534 1.00 4.44 C ATOM 116 ND1 HIS A 20 7.636 -11.954 6.392 1.00 62.52 N ATOM 117 CD2 HIS A 20 7.850 -9.866 5.793 1.00 2.34 C ATOM 118 CE1 HIS A 20 6.803 -11.248 7.134 1.00 32.15 C ATOM 119 NE2 HIS A 20 6.914 -9.977 6.791 1.00 34.44 N ATOM 0 H HIS A 20 8.138 -13.732 4.301 1.00 31.44 H new ATOM 0 HA HIS A 20 7.965 -11.334 2.920 1.00 54.43 H new ATOM 0 HB2 HIS A 20 9.886 -12.424 4.993 1.00 52.15 H new ATOM 0 HB3 HIS A 20 10.055 -10.795 4.371 1.00 52.15 H new ATOM 0 HD2 HIS A 20 8.161 -8.954 5.305 1.00 2.34 H new ATOM 0 HE1 HIS A 20 6.143 -11.642 7.892 1.00 32.15 H new ATOM 0 HE2 HIS A 20 6.390 -9.204 7.201 1.00 34.44 H new ATOM 127 N MET A 21 11.053 -12.338 2.554 1.00 51.21 N ATOM 128 CA MET A 21 12.176 -12.384 1.625 1.00 4.53 C ATOM 129 C MET A 21 12.484 -10.994 1.076 1.00 65.33 C ATOM 130 O MET A 21 13.502 -10.392 1.418 1.00 64.35 O ATOM 131 CB MET A 21 11.875 -13.345 0.474 1.00 43.00 C ATOM 132 CG MET A 21 11.221 -14.642 0.921 1.00 63.31 C ATOM 133 SD MET A 21 12.306 -15.648 1.953 1.00 51.45 S ATOM 134 CE MET A 21 11.366 -15.705 3.476 1.00 21.22 C ATOM 0 H MET A 21 11.299 -12.539 3.523 1.00 51.21 H new ATOM 0 HA MET A 21 13.050 -12.743 2.168 1.00 4.53 H new ATOM 0 HB2 MET A 21 11.223 -12.847 -0.243 1.00 43.00 H new ATOM 0 HB3 MET A 21 12.804 -13.577 -0.047 1.00 43.00 H new ATOM 0 HG2 MET A 21 10.310 -14.413 1.474 1.00 63.31 H new ATOM 0 HG3 MET A 21 10.925 -15.217 0.043 1.00 63.31 H new ATOM 0 HE1 MET A 21 12.039 -15.577 4.324 1.00 21.22 H new ATOM 0 HE2 MET A 21 10.625 -14.905 3.477 1.00 21.22 H new ATOM 0 HE3 MET A 21 10.861 -16.667 3.556 1.00 21.22 H new ATOM 144 N VAL A 22 11.599 -10.491 0.222 1.00 53.40 N ATOM 145 CA VAL A 22 11.776 -9.172 -0.374 1.00 50.12 C ATOM 146 C VAL A 22 10.597 -8.261 -0.053 1.00 55.24 C ATOM 147 O VAL A 22 9.501 -8.731 0.252 1.00 74.31 O ATOM 148 CB VAL A 22 11.938 -9.264 -1.903 1.00 61.41 C ATOM 149 CG1 VAL A 22 12.374 -7.924 -2.476 1.00 75.41 C ATOM 150 CG2 VAL A 22 12.931 -10.358 -2.268 1.00 40.40 C ATOM 0 H VAL A 22 10.752 -10.977 -0.073 1.00 53.40 H new ATOM 0 HA VAL A 22 12.685 -8.750 0.056 1.00 50.12 H new ATOM 0 HB VAL A 22 10.972 -9.521 -2.339 1.00 61.41 H new ATOM 0 HG11 VAL A 22 12.483 -8.009 -3.557 1.00 75.41 H new ATOM 0 HG12 VAL A 22 11.623 -7.168 -2.245 1.00 75.41 H new ATOM 0 HG13 VAL A 22 13.328 -7.634 -2.037 1.00 75.41 H new ATOM 0 HG21 VAL A 22 13.034 -10.409 -3.352 1.00 40.40 H new ATOM 0 HG22 VAL A 22 13.900 -10.133 -1.822 1.00 40.40 H new ATOM 0 HG23 VAL A 22 12.572 -11.316 -1.892 1.00 40.40 H new ATOM 160 N ARG A 23 10.829 -6.954 -0.125 1.00 73.20 N ATOM 161 CA ARG A 23 9.785 -5.976 0.159 1.00 64.15 C ATOM 162 C ARG A 23 10.204 -4.584 -0.307 1.00 33.51 C ATOM 163 O ARG A 23 11.374 -4.214 -0.215 1.00 22.12 O ATOM 164 CB ARG A 23 9.472 -5.952 1.656 1.00 65.22 C ATOM 165 CG ARG A 23 10.561 -5.304 2.495 1.00 0.52 C ATOM 166 CD ARG A 23 10.139 -5.172 3.950 1.00 55.30 C ATOM 167 NE ARG A 23 10.271 -3.801 4.436 1.00 31.04 N ATOM 168 CZ ARG A 23 10.307 -3.479 5.724 1.00 13.55 C ATOM 169 NH1 ARG A 23 10.221 -4.424 6.650 1.00 12.55 N ATOM 170 NH2 ARG A 23 10.429 -2.208 6.089 1.00 61.45 N ATOM 0 H ARG A 23 11.730 -6.548 -0.377 1.00 73.20 H new ATOM 0 HA ARG A 23 8.888 -6.269 -0.387 1.00 64.15 H new ATOM 0 HB2 ARG A 23 8.536 -5.417 1.814 1.00 65.22 H new ATOM 0 HB3 ARG A 23 9.317 -6.974 2.003 1.00 65.22 H new ATOM 0 HG2 ARG A 23 11.473 -5.898 2.432 1.00 0.52 H new ATOM 0 HG3 ARG A 23 10.794 -4.319 2.092 1.00 0.52 H new ATOM 0 HD2 ARG A 23 9.104 -5.497 4.058 1.00 55.30 H new ATOM 0 HD3 ARG A 23 10.747 -5.835 4.565 1.00 55.30 H new ATOM 0 HE ARG A 23 10.339 -3.050 3.749 1.00 31.04 H new ATOM 0 HH11 ARG A 23 10.127 -5.401 6.374 1.00 12.55 H new ATOM 0 HH12 ARG A 23 10.249 -4.174 7.638 1.00 12.55 H new ATOM 0 HH21 ARG A 23 10.495 -1.478 5.380 1.00 61.45 H new ATOM 0 HH22 ARG A 23 10.457 -1.962 7.078 1.00 61.45 H new ATOM 184 N ARG A 24 9.240 -3.819 -0.807 1.00 55.23 N ATOM 185 CA ARG A 24 9.508 -2.469 -1.289 1.00 21.23 C ATOM 186 C ARG A 24 9.825 -1.531 -0.128 1.00 14.21 C ATOM 187 O ARG A 24 8.966 -0.774 0.323 1.00 14.41 O ATOM 188 CB ARG A 24 8.309 -1.938 -2.076 1.00 11.51 C ATOM 189 CG ARG A 24 7.683 -2.968 -3.002 1.00 1.41 C ATOM 190 CD ARG A 24 7.434 -2.393 -4.388 1.00 3.24 C ATOM 191 NE ARG A 24 6.077 -2.661 -4.856 1.00 2.12 N ATOM 192 CZ ARG A 24 5.487 -1.977 -5.829 1.00 41.45 C ATOM 193 NH1 ARG A 24 6.132 -0.989 -6.435 1.00 52.00 N ATOM 194 NH2 ARG A 24 4.250 -2.280 -6.200 1.00 35.34 N ATOM 0 H ARG A 24 8.266 -4.111 -0.889 1.00 55.23 H new ATOM 0 HA ARG A 24 10.376 -2.510 -1.947 1.00 21.23 H new ATOM 0 HB2 ARG A 24 7.553 -1.585 -1.375 1.00 11.51 H new ATOM 0 HB3 ARG A 24 8.624 -1.077 -2.665 1.00 11.51 H new ATOM 0 HG2 ARG A 24 8.338 -3.835 -3.079 1.00 1.41 H new ATOM 0 HG3 ARG A 24 6.742 -3.317 -2.577 1.00 1.41 H new ATOM 0 HD2 ARG A 24 7.605 -1.317 -4.370 1.00 3.24 H new ATOM 0 HD3 ARG A 24 8.150 -2.818 -5.091 1.00 3.24 H new ATOM 0 HE ARG A 24 5.554 -3.415 -4.411 1.00 2.12 H new ATOM 0 HH11 ARG A 24 7.084 -0.753 -6.154 1.00 52.00 H new ATOM 0 HH12 ARG A 24 5.676 -0.465 -7.182 1.00 52.00 H new ATOM 0 HH21 ARG A 24 3.750 -3.040 -5.738 1.00 35.34 H new ATOM 0 HH22 ARG A 24 3.798 -1.753 -6.948 1.00 35.34 H new ATOM 208 N ALA A 25 11.063 -1.587 0.351 1.00 31.22 N ATOM 209 CA ALA A 25 11.493 -0.742 1.458 1.00 42.11 C ATOM 210 C ALA A 25 12.418 0.369 0.973 1.00 65.12 C ATOM 211 O ALA A 25 13.212 0.171 0.053 1.00 61.03 O ATOM 212 CB ALA A 25 12.184 -1.579 2.524 1.00 62.21 C ATOM 0 H ALA A 25 11.786 -2.209 -0.010 1.00 31.22 H new ATOM 0 HA ALA A 25 10.608 -0.278 1.894 1.00 42.11 H new ATOM 0 HB1 ALA A 25 12.500 -0.935 3.345 1.00 62.21 H new ATOM 0 HB2 ALA A 25 11.492 -2.333 2.900 1.00 62.21 H new ATOM 0 HB3 ALA A 25 13.056 -2.070 2.092 1.00 62.21 H new ATOM 218 N ARG A 26 12.311 1.537 1.597 1.00 54.31 N ATOM 219 CA ARG A 26 13.137 2.680 1.227 1.00 53.20 C ATOM 220 C ARG A 26 14.612 2.293 1.183 1.00 1.11 C ATOM 221 O ARG A 26 15.069 1.457 1.963 1.00 2.33 O ATOM 222 CB ARG A 26 12.929 3.828 2.216 1.00 11.33 C ATOM 223 CG ARG A 26 13.343 5.185 1.670 1.00 14.14 C ATOM 224 CD ARG A 26 12.170 6.153 1.636 1.00 21.11 C ATOM 225 NE ARG A 26 11.325 5.947 0.463 1.00 13.22 N ATOM 226 CZ ARG A 26 10.197 6.615 0.244 1.00 64.34 C ATOM 227 NH1 ARG A 26 9.783 7.526 1.113 1.00 52.24 N ATOM 228 NH2 ARG A 26 9.483 6.371 -0.848 1.00 14.35 N ATOM 0 H ARG A 26 11.660 1.717 2.362 1.00 54.31 H new ATOM 0 HA ARG A 26 12.835 3.008 0.232 1.00 53.20 H new ATOM 0 HB2 ARG A 26 11.877 3.866 2.500 1.00 11.33 H new ATOM 0 HB3 ARG A 26 13.497 3.622 3.123 1.00 11.33 H new ATOM 0 HG2 ARG A 26 14.140 5.599 2.287 1.00 14.14 H new ATOM 0 HG3 ARG A 26 13.747 5.066 0.665 1.00 14.14 H new ATOM 0 HD2 ARG A 26 11.572 6.030 2.539 1.00 21.11 H new ATOM 0 HD3 ARG A 26 12.544 7.177 1.638 1.00 21.11 H new ATOM 0 HE ARG A 26 11.616 5.253 -0.225 1.00 13.22 H new ATOM 0 HH11 ARG A 26 10.330 7.716 1.952 1.00 52.24 H new ATOM 0 HH12 ARG A 26 8.917 8.037 0.942 1.00 52.24 H new ATOM 0 HH21 ARG A 26 9.800 5.671 -1.519 1.00 14.35 H new ATOM 0 HH22 ARG A 26 8.617 6.883 -1.016 1.00 14.35 H new ATOM 242 N CYS A 27 15.352 2.906 0.265 1.00 21.03 N ATOM 243 CA CYS A 27 16.775 2.626 0.118 1.00 62.11 C ATOM 244 C CYS A 27 17.572 3.919 -0.028 1.00 10.24 C ATOM 245 O CYS A 27 17.085 4.901 -0.590 1.00 23.44 O ATOM 246 CB CYS A 27 17.016 1.726 -1.096 1.00 3.21 C ATOM 247 SG CYS A 27 16.700 -0.041 -0.786 1.00 50.11 S ATOM 0 H CYS A 27 14.989 3.600 -0.388 1.00 21.03 H new ATOM 0 HA CYS A 27 17.113 2.111 1.017 1.00 62.11 H new ATOM 0 HB2 CYS A 27 16.379 2.060 -1.915 1.00 3.21 H new ATOM 0 HB3 CYS A 27 18.048 1.847 -1.426 1.00 3.21 H new ATOM 252 N TYR A 28 18.798 3.912 0.482 1.00 5.23 N ATOM 253 CA TYR A 28 19.662 5.085 0.411 1.00 24.44 C ATOM 254 C TYR A 28 21.114 4.678 0.179 1.00 4.20 C ATOM 255 O TYR A 28 21.561 3.610 0.596 1.00 25.25 O ATOM 256 CB TYR A 28 19.550 5.905 1.698 1.00 44.15 C ATOM 257 CG TYR A 28 19.996 5.157 2.934 1.00 52.13 C ATOM 258 CD1 TYR A 28 21.339 5.088 3.282 1.00 60.33 C ATOM 259 CD2 TYR A 28 19.073 4.520 3.754 1.00 13.34 C ATOM 260 CE1 TYR A 28 21.750 4.405 4.410 1.00 63.32 C ATOM 261 CE2 TYR A 28 19.475 3.836 4.885 1.00 12.23 C ATOM 262 CZ TYR A 28 20.815 3.781 5.208 1.00 34.24 C ATOM 263 OH TYR A 28 21.220 3.101 6.334 1.00 61.42 O ATOM 0 H TYR A 28 19.216 3.108 0.949 1.00 5.23 H new ATOM 0 HA TYR A 28 19.335 5.696 -0.431 1.00 24.44 H new ATOM 0 HB2 TYR A 28 20.149 6.810 1.595 1.00 44.15 H new ATOM 0 HB3 TYR A 28 18.515 6.221 1.829 1.00 44.15 H new ATOM 0 HD1 TYR A 28 22.074 5.577 2.660 1.00 60.33 H new ATOM 0 HD2 TYR A 28 18.023 4.560 3.503 1.00 13.34 H new ATOM 0 HE1 TYR A 28 22.798 4.360 4.665 1.00 63.32 H new ATOM 0 HE2 TYR A 28 18.744 3.347 5.513 1.00 12.23 H new ATOM 0 HH TYR A 28 22.142 3.352 6.554 1.00 61.42 H new ATOM 273 N PRO A 29 21.870 5.551 -0.503 1.00 40.45 N ATOM 274 CA PRO A 29 23.283 5.307 -0.807 1.00 3.43 C ATOM 275 C PRO A 29 24.162 5.369 0.438 1.00 43.42 C ATOM 276 O PRO A 29 24.333 6.431 1.039 1.00 74.13 O ATOM 277 CB PRO A 29 23.640 6.442 -1.771 1.00 22.44 C ATOM 278 CG PRO A 29 22.674 7.530 -1.450 1.00 24.54 C ATOM 279 CD PRO A 29 21.403 6.844 -1.031 1.00 50.42 C ATOM 0 HA PRO A 29 23.445 4.312 -1.221 1.00 3.43 H new ATOM 0 HB2 PRO A 29 24.669 6.772 -1.630 1.00 22.44 H new ATOM 0 HB3 PRO A 29 23.547 6.124 -2.809 1.00 22.44 H new ATOM 0 HG2 PRO A 29 23.055 8.167 -0.652 1.00 24.54 H new ATOM 0 HG3 PRO A 29 22.505 8.170 -2.316 1.00 24.54 H new ATOM 0 HD2 PRO A 29 20.868 7.417 -0.274 1.00 50.42 H new ATOM 0 HD3 PRO A 29 20.722 6.712 -1.872 1.00 50.42 H new ATOM 287 N THR A 30 24.720 4.225 0.821 1.00 60.14 N ATOM 288 CA THR A 30 25.581 4.149 1.994 1.00 1.20 C ATOM 289 C THR A 30 26.882 4.912 1.771 1.00 21.14 C ATOM 290 O THR A 30 27.101 5.970 2.361 1.00 50.22 O ATOM 291 CB THR A 30 25.911 2.689 2.356 1.00 71.35 C ATOM 292 OG1 THR A 30 24.824 1.834 1.983 1.00 50.33 O ATOM 293 CG2 THR A 30 26.185 2.549 3.845 1.00 31.53 C ATOM 0 H THR A 30 24.591 3.338 0.335 1.00 60.14 H new ATOM 0 HA THR A 30 25.032 4.604 2.818 1.00 1.20 H new ATOM 0 HB THR A 30 26.807 2.396 1.809 1.00 71.35 H new ATOM 0 HG1 THR A 30 25.042 0.907 2.215 1.00 50.33 H new ATOM 0 HG21 THR A 30 26.416 1.509 4.076 1.00 31.53 H new ATOM 0 HG22 THR A 30 27.032 3.178 4.120 1.00 31.53 H new ATOM 0 HG23 THR A 30 25.305 2.859 4.408 1.00 31.53 H new ATOM 301 N SER A 31 27.743 4.368 0.917 1.00 54.13 N ATOM 302 CA SER A 31 29.024 4.997 0.619 1.00 63.54 C ATOM 303 C SER A 31 29.049 5.528 -0.811 1.00 64.54 C ATOM 304 O SER A 31 28.295 5.069 -1.668 1.00 42.35 O ATOM 305 CB SER A 31 30.166 3.999 0.824 1.00 34.43 C ATOM 306 OG SER A 31 30.481 3.861 2.199 1.00 72.51 O ATOM 0 H SER A 31 27.577 3.493 0.419 1.00 54.13 H new ATOM 0 HA SER A 31 29.156 5.836 1.302 1.00 63.54 H new ATOM 0 HB2 SER A 31 29.884 3.030 0.413 1.00 34.43 H new ATOM 0 HB3 SER A 31 31.048 4.333 0.277 1.00 34.43 H new ATOM 0 HG SER A 31 31.212 3.217 2.304 1.00 72.51 H new ATOM 312 N ASN A 32 29.923 6.498 -1.060 1.00 61.34 N ATOM 313 CA ASN A 32 30.047 7.093 -2.386 1.00 62.31 C ATOM 314 C ASN A 32 30.223 6.015 -3.452 1.00 14.12 C ATOM 315 O ASN A 32 29.577 6.052 -4.499 1.00 2.41 O ATOM 316 CB ASN A 32 31.231 8.061 -2.424 1.00 40.25 C ATOM 317 CG ASN A 32 30.798 9.495 -2.660 1.00 55.20 C ATOM 318 OD1 ASN A 32 31.099 10.084 -3.698 1.00 45.11 O ATOM 319 ND2 ASN A 32 30.086 10.064 -1.694 1.00 54.11 N ATOM 0 H ASN A 32 30.555 6.889 -0.361 1.00 61.34 H new ATOM 0 HA ASN A 32 29.130 7.642 -2.598 1.00 62.31 H new ATOM 0 HB2 ASN A 32 31.777 8.000 -1.483 1.00 40.25 H new ATOM 0 HB3 ASN A 32 31.920 7.758 -3.213 1.00 40.25 H new ATOM 0 HD21 ASN A 32 29.766 11.027 -1.796 1.00 54.11 H new ATOM 0 HD22 ASN A 32 29.859 9.538 -0.850 1.00 54.11 H new ATOM 326 N ALA A 33 31.100 5.056 -3.177 1.00 21.35 N ATOM 327 CA ALA A 33 31.359 3.966 -4.110 1.00 13.23 C ATOM 328 C ALA A 33 30.578 2.715 -3.723 1.00 35.01 C ATOM 329 O ALA A 33 29.817 2.172 -4.525 1.00 64.51 O ATOM 330 CB ALA A 33 32.849 3.664 -4.168 1.00 34.40 C ATOM 0 H ALA A 33 31.644 5.011 -2.315 1.00 21.35 H new ATOM 0 HA ALA A 33 31.024 4.280 -5.099 1.00 13.23 H new ATOM 0 HB1 ALA A 33 33.028 2.848 -4.868 1.00 34.40 H new ATOM 0 HB2 ALA A 33 33.388 4.552 -4.500 1.00 34.40 H new ATOM 0 HB3 ALA A 33 33.201 3.375 -3.177 1.00 34.40 H new ATOM 336 N THR A 34 30.770 2.261 -2.488 1.00 73.12 N ATOM 337 CA THR A 34 30.085 1.073 -1.996 1.00 32.54 C ATOM 338 C THR A 34 30.479 0.768 -0.555 1.00 65.11 C ATOM 339 O THR A 34 31.663 0.715 -0.224 1.00 61.41 O ATOM 340 CB THR A 34 30.393 -0.157 -2.871 1.00 53.22 C ATOM 341 OG1 THR A 34 29.971 -1.352 -2.204 1.00 3.52 O ATOM 342 CG2 THR A 34 31.879 -0.241 -3.182 1.00 44.02 C ATOM 0 H THR A 34 31.395 2.699 -1.811 1.00 73.12 H new ATOM 0 HA THR A 34 29.017 1.284 -2.041 1.00 32.54 H new ATOM 0 HB THR A 34 29.847 -0.054 -3.809 1.00 53.22 H new ATOM 0 HG1 THR A 34 29.030 -1.529 -2.414 1.00 3.52 H new ATOM 0 HG21 THR A 34 32.072 -1.117 -3.801 1.00 44.02 H new ATOM 0 HG22 THR A 34 32.190 0.657 -3.717 1.00 44.02 H new ATOM 0 HG23 THR A 34 32.441 -0.323 -2.252 1.00 44.02 H new ATOM 350 N ASN A 35 29.480 0.568 0.298 1.00 70.02 N ATOM 351 CA ASN A 35 29.724 0.268 1.704 1.00 14.11 C ATOM 352 C ASN A 35 30.704 -0.892 1.851 1.00 12.31 C ATOM 353 O ASN A 35 30.879 -1.692 0.932 1.00 43.04 O ATOM 354 CB ASN A 35 28.409 -0.068 2.411 1.00 52.03 C ATOM 355 CG ASN A 35 28.518 0.046 3.919 1.00 35.50 C ATOM 356 OD1 ASN A 35 29.508 0.553 4.445 1.00 65.24 O ATOM 357 ND2 ASN A 35 27.496 -0.428 4.623 1.00 70.10 N ATOM 0 H ASN A 35 28.494 0.608 0.040 1.00 70.02 H new ATOM 0 HA ASN A 35 30.163 1.152 2.167 1.00 14.11 H new ATOM 0 HB2 ASN A 35 27.626 0.602 2.054 1.00 52.03 H new ATOM 0 HB3 ASN A 35 28.106 -1.081 2.147 1.00 52.03 H new ATOM 0 HD21 ASN A 35 27.512 -0.380 5.642 1.00 70.10 H new ATOM 0 HD22 ASN A 35 26.695 -0.840 4.145 1.00 70.10 H new ATOM 364 N THR A 36 31.341 -0.977 3.015 1.00 71.21 N ATOM 365 CA THR A 36 32.304 -2.038 3.283 1.00 34.01 C ATOM 366 C THR A 36 31.962 -2.778 4.571 1.00 1.35 C ATOM 367 O THR A 36 31.445 -2.187 5.520 1.00 0.02 O ATOM 368 CB THR A 36 33.737 -1.483 3.388 1.00 54.14 C ATOM 369 OG1 THR A 36 33.850 -0.273 2.630 1.00 71.10 O ATOM 370 CG2 THR A 36 34.749 -2.500 2.883 1.00 41.10 C ATOM 0 H THR A 36 31.207 -0.324 3.787 1.00 71.21 H new ATOM 0 HA THR A 36 32.252 -2.732 2.444 1.00 34.01 H new ATOM 0 HB THR A 36 33.947 -1.275 4.437 1.00 54.14 H new ATOM 0 HG1 THR A 36 34.763 0.075 2.703 1.00 71.10 H new ATOM 0 HG21 THR A 36 35.754 -2.086 2.967 1.00 41.10 H new ATOM 0 HG22 THR A 36 34.680 -3.409 3.480 1.00 41.10 H new ATOM 0 HG23 THR A 36 34.539 -2.735 1.839 1.00 41.10 H new ATOM 378 N CYS A 37 32.255 -4.074 4.600 1.00 53.43 N ATOM 379 CA CYS A 37 31.979 -4.895 5.772 1.00 0.01 C ATOM 380 C CYS A 37 33.140 -5.843 6.057 1.00 22.12 C ATOM 381 O CYS A 37 33.527 -6.643 5.205 1.00 55.14 O ATOM 382 CB CYS A 37 30.691 -5.695 5.569 1.00 71.13 C ATOM 383 SG CYS A 37 30.301 -6.836 6.934 1.00 21.31 S ATOM 0 H CYS A 37 32.684 -4.578 3.824 1.00 53.43 H new ATOM 0 HA CYS A 37 31.855 -4.232 6.628 1.00 0.01 H new ATOM 0 HB2 CYS A 37 29.861 -5.000 5.442 1.00 71.13 H new ATOM 0 HB3 CYS A 37 30.773 -6.266 4.644 1.00 71.13 H new ATOM 388 N PHE A 38 33.692 -5.748 7.262 1.00 4.22 N ATOM 389 CA PHE A 38 34.810 -6.596 7.660 1.00 12.03 C ATOM 390 C PHE A 38 35.914 -6.570 6.608 1.00 63.02 C ATOM 391 O PHE A 38 36.276 -7.603 6.046 1.00 51.01 O ATOM 392 CB PHE A 38 34.333 -8.033 7.881 1.00 65.23 C ATOM 393 CG PHE A 38 33.786 -8.279 9.258 1.00 42.13 C ATOM 394 CD1 PHE A 38 33.252 -7.239 10.001 1.00 54.12 C ATOM 395 CD2 PHE A 38 33.807 -9.550 9.809 1.00 10.11 C ATOM 396 CE1 PHE A 38 32.747 -7.462 11.268 1.00 12.42 C ATOM 397 CE2 PHE A 38 33.303 -9.779 11.076 1.00 43.34 C ATOM 398 CZ PHE A 38 32.774 -8.733 11.807 1.00 72.14 C ATOM 0 H PHE A 38 33.384 -5.092 7.980 1.00 4.22 H new ATOM 0 HA PHE A 38 35.215 -6.207 8.594 1.00 12.03 H new ATOM 0 HB2 PHE A 38 33.564 -8.269 7.146 1.00 65.23 H new ATOM 0 HB3 PHE A 38 35.164 -8.715 7.702 1.00 65.23 H new ATOM 0 HD1 PHE A 38 33.230 -6.242 9.585 1.00 54.12 H new ATOM 0 HD2 PHE A 38 34.222 -10.371 9.243 1.00 10.11 H new ATOM 0 HE1 PHE A 38 32.332 -6.643 11.836 1.00 12.42 H new ATOM 0 HE2 PHE A 38 33.323 -10.775 11.494 1.00 43.34 H new ATOM 0 HZ PHE A 38 32.382 -8.909 12.798 1.00 72.14 H new ATOM 408 N GLY A 39 36.446 -5.380 6.346 1.00 43.22 N ATOM 409 CA GLY A 39 37.503 -5.240 5.361 1.00 23.23 C ATOM 410 C GLY A 39 37.150 -5.885 4.036 1.00 61.40 C ATOM 411 O GLY A 39 38.032 -6.318 3.294 1.00 72.10 O ATOM 0 H GLY A 39 36.164 -4.510 6.798 1.00 43.22 H new ATOM 0 HA2 GLY A 39 37.710 -4.182 5.203 1.00 23.23 H new ATOM 0 HA3 GLY A 39 38.418 -5.689 5.748 1.00 23.23 H new ATOM 415 N SER A 40 35.856 -5.952 3.738 1.00 4.10 N ATOM 416 CA SER A 40 35.388 -6.554 2.495 1.00 21.23 C ATOM 417 C SER A 40 34.233 -5.752 1.904 1.00 11.13 C ATOM 418 O SER A 40 33.099 -5.831 2.378 1.00 24.04 O ATOM 419 CB SER A 40 34.949 -7.999 2.738 1.00 34.33 C ATOM 420 OG SER A 40 35.931 -8.914 2.284 1.00 74.32 O ATOM 0 H SER A 40 35.113 -5.597 4.340 1.00 4.10 H new ATOM 0 HA SER A 40 36.213 -6.547 1.783 1.00 21.23 H new ATOM 0 HB2 SER A 40 34.768 -8.153 3.802 1.00 34.33 H new ATOM 0 HB3 SER A 40 34.007 -8.187 2.224 1.00 34.33 H new ATOM 0 HG SER A 40 35.627 -9.830 2.452 1.00 74.32 H new ATOM 426 N LYS A 41 34.529 -4.979 0.865 1.00 12.40 N ATOM 427 CA LYS A 41 33.517 -4.161 0.206 1.00 32.41 C ATOM 428 C LYS A 41 32.321 -5.010 -0.214 1.00 62.23 C ATOM 429 O LYS A 41 32.482 -6.072 -0.818 1.00 41.42 O ATOM 430 CB LYS A 41 34.114 -3.461 -1.017 1.00 20.33 C ATOM 431 CG LYS A 41 35.275 -2.540 -0.684 1.00 14.15 C ATOM 432 CD LYS A 41 35.854 -1.898 -1.933 1.00 74.13 C ATOM 433 CE LYS A 41 34.949 -0.797 -2.464 1.00 41.34 C ATOM 434 NZ LYS A 41 35.699 0.465 -2.714 1.00 4.23 N ATOM 0 H LYS A 41 35.462 -4.902 0.461 1.00 12.40 H new ATOM 0 HA LYS A 41 33.175 -3.408 0.916 1.00 32.41 H new ATOM 0 HB2 LYS A 41 34.452 -4.215 -1.728 1.00 20.33 H new ATOM 0 HB3 LYS A 41 33.333 -2.883 -1.512 1.00 20.33 H new ATOM 0 HG2 LYS A 41 34.939 -1.763 0.003 1.00 14.15 H new ATOM 0 HG3 LYS A 41 36.053 -3.105 -0.170 1.00 14.15 H new ATOM 0 HD2 LYS A 41 36.838 -1.485 -1.709 1.00 74.13 H new ATOM 0 HD3 LYS A 41 35.995 -2.658 -2.702 1.00 74.13 H new ATOM 0 HE2 LYS A 41 34.478 -1.129 -3.389 1.00 41.34 H new ATOM 0 HE3 LYS A 41 34.149 -0.608 -1.749 1.00 41.34 H new ATOM 0 HZ1 LYS A 41 35.047 1.191 -3.075 1.00 4.23 H new ATOM 0 HZ2 LYS A 41 36.128 0.796 -1.826 1.00 4.23 H new ATOM 0 HZ3 LYS A 41 36.447 0.291 -3.416 1.00 4.23 H new ATOM 448 N LEU A 42 31.123 -4.536 0.107 1.00 13.10 N ATOM 449 CA LEU A 42 29.899 -5.251 -0.239 1.00 0.20 C ATOM 450 C LEU A 42 29.557 -5.063 -1.714 1.00 23.33 C ATOM 451 O LEU A 42 29.932 -4.073 -2.342 1.00 12.11 O ATOM 452 CB LEU A 42 28.738 -4.766 0.631 1.00 42.50 C ATOM 453 CG LEU A 42 28.888 -4.990 2.136 1.00 33.11 C ATOM 454 CD1 LEU A 42 29.467 -6.369 2.415 1.00 15.51 C ATOM 455 CD2 LEU A 42 29.762 -3.908 2.753 1.00 51.24 C ATOM 0 H LEU A 42 30.972 -3.659 0.606 1.00 13.10 H new ATOM 0 HA LEU A 42 30.064 -6.313 -0.055 1.00 0.20 H new ATOM 0 HB2 LEU A 42 28.599 -3.699 0.455 1.00 42.50 H new ATOM 0 HB3 LEU A 42 27.828 -5.265 0.299 1.00 42.50 H new ATOM 0 HG LEU A 42 27.900 -4.934 2.592 1.00 33.11 H new ATOM 0 HD11 LEU A 42 29.567 -6.511 3.491 1.00 15.51 H new ATOM 0 HD12 LEU A 42 28.803 -7.132 2.008 1.00 15.51 H new ATOM 0 HD13 LEU A 42 30.447 -6.454 1.946 1.00 15.51 H new ATOM 0 HD21 LEU A 42 29.857 -4.084 3.824 1.00 51.24 H new ATOM 0 HD22 LEU A 42 30.750 -3.931 2.292 1.00 51.24 H new ATOM 0 HD23 LEU A 42 29.306 -2.932 2.585 1.00 51.24 H new ATOM 467 N PRO A 43 28.827 -6.035 -2.280 1.00 61.23 N ATOM 468 CA PRO A 43 28.416 -5.999 -3.687 1.00 1.30 C ATOM 469 C PRO A 43 27.372 -4.921 -3.958 1.00 74.30 C ATOM 470 O PRO A 43 27.012 -4.667 -5.108 1.00 3.42 O ATOM 471 CB PRO A 43 27.822 -7.390 -3.919 1.00 73.11 C ATOM 472 CG PRO A 43 27.373 -7.840 -2.572 1.00 25.25 C ATOM 473 CD PRO A 43 28.346 -7.244 -1.591 1.00 71.44 C ATOM 0 HA PRO A 43 29.248 -5.761 -4.349 1.00 1.30 H new ATOM 0 HB2 PRO A 43 26.990 -7.353 -4.622 1.00 73.11 H new ATOM 0 HB3 PRO A 43 28.562 -8.072 -4.338 1.00 73.11 H new ATOM 0 HG2 PRO A 43 26.357 -7.504 -2.367 1.00 25.25 H new ATOM 0 HG3 PRO A 43 27.368 -8.928 -2.505 1.00 25.25 H new ATOM 0 HD2 PRO A 43 27.864 -7.002 -0.644 1.00 71.44 H new ATOM 0 HD3 PRO A 43 29.162 -7.931 -1.367 1.00 71.44 H new ATOM 481 N TYR A 44 26.888 -4.291 -2.893 1.00 63.41 N ATOM 482 CA TYR A 44 25.883 -3.242 -3.016 1.00 63.34 C ATOM 483 C TYR A 44 26.402 -1.922 -2.454 1.00 34.43 C ATOM 484 O TYR A 44 27.460 -1.876 -1.827 1.00 53.33 O ATOM 485 CB TYR A 44 24.599 -3.649 -2.292 1.00 22.44 C ATOM 486 CG TYR A 44 24.836 -4.550 -1.100 1.00 51.03 C ATOM 487 CD1 TYR A 44 25.217 -4.025 0.128 1.00 13.51 C ATOM 488 CD2 TYR A 44 24.678 -5.927 -1.203 1.00 55.43 C ATOM 489 CE1 TYR A 44 25.435 -4.844 1.219 1.00 54.22 C ATOM 490 CE2 TYR A 44 24.892 -6.753 -0.117 1.00 71.44 C ATOM 491 CZ TYR A 44 25.271 -6.207 1.091 1.00 32.32 C ATOM 492 OH TYR A 44 25.486 -7.027 2.176 1.00 55.33 O ATOM 0 H TYR A 44 27.176 -4.489 -1.935 1.00 63.41 H new ATOM 0 HA TYR A 44 25.666 -3.104 -4.075 1.00 63.34 H new ATOM 0 HB2 TYR A 44 24.078 -2.751 -1.960 1.00 22.44 H new ATOM 0 HB3 TYR A 44 23.940 -4.157 -2.996 1.00 22.44 H new ATOM 0 HD1 TYR A 44 25.345 -2.958 0.232 1.00 13.51 H new ATOM 0 HD2 TYR A 44 24.383 -6.358 -2.148 1.00 55.43 H new ATOM 0 HE1 TYR A 44 25.732 -4.419 2.166 1.00 54.22 H new ATOM 0 HE2 TYR A 44 24.763 -7.821 -0.213 1.00 71.44 H new ATOM 0 HH TYR A 44 25.219 -6.561 2.996 1.00 55.33 H new ATOM 502 N GLU A 45 25.647 -0.852 -2.682 1.00 72.11 N ATOM 503 CA GLU A 45 26.030 0.469 -2.198 1.00 53.12 C ATOM 504 C GLU A 45 24.824 1.209 -1.625 1.00 24.21 C ATOM 505 O GLU A 45 24.856 2.427 -1.447 1.00 5.32 O ATOM 506 CB GLU A 45 26.655 1.289 -3.329 1.00 12.24 C ATOM 507 CG GLU A 45 25.644 1.795 -4.344 1.00 43.23 C ATOM 508 CD GLU A 45 26.078 1.541 -5.775 1.00 12.00 C ATOM 509 OE1 GLU A 45 26.093 0.363 -6.189 1.00 62.21 O ATOM 510 OE2 GLU A 45 26.402 2.519 -6.480 1.00 53.31 O ATOM 0 H GLU A 45 24.768 -0.874 -3.198 1.00 72.11 H new ATOM 0 HA GLU A 45 26.765 0.338 -1.404 1.00 53.12 H new ATOM 0 HB2 GLU A 45 27.184 2.140 -2.900 1.00 12.24 H new ATOM 0 HB3 GLU A 45 27.398 0.678 -3.842 1.00 12.24 H new ATOM 0 HG2 GLU A 45 24.684 1.310 -4.168 1.00 43.23 H new ATOM 0 HG3 GLU A 45 25.492 2.865 -4.198 1.00 43.23 H new ATOM 517 N LEU A 46 23.762 0.464 -1.338 1.00 43.24 N ATOM 518 CA LEU A 46 22.545 1.048 -0.785 1.00 41.15 C ATOM 519 C LEU A 46 22.200 0.417 0.559 1.00 24.45 C ATOM 520 O LEU A 46 22.815 -0.568 0.970 1.00 2.31 O ATOM 521 CB LEU A 46 21.380 0.867 -1.760 1.00 64.34 C ATOM 522 CG LEU A 46 21.498 1.610 -3.092 1.00 35.23 C ATOM 523 CD1 LEU A 46 20.224 1.449 -3.907 1.00 14.04 C ATOM 524 CD2 LEU A 46 21.800 3.082 -2.856 1.00 14.53 C ATOM 0 H LEU A 46 23.719 -0.545 -1.479 1.00 43.24 H new ATOM 0 HA LEU A 46 22.720 2.113 -0.631 1.00 41.15 H new ATOM 0 HB2 LEU A 46 21.269 -0.197 -1.969 1.00 64.34 H new ATOM 0 HB3 LEU A 46 20.465 1.192 -1.265 1.00 64.34 H new ATOM 0 HG LEU A 46 22.323 1.176 -3.657 1.00 35.23 H new ATOM 0 HD11 LEU A 46 20.326 1.984 -4.851 1.00 14.04 H new ATOM 0 HD12 LEU A 46 20.051 0.391 -4.106 1.00 14.04 H new ATOM 0 HD13 LEU A 46 19.381 1.856 -3.349 1.00 14.04 H new ATOM 0 HD21 LEU A 46 21.881 3.595 -3.814 1.00 14.53 H new ATOM 0 HD22 LEU A 46 20.996 3.529 -2.271 1.00 14.53 H new ATOM 0 HD23 LEU A 46 22.740 3.178 -2.313 1.00 14.53 H new ATOM 536 N SER A 47 21.212 0.988 1.240 1.00 41.30 N ATOM 537 CA SER A 47 20.786 0.482 2.540 1.00 42.34 C ATOM 538 C SER A 47 19.351 0.903 2.842 1.00 22.45 C ATOM 539 O SER A 47 18.900 1.965 2.415 1.00 44.13 O ATOM 540 CB SER A 47 21.721 0.989 3.639 1.00 1.53 C ATOM 541 OG SER A 47 21.100 0.917 4.911 1.00 75.23 O ATOM 0 H SER A 47 20.691 1.802 0.913 1.00 41.30 H new ATOM 0 HA SER A 47 20.828 -0.607 2.511 1.00 42.34 H new ATOM 0 HB2 SER A 47 22.636 0.397 3.644 1.00 1.53 H new ATOM 0 HB3 SER A 47 22.009 2.019 3.429 1.00 1.53 H new ATOM 0 HG SER A 47 21.317 1.721 5.427 1.00 75.23 H new ATOM 547 N SER A 48 18.638 0.060 3.584 1.00 44.25 N ATOM 548 CA SER A 48 17.253 0.341 3.941 1.00 0.04 C ATOM 549 C SER A 48 17.089 0.421 5.456 1.00 13.11 C ATOM 550 O SER A 48 17.047 -0.601 6.143 1.00 54.42 O ATOM 551 CB SER A 48 16.329 -0.737 3.373 1.00 34.41 C ATOM 552 OG SER A 48 16.620 -2.006 3.934 1.00 51.14 O ATOM 0 H SER A 48 18.997 -0.822 3.949 1.00 44.25 H new ATOM 0 HA SER A 48 16.981 1.305 3.512 1.00 0.04 H new ATOM 0 HB2 SER A 48 15.291 -0.475 3.577 1.00 34.41 H new ATOM 0 HB3 SER A 48 16.439 -0.781 2.289 1.00 34.41 H new ATOM 0 HG SER A 48 17.139 -1.889 4.757 1.00 51.14 H new ATOM 558 N LEU A 49 16.996 1.642 5.971 1.00 44.32 N ATOM 559 CA LEU A 49 16.837 1.858 7.405 1.00 54.03 C ATOM 560 C LEU A 49 15.570 1.182 7.919 1.00 31.33 C ATOM 561 O LEU A 49 15.464 0.857 9.102 1.00 1.32 O ATOM 562 CB LEU A 49 16.790 3.356 7.713 1.00 20.40 C ATOM 563 CG LEU A 49 17.803 3.861 8.740 1.00 5.24 C ATOM 564 CD1 LEU A 49 17.417 3.408 10.140 1.00 72.45 C ATOM 565 CD2 LEU A 49 19.204 3.380 8.390 1.00 72.14 C ATOM 0 H LEU A 49 17.028 2.498 5.417 1.00 44.32 H new ATOM 0 HA LEU A 49 17.695 1.416 7.912 1.00 54.03 H new ATOM 0 HB2 LEU A 49 16.942 3.903 6.783 1.00 20.40 H new ATOM 0 HB3 LEU A 49 15.789 3.603 8.068 1.00 20.40 H new ATOM 0 HG LEU A 49 17.798 4.951 8.719 1.00 5.24 H new ATOM 0 HD11 LEU A 49 18.150 3.777 10.857 1.00 72.45 H new ATOM 0 HD12 LEU A 49 16.433 3.803 10.392 1.00 72.45 H new ATOM 0 HD13 LEU A 49 17.391 2.319 10.176 1.00 72.45 H new ATOM 0 HD21 LEU A 49 19.912 3.749 9.132 1.00 72.14 H new ATOM 0 HD22 LEU A 49 19.223 2.290 8.381 1.00 72.14 H new ATOM 0 HD23 LEU A 49 19.482 3.755 7.405 1.00 72.14 H new ATOM 577 N ASP A 50 14.613 0.970 7.023 1.00 54.41 N ATOM 578 CA ASP A 50 13.354 0.329 7.385 1.00 12.32 C ATOM 579 C ASP A 50 13.592 -1.092 7.886 1.00 42.11 C ATOM 580 O ASP A 50 12.879 -1.580 8.763 1.00 75.51 O ATOM 581 CB ASP A 50 12.404 0.308 6.187 1.00 51.53 C ATOM 582 CG ASP A 50 10.988 0.698 6.563 1.00 1.32 C ATOM 583 OD1 ASP A 50 10.491 0.202 7.595 1.00 21.15 O ATOM 584 OD2 ASP A 50 10.377 1.499 5.825 1.00 14.21 O ATOM 0 H ASP A 50 14.685 1.233 6.040 1.00 54.41 H new ATOM 0 HA ASP A 50 12.899 0.907 8.189 1.00 12.32 H new ATOM 0 HB2 ASP A 50 12.774 0.990 5.422 1.00 51.53 H new ATOM 0 HB3 ASP A 50 12.399 -0.690 5.749 1.00 51.53 H new ATOM 589 N LEU A 51 14.599 -1.751 7.323 1.00 53.13 N ATOM 590 CA LEU A 51 14.931 -3.117 7.711 1.00 61.30 C ATOM 591 C LEU A 51 15.335 -3.183 9.180 1.00 4.23 C ATOM 592 O LEU A 51 15.347 -4.255 9.786 1.00 71.23 O ATOM 593 CB LEU A 51 16.063 -3.657 6.834 1.00 12.53 C ATOM 594 CG LEU A 51 15.883 -5.081 6.308 1.00 43.24 C ATOM 595 CD1 LEU A 51 14.605 -5.191 5.491 1.00 44.35 C ATOM 596 CD2 LEU A 51 17.088 -5.498 5.476 1.00 13.41 C ATOM 0 H LEU A 51 15.200 -1.361 6.596 1.00 53.13 H new ATOM 0 HA LEU A 51 14.044 -3.734 7.569 1.00 61.30 H new ATOM 0 HB2 LEU A 51 16.186 -2.989 5.982 1.00 12.53 H new ATOM 0 HB3 LEU A 51 16.990 -3.617 7.406 1.00 12.53 H new ATOM 0 HG LEU A 51 15.804 -5.756 7.160 1.00 43.24 H new ATOM 0 HD11 LEU A 51 14.494 -6.212 5.125 1.00 44.35 H new ATOM 0 HD12 LEU A 51 13.750 -4.935 6.117 1.00 44.35 H new ATOM 0 HD13 LEU A 51 14.654 -4.505 4.645 1.00 44.35 H new ATOM 0 HD21 LEU A 51 16.943 -6.514 5.110 1.00 13.41 H new ATOM 0 HD22 LEU A 51 17.198 -4.820 4.630 1.00 13.41 H new ATOM 0 HD23 LEU A 51 17.986 -5.459 6.092 1.00 13.41 H new ATOM 608 N THR A 52 15.665 -2.028 9.750 1.00 1.22 N ATOM 609 CA THR A 52 16.069 -1.953 11.149 1.00 72.34 C ATOM 610 C THR A 52 15.152 -1.025 11.937 1.00 51.02 C ATOM 611 O THR A 52 14.184 -0.488 11.398 1.00 42.05 O ATOM 612 CB THR A 52 17.522 -1.461 11.288 1.00 32.34 C ATOM 613 OG1 THR A 52 17.840 -0.563 10.220 1.00 13.50 O ATOM 614 CG2 THR A 52 18.493 -2.632 11.279 1.00 72.33 C ATOM 0 H THR A 52 15.660 -1.131 9.264 1.00 1.22 H new ATOM 0 HA THR A 52 15.995 -2.962 11.554 1.00 72.34 H new ATOM 0 HB THR A 52 17.616 -0.939 12.240 1.00 32.34 H new ATOM 0 HG1 THR A 52 17.054 -0.018 10.006 1.00 13.50 H new ATOM 0 HG21 THR A 52 19.513 -2.260 11.378 1.00 72.33 H new ATOM 0 HG22 THR A 52 18.267 -3.298 12.112 1.00 72.33 H new ATOM 0 HG23 THR A 52 18.396 -3.178 10.341 1.00 72.33 H new ATOM 622 N ASP A 53 15.463 -0.840 13.215 1.00 13.30 N ATOM 623 CA ASP A 53 14.667 0.026 14.078 1.00 41.14 C ATOM 624 C ASP A 53 15.490 1.215 14.562 1.00 4.41 C ATOM 625 O ASP A 53 15.820 1.316 15.744 1.00 34.42 O ATOM 626 CB ASP A 53 14.133 -0.762 15.275 1.00 65.22 C ATOM 627 CG ASP A 53 13.142 0.036 16.098 1.00 1.13 C ATOM 628 OD1 ASP A 53 12.171 0.560 15.514 1.00 53.23 O ATOM 629 OD2 ASP A 53 13.337 0.136 17.327 1.00 2.25 O ATOM 0 H ASP A 53 16.260 -1.278 13.677 1.00 13.30 H new ATOM 0 HA ASP A 53 13.825 0.402 13.497 1.00 41.14 H new ATOM 0 HB2 ASP A 53 13.655 -1.675 14.921 1.00 65.22 H new ATOM 0 HB3 ASP A 53 14.967 -1.064 15.909 1.00 65.22 H new ATOM 634 N PHE A 54 15.821 2.114 13.641 1.00 51.32 N ATOM 635 CA PHE A 54 16.608 3.296 13.973 1.00 12.14 C ATOM 636 C PHE A 54 16.071 4.528 13.250 1.00 1.15 C ATOM 637 O PHE A 54 15.319 4.415 12.282 1.00 33.02 O ATOM 638 CB PHE A 54 18.077 3.076 13.608 1.00 42.03 C ATOM 639 CG PHE A 54 18.650 1.804 14.165 1.00 55.11 C ATOM 640 CD1 PHE A 54 18.795 1.635 15.532 1.00 21.14 C ATOM 641 CD2 PHE A 54 19.043 0.778 13.321 1.00 34.31 C ATOM 642 CE1 PHE A 54 19.321 0.466 16.049 1.00 61.55 C ATOM 643 CE2 PHE A 54 19.569 -0.394 13.831 1.00 12.04 C ATOM 644 CZ PHE A 54 19.709 -0.550 15.197 1.00 44.24 C ATOM 0 H PHE A 54 15.556 2.046 12.658 1.00 51.32 H new ATOM 0 HA PHE A 54 16.529 3.464 15.047 1.00 12.14 H new ATOM 0 HB2 PHE A 54 18.175 3.064 12.523 1.00 42.03 H new ATOM 0 HB3 PHE A 54 18.664 3.919 13.972 1.00 42.03 H new ATOM 0 HD1 PHE A 54 18.493 2.426 16.202 1.00 21.14 H new ATOM 0 HD2 PHE A 54 18.937 0.895 12.253 1.00 34.31 H new ATOM 0 HE1 PHE A 54 19.428 0.347 17.117 1.00 61.55 H new ATOM 0 HE2 PHE A 54 19.870 -1.187 13.163 1.00 12.04 H new ATOM 0 HZ PHE A 54 20.121 -1.464 15.598 1.00 44.24 H new ATOM 654 N HIS A 55 16.463 5.705 13.728 1.00 21.14 N ATOM 655 CA HIS A 55 16.022 6.959 13.128 1.00 11.04 C ATOM 656 C HIS A 55 16.990 7.410 12.039 1.00 40.12 C ATOM 657 O HIS A 55 16.614 8.144 11.124 1.00 63.32 O ATOM 658 CB HIS A 55 15.898 8.045 14.198 1.00 73.41 C ATOM 659 CG HIS A 55 14.638 7.951 15.002 1.00 11.44 C ATOM 660 ND1 HIS A 55 13.381 8.068 14.448 1.00 13.53 N ATOM 661 CD2 HIS A 55 14.446 7.749 16.327 1.00 3.41 C ATOM 662 CE1 HIS A 55 12.470 7.944 15.398 1.00 43.25 C ATOM 663 NE2 HIS A 55 13.091 7.749 16.547 1.00 11.31 N ATOM 0 H HIS A 55 17.085 5.816 14.529 1.00 21.14 H new ATOM 0 HA HIS A 55 15.045 6.792 12.675 1.00 11.04 H new ATOM 0 HB2 HIS A 55 16.754 7.981 14.870 1.00 73.41 H new ATOM 0 HB3 HIS A 55 15.941 9.023 13.719 1.00 73.41 H new ATOM 0 HD2 HIS A 55 15.216 7.613 17.072 1.00 3.41 H new ATOM 0 HE1 HIS A 55 11.400 7.994 15.258 1.00 43.25 H new ATOM 0 HE2 HIS A 55 12.637 7.619 17.451 1.00 11.31 H new ATOM 671 N THR A 56 18.239 6.967 12.143 1.00 3.33 N ATOM 672 CA THR A 56 19.262 7.327 11.169 1.00 74.32 C ATOM 673 C THR A 56 20.261 6.192 10.976 1.00 32.22 C ATOM 674 O THR A 56 20.033 5.069 11.426 1.00 55.41 O ATOM 675 CB THR A 56 20.021 8.598 11.594 1.00 21.51 C ATOM 676 OG1 THR A 56 21.072 8.258 12.506 1.00 40.24 O ATOM 677 CG2 THR A 56 19.079 9.598 12.248 1.00 63.44 C ATOM 0 H THR A 56 18.567 6.358 12.893 1.00 3.33 H new ATOM 0 HA THR A 56 18.748 7.519 10.227 1.00 74.32 H new ATOM 0 HB THR A 56 20.448 9.056 10.702 1.00 21.51 H new ATOM 0 HG1 THR A 56 21.910 8.668 12.206 1.00 40.24 H new ATOM 0 HG21 THR A 56 19.638 10.487 12.540 1.00 63.44 H new ATOM 0 HG22 THR A 56 18.297 9.876 11.542 1.00 63.44 H new ATOM 0 HG23 THR A 56 18.627 9.148 13.132 1.00 63.44 H new ATOM 685 N GLU A 57 21.369 6.492 10.306 1.00 53.23 N ATOM 686 CA GLU A 57 22.403 5.495 10.054 1.00 13.23 C ATOM 687 C GLU A 57 23.354 5.386 11.243 1.00 52.13 C ATOM 688 O GLU A 57 23.780 4.292 11.614 1.00 54.13 O ATOM 689 CB GLU A 57 23.188 5.850 8.790 1.00 73.13 C ATOM 690 CG GLU A 57 22.308 6.277 7.627 1.00 71.32 C ATOM 691 CD GLU A 57 23.106 6.596 6.378 1.00 61.34 C ATOM 692 OE1 GLU A 57 24.141 5.935 6.149 1.00 12.12 O ATOM 693 OE2 GLU A 57 22.695 7.506 5.628 1.00 2.42 O ATOM 0 H GLU A 57 21.574 7.417 9.928 1.00 53.23 H new ATOM 0 HA GLU A 57 21.915 4.531 9.911 1.00 13.23 H new ATOM 0 HB2 GLU A 57 23.887 6.654 9.020 1.00 73.13 H new ATOM 0 HB3 GLU A 57 23.783 4.988 8.487 1.00 73.13 H new ATOM 0 HG2 GLU A 57 21.595 5.483 7.405 1.00 71.32 H new ATOM 0 HG3 GLU A 57 21.729 7.154 7.917 1.00 71.32 H new ATOM 700 N LYS A 58 23.684 6.528 11.836 1.00 54.54 N ATOM 701 CA LYS A 58 24.583 6.564 12.982 1.00 25.14 C ATOM 702 C LYS A 58 24.059 5.684 14.113 1.00 63.13 C ATOM 703 O LYS A 58 24.836 5.113 14.877 1.00 30.23 O ATOM 704 CB LYS A 58 24.754 8.002 13.478 1.00 24.54 C ATOM 705 CG LYS A 58 23.600 8.490 14.337 1.00 44.25 C ATOM 706 CD LYS A 58 23.379 9.985 14.175 1.00 72.35 C ATOM 707 CE LYS A 58 23.839 10.753 15.404 1.00 62.11 C ATOM 708 NZ LYS A 58 25.314 10.666 15.592 1.00 31.22 N ATOM 0 H LYS A 58 23.341 7.442 11.541 1.00 54.54 H new ATOM 0 HA LYS A 58 25.552 6.178 12.664 1.00 25.14 H new ATOM 0 HB2 LYS A 58 25.678 8.072 14.052 1.00 24.54 H new ATOM 0 HB3 LYS A 58 24.861 8.664 12.618 1.00 24.54 H new ATOM 0 HG2 LYS A 58 22.690 7.955 14.064 1.00 44.25 H new ATOM 0 HG3 LYS A 58 23.802 8.262 15.384 1.00 44.25 H new ATOM 0 HD2 LYS A 58 23.920 10.341 13.299 1.00 72.35 H new ATOM 0 HD3 LYS A 58 22.321 10.180 13.997 1.00 72.35 H new ATOM 0 HE2 LYS A 58 23.546 11.799 15.310 1.00 62.11 H new ATOM 0 HE3 LYS A 58 23.336 10.359 16.287 1.00 62.11 H new ATOM 0 HZ1 LYS A 58 25.588 11.202 16.440 1.00 31.22 H new ATOM 0 HZ2 LYS A 58 25.591 9.670 15.707 1.00 31.22 H new ATOM 0 HZ3 LYS A 58 25.794 11.065 14.760 1.00 31.22 H new ATOM 722 N GLU A 59 22.738 5.579 14.211 1.00 74.34 N ATOM 723 CA GLU A 59 22.111 4.767 15.248 1.00 43.24 C ATOM 724 C GLU A 59 22.415 3.287 15.037 1.00 35.50 C ATOM 725 O GLU A 59 22.767 2.573 15.977 1.00 5.54 O ATOM 726 CB GLU A 59 20.598 4.993 15.258 1.00 30.33 C ATOM 727 CG GLU A 59 20.121 5.868 16.405 1.00 41.31 C ATOM 728 CD GLU A 59 19.451 5.072 17.508 1.00 60.34 C ATOM 729 OE1 GLU A 59 20.175 4.509 18.356 1.00 53.30 O ATOM 730 OE2 GLU A 59 18.204 5.010 17.522 1.00 0.52 O ATOM 0 H GLU A 59 22.081 6.046 13.586 1.00 74.34 H new ATOM 0 HA GLU A 59 22.522 5.071 16.211 1.00 43.24 H new ATOM 0 HB2 GLU A 59 20.301 5.451 14.315 1.00 30.33 H new ATOM 0 HB3 GLU A 59 20.095 4.028 15.315 1.00 30.33 H new ATOM 0 HG2 GLU A 59 20.970 6.412 16.819 1.00 41.31 H new ATOM 0 HG3 GLU A 59 19.422 6.612 16.023 1.00 41.31 H new ATOM 737 N LEU A 60 22.274 2.831 13.797 1.00 32.43 N ATOM 738 CA LEU A 60 22.532 1.434 13.462 1.00 52.53 C ATOM 739 C LEU A 60 24.001 1.086 13.675 1.00 63.23 C ATOM 740 O LEU A 60 24.326 0.076 14.298 1.00 53.01 O ATOM 741 CB LEU A 60 22.135 1.157 12.011 1.00 60.43 C ATOM 742 CG LEU A 60 22.032 -0.316 11.613 1.00 32.45 C ATOM 743 CD1 LEU A 60 20.943 -0.513 10.570 1.00 11.21 C ATOM 744 CD2 LEU A 60 23.369 -0.824 11.093 1.00 0.55 C ATOM 0 H LEU A 60 21.983 3.407 13.007 1.00 32.43 H new ATOM 0 HA LEU A 60 21.931 0.809 14.123 1.00 52.53 H new ATOM 0 HB2 LEU A 60 21.172 1.632 11.822 1.00 60.43 H new ATOM 0 HB3 LEU A 60 22.862 1.639 11.358 1.00 60.43 H new ATOM 0 HG LEU A 60 21.767 -0.893 12.499 1.00 32.45 H new ATOM 0 HD11 LEU A 60 20.885 -1.567 10.299 1.00 11.21 H new ATOM 0 HD12 LEU A 60 19.985 -0.190 10.978 1.00 11.21 H new ATOM 0 HD13 LEU A 60 21.177 0.077 9.684 1.00 11.21 H new ATOM 0 HD21 LEU A 60 23.276 -1.874 10.815 1.00 0.55 H new ATOM 0 HD22 LEU A 60 23.665 -0.242 10.220 1.00 0.55 H new ATOM 0 HD23 LEU A 60 24.125 -0.720 11.871 1.00 0.55 H new ATOM 756 N ASN A 61 24.886 1.930 13.154 1.00 0.23 N ATOM 757 CA ASN A 61 26.322 1.712 13.289 1.00 53.10 C ATOM 758 C ASN A 61 26.752 1.809 14.750 1.00 50.05 C ATOM 759 O ASN A 61 27.687 1.132 15.178 1.00 11.31 O ATOM 760 CB ASN A 61 27.094 2.731 12.449 1.00 5.44 C ATOM 761 CG ASN A 61 27.167 2.339 10.986 1.00 23.23 C ATOM 762 OD1 ASN A 61 26.843 3.132 10.102 1.00 33.15 O ATOM 763 ND2 ASN A 61 27.595 1.109 10.724 1.00 11.25 N ATOM 0 H ASN A 61 24.634 2.771 12.635 1.00 0.23 H new ATOM 0 HA ASN A 61 26.548 0.708 12.929 1.00 53.10 H new ATOM 0 HB2 ASN A 61 26.616 3.707 12.537 1.00 5.44 H new ATOM 0 HB3 ASN A 61 28.104 2.834 12.845 1.00 5.44 H new ATOM 0 HD21 ASN A 61 27.666 0.788 9.758 1.00 11.25 H new ATOM 0 HD22 ASN A 61 27.853 0.485 11.489 1.00 11.25 H new ATOM 770 N ASP A 62 26.063 2.654 15.508 1.00 1.15 N ATOM 771 CA ASP A 62 26.372 2.839 16.922 1.00 62.23 C ATOM 772 C ASP A 62 25.825 1.683 17.753 1.00 21.22 C ATOM 773 O ASP A 62 26.399 1.315 18.778 1.00 20.34 O ATOM 774 CB ASP A 62 25.794 4.163 17.423 1.00 32.24 C ATOM 775 CG ASP A 62 26.633 5.355 17.009 1.00 42.30 C ATOM 776 OD1 ASP A 62 27.636 5.154 16.293 1.00 51.35 O ATOM 777 OD2 ASP A 62 26.288 6.490 17.402 1.00 70.42 O ATOM 0 H ASP A 62 25.287 3.222 15.168 1.00 1.15 H new ATOM 0 HA ASP A 62 27.456 2.861 17.032 1.00 62.23 H new ATOM 0 HB2 ASP A 62 24.782 4.283 17.037 1.00 32.24 H new ATOM 0 HB3 ASP A 62 25.719 4.135 18.510 1.00 32.24 H new ATOM 782 N LYS A 63 24.711 1.114 17.305 1.00 11.04 N ATOM 783 CA LYS A 63 24.085 0.000 18.007 1.00 72.42 C ATOM 784 C LYS A 63 25.007 -1.215 18.030 1.00 32.43 C ATOM 785 O LYS A 63 24.931 -2.048 18.935 1.00 12.20 O ATOM 786 CB LYS A 63 22.757 -0.368 17.341 1.00 53.41 C ATOM 787 CG LYS A 63 22.811 -1.662 16.548 1.00 21.25 C ATOM 788 CD LYS A 63 22.514 -2.866 17.426 1.00 34.34 C ATOM 789 CE LYS A 63 23.285 -4.094 16.968 1.00 32.50 C ATOM 790 NZ LYS A 63 22.816 -5.331 17.653 1.00 64.12 N ATOM 0 H LYS A 63 24.223 1.406 16.458 1.00 11.04 H new ATOM 0 HA LYS A 63 23.896 0.311 19.034 1.00 72.42 H new ATOM 0 HB2 LYS A 63 21.987 -0.454 18.108 1.00 53.41 H new ATOM 0 HB3 LYS A 63 22.456 0.443 16.677 1.00 53.41 H new ATOM 0 HG2 LYS A 63 22.091 -1.620 15.731 1.00 21.25 H new ATOM 0 HG3 LYS A 63 23.797 -1.773 16.098 1.00 21.25 H new ATOM 0 HD2 LYS A 63 22.774 -2.637 18.460 1.00 34.34 H new ATOM 0 HD3 LYS A 63 21.445 -3.078 17.405 1.00 34.34 H new ATOM 0 HE2 LYS A 63 23.174 -4.211 15.890 1.00 32.50 H new ATOM 0 HE3 LYS A 63 24.347 -3.950 17.165 1.00 32.50 H new ATOM 0 HZ1 LYS A 63 23.505 -6.095 17.501 1.00 64.12 H new ATOM 0 HZ2 LYS A 63 22.721 -5.148 18.672 1.00 64.12 H new ATOM 0 HZ3 LYS A 63 21.894 -5.615 17.264 1.00 64.12 H new ATOM 804 N LEU A 64 25.878 -1.311 17.032 1.00 52.32 N ATOM 805 CA LEU A 64 26.816 -2.424 16.939 1.00 43.43 C ATOM 806 C LEU A 64 27.554 -2.625 18.258 1.00 23.43 C ATOM 807 O LEU A 64 27.922 -3.745 18.610 1.00 62.31 O ATOM 808 CB LEU A 64 27.821 -2.176 15.812 1.00 71.40 C ATOM 809 CG LEU A 64 27.227 -1.940 14.423 1.00 11.51 C ATOM 810 CD1 LEU A 64 28.185 -2.420 13.344 1.00 54.01 C ATOM 811 CD2 LEU A 64 25.881 -2.637 14.293 1.00 54.22 C ATOM 0 H LEU A 64 25.954 -0.631 16.275 1.00 52.32 H new ATOM 0 HA LEU A 64 26.249 -3.328 16.720 1.00 43.43 H new ATOM 0 HB2 LEU A 64 28.428 -1.310 16.077 1.00 71.40 H new ATOM 0 HB3 LEU A 64 28.493 -3.032 15.757 1.00 71.40 H new ATOM 0 HG LEU A 64 27.073 -0.869 14.292 1.00 11.51 H new ATOM 0 HD11 LEU A 64 27.745 -2.244 12.362 1.00 54.01 H new ATOM 0 HD12 LEU A 64 29.125 -1.875 13.423 1.00 54.01 H new ATOM 0 HD13 LEU A 64 28.372 -3.486 13.472 1.00 54.01 H new ATOM 0 HD21 LEU A 64 25.473 -2.458 13.298 1.00 54.22 H new ATOM 0 HD22 LEU A 64 26.010 -3.709 14.445 1.00 54.22 H new ATOM 0 HD23 LEU A 64 25.194 -2.244 15.043 1.00 54.22 H new ATOM 823 N ASN A 65 27.765 -1.533 18.985 1.00 2.04 N ATOM 824 CA ASN A 65 28.458 -1.590 20.268 1.00 72.34 C ATOM 825 C ASN A 65 27.808 -2.616 21.191 1.00 0.15 C ATOM 826 O ASN A 65 28.490 -3.294 21.961 1.00 51.34 O ATOM 827 CB ASN A 65 28.455 -0.213 20.934 1.00 22.12 C ATOM 828 CG ASN A 65 29.698 0.591 20.605 1.00 24.33 C ATOM 829 OD1 ASN A 65 30.468 0.956 21.494 1.00 51.30 O ATOM 830 ND2 ASN A 65 29.900 0.870 19.323 1.00 61.12 N ATOM 0 H ASN A 65 27.466 -0.598 18.708 1.00 2.04 H new ATOM 0 HA ASN A 65 29.488 -1.894 20.084 1.00 72.34 H new ATOM 0 HB2 ASN A 65 27.572 0.341 20.614 1.00 22.12 H new ATOM 0 HB3 ASN A 65 28.380 -0.335 22.015 1.00 22.12 H new ATOM 0 HD21 ASN A 65 30.720 1.407 19.041 1.00 61.12 H new ATOM 0 HD22 ASN A 65 29.235 0.547 18.620 1.00 61.12 H new ATOM 837 N ASP A 66 26.487 -2.724 21.109 1.00 34.45 N ATOM 838 CA ASP A 66 25.744 -3.668 21.937 1.00 61.54 C ATOM 839 C ASP A 66 26.176 -5.102 21.646 1.00 72.45 C ATOM 840 O ASP A 66 26.439 -5.880 22.563 1.00 60.53 O ATOM 841 CB ASP A 66 24.241 -3.517 21.697 1.00 1.44 C ATOM 842 CG ASP A 66 23.594 -2.552 22.672 1.00 43.02 C ATOM 843 OD1 ASP A 66 23.550 -1.342 22.367 1.00 42.00 O ATOM 844 OD2 ASP A 66 23.133 -3.007 23.740 1.00 41.13 O ATOM 0 H ASP A 66 25.908 -2.170 20.478 1.00 34.45 H new ATOM 0 HA ASP A 66 25.961 -3.446 22.982 1.00 61.54 H new ATOM 0 HB2 ASP A 66 24.072 -3.168 20.678 1.00 1.44 H new ATOM 0 HB3 ASP A 66 23.762 -4.492 21.784 1.00 1.44 H new ATOM 849 N TYR A 67 26.245 -5.445 20.364 1.00 21.21 N ATOM 850 CA TYR A 67 26.641 -6.787 19.952 1.00 3.41 C ATOM 851 C TYR A 67 28.142 -6.992 20.135 1.00 50.32 C ATOM 852 O TYR A 67 28.602 -8.107 20.379 1.00 25.21 O ATOM 853 CB TYR A 67 26.256 -7.029 18.492 1.00 42.23 C ATOM 854 CG TYR A 67 27.441 -7.076 17.553 1.00 54.40 C ATOM 855 CD1 TYR A 67 28.201 -8.230 17.419 1.00 23.54 C ATOM 856 CD2 TYR A 67 27.798 -5.965 16.799 1.00 43.32 C ATOM 857 CE1 TYR A 67 29.285 -8.277 16.564 1.00 74.25 C ATOM 858 CE2 TYR A 67 28.879 -6.003 15.939 1.00 2.22 C ATOM 859 CZ TYR A 67 29.619 -7.161 15.825 1.00 24.15 C ATOM 860 OH TYR A 67 30.697 -7.204 14.971 1.00 70.13 O ATOM 0 H TYR A 67 26.032 -4.813 19.593 1.00 21.21 H new ATOM 0 HA TYR A 67 26.115 -7.504 20.583 1.00 3.41 H new ATOM 0 HB2 TYR A 67 25.709 -7.969 18.420 1.00 42.23 H new ATOM 0 HB3 TYR A 67 25.578 -6.240 18.168 1.00 42.23 H new ATOM 0 HD1 TYR A 67 27.940 -9.107 17.993 1.00 23.54 H new ATOM 0 HD2 TYR A 67 27.221 -5.056 16.886 1.00 43.32 H new ATOM 0 HE1 TYR A 67 29.868 -9.182 16.475 1.00 74.25 H new ATOM 0 HE2 TYR A 67 29.143 -5.131 15.359 1.00 2.22 H new ATOM 0 HH TYR A 67 30.796 -6.337 14.525 1.00 70.13 H new ATOM 870 N TYR A 68 28.899 -5.907 20.015 1.00 23.02 N ATOM 871 CA TYR A 68 30.348 -5.966 20.165 1.00 24.41 C ATOM 872 C TYR A 68 30.734 -6.713 21.438 1.00 23.23 C ATOM 873 O TYR A 68 31.727 -7.440 21.468 1.00 34.40 O ATOM 874 CB TYR A 68 30.938 -4.555 20.190 1.00 72.12 C ATOM 875 CG TYR A 68 31.581 -4.145 18.885 1.00 44.34 C ATOM 876 CD1 TYR A 68 32.814 -4.659 18.503 1.00 23.10 C ATOM 877 CD2 TYR A 68 30.956 -3.243 18.032 1.00 33.04 C ATOM 878 CE1 TYR A 68 33.406 -4.286 17.312 1.00 61.21 C ATOM 879 CE2 TYR A 68 31.539 -2.866 16.838 1.00 5.45 C ATOM 880 CZ TYR A 68 32.765 -3.389 16.483 1.00 72.50 C ATOM 881 OH TYR A 68 33.350 -3.017 15.295 1.00 44.32 O ATOM 0 H TYR A 68 28.533 -4.976 19.814 1.00 23.02 H new ATOM 0 HA TYR A 68 30.754 -6.507 19.310 1.00 24.41 H new ATOM 0 HB2 TYR A 68 30.149 -3.844 20.436 1.00 72.12 H new ATOM 0 HB3 TYR A 68 31.680 -4.495 20.986 1.00 72.12 H new ATOM 0 HD1 TYR A 68 33.318 -5.363 19.149 1.00 23.10 H new ATOM 0 HD2 TYR A 68 29.997 -2.829 18.308 1.00 33.04 H new ATOM 0 HE1 TYR A 68 34.366 -4.694 17.031 1.00 61.21 H new ATOM 0 HE2 TYR A 68 31.038 -2.166 16.186 1.00 5.45 H new ATOM 0 HH TYR A 68 32.769 -2.380 14.829 1.00 44.32 H new ATOM 891 N ALA A 69 29.941 -6.528 22.488 1.00 3.25 N ATOM 892 CA ALA A 69 30.197 -7.185 23.764 1.00 31.01 C ATOM 893 C ALA A 69 30.324 -8.694 23.588 1.00 31.43 C ATOM 894 O ALA A 69 31.043 -9.359 24.336 1.00 44.44 O ATOM 895 CB ALA A 69 29.091 -6.859 24.757 1.00 40.41 C ATOM 0 H ALA A 69 29.116 -5.929 22.480 1.00 3.25 H new ATOM 0 HA ALA A 69 31.143 -6.810 24.154 1.00 31.01 H new ATOM 0 HB1 ALA A 69 29.295 -7.356 25.705 1.00 40.41 H new ATOM 0 HB2 ALA A 69 29.049 -5.781 24.914 1.00 40.41 H new ATOM 0 HB3 ALA A 69 28.135 -7.206 24.364 1.00 40.41 H new ATOM 901 N LEU A 70 29.621 -9.231 22.597 1.00 11.00 N ATOM 902 CA LEU A 70 29.655 -10.663 22.323 1.00 35.52 C ATOM 903 C LEU A 70 31.067 -11.117 21.966 1.00 15.41 C ATOM 904 O LEU A 70 31.379 -12.307 22.012 1.00 52.34 O ATOM 905 CB LEU A 70 28.693 -11.008 21.185 1.00 52.24 C ATOM 906 CG LEU A 70 28.397 -12.494 20.982 1.00 22.31 C ATOM 907 CD1 LEU A 70 26.907 -12.765 21.117 1.00 72.31 C ATOM 908 CD2 LEU A 70 28.905 -12.959 19.625 1.00 60.00 C ATOM 0 H LEU A 70 29.020 -8.696 21.970 1.00 11.00 H new ATOM 0 HA LEU A 70 29.343 -11.187 23.226 1.00 35.52 H new ATOM 0 HB2 LEU A 70 27.750 -10.492 21.365 1.00 52.24 H new ATOM 0 HB3 LEU A 70 29.103 -10.610 20.257 1.00 52.24 H new ATOM 0 HG LEU A 70 28.919 -13.057 21.755 1.00 22.31 H new ATOM 0 HD11 LEU A 70 26.716 -13.828 20.969 1.00 72.31 H new ATOM 0 HD12 LEU A 70 26.572 -12.471 22.112 1.00 72.31 H new ATOM 0 HD13 LEU A 70 26.363 -12.191 20.367 1.00 72.31 H new ATOM 0 HD21 LEU A 70 28.686 -14.019 19.498 1.00 60.00 H new ATOM 0 HD22 LEU A 70 28.412 -12.389 18.837 1.00 60.00 H new ATOM 0 HD23 LEU A 70 29.982 -12.802 19.566 1.00 60.00 H new ATOM 920 N LYS A 71 31.918 -10.160 21.612 1.00 13.44 N ATOM 921 CA LYS A 71 33.298 -10.458 21.251 1.00 63.23 C ATOM 922 C LYS A 71 33.946 -11.373 22.285 1.00 1.02 C ATOM 923 O LYS A 71 34.808 -12.189 21.955 1.00 55.44 O ATOM 924 CB LYS A 71 34.105 -9.164 21.123 1.00 51.05 C ATOM 925 CG LYS A 71 34.327 -8.452 22.446 1.00 64.32 C ATOM 926 CD LYS A 71 35.241 -7.249 22.285 1.00 11.21 C ATOM 927 CE LYS A 71 34.459 -6.003 21.898 1.00 32.03 C ATOM 928 NZ LYS A 71 33.827 -5.355 23.081 1.00 21.20 N ATOM 0 H LYS A 71 31.675 -9.170 21.568 1.00 13.44 H new ATOM 0 HA LYS A 71 33.292 -10.972 20.290 1.00 63.23 H new ATOM 0 HB2 LYS A 71 35.073 -9.392 20.676 1.00 51.05 H new ATOM 0 HB3 LYS A 71 33.589 -8.490 20.439 1.00 51.05 H new ATOM 0 HG2 LYS A 71 33.368 -8.130 22.852 1.00 64.32 H new ATOM 0 HG3 LYS A 71 34.761 -9.146 23.166 1.00 64.32 H new ATOM 0 HD2 LYS A 71 35.775 -7.069 23.218 1.00 11.21 H new ATOM 0 HD3 LYS A 71 35.991 -7.460 21.523 1.00 11.21 H new ATOM 0 HE2 LYS A 71 35.126 -5.293 21.408 1.00 32.03 H new ATOM 0 HE3 LYS A 71 33.688 -6.268 21.174 1.00 32.03 H new ATOM 0 HZ1 LYS A 71 33.304 -4.510 22.776 1.00 21.20 H new ATOM 0 HZ2 LYS A 71 33.171 -6.023 23.534 1.00 21.20 H new ATOM 0 HZ3 LYS A 71 34.564 -5.079 23.761 1.00 21.20 H new ATOM 942 N HIS A 72 33.525 -11.233 23.538 1.00 23.24 N ATOM 943 CA HIS A 72 34.064 -12.049 24.621 1.00 35.10 C ATOM 944 C HIS A 72 34.030 -13.530 24.254 1.00 45.43 C ATOM 945 O HIS A 72 34.999 -14.257 24.476 1.00 52.43 O ATOM 946 CB HIS A 72 33.272 -11.813 25.908 1.00 70.23 C ATOM 947 CG HIS A 72 34.120 -11.369 27.060 1.00 71.04 C ATOM 948 ND1 HIS A 72 34.270 -10.046 27.417 1.00 4.22 N ATOM 949 CD2 HIS A 72 34.864 -12.081 27.938 1.00 60.43 C ATOM 950 CE1 HIS A 72 35.072 -9.963 28.464 1.00 33.32 C ATOM 951 NE2 HIS A 72 35.446 -11.185 28.800 1.00 15.21 N ATOM 0 H HIS A 72 32.813 -10.563 23.829 1.00 23.24 H new ATOM 0 HA HIS A 72 35.101 -11.756 24.782 1.00 35.10 H new ATOM 0 HB2 HIS A 72 32.506 -11.061 25.721 1.00 70.23 H new ATOM 0 HB3 HIS A 72 32.756 -12.733 26.181 1.00 70.23 H new ATOM 0 HD2 HIS A 72 34.979 -13.155 27.957 1.00 60.43 H new ATOM 0 HE1 HIS A 72 35.371 -9.052 28.960 1.00 33.32 H new ATOM 0 HE2 HIS A 72 36.066 -11.424 29.574 1.00 15.21 H new ATOM 959 N VAL A 73 32.909 -13.970 23.691 1.00 5.01 N ATOM 960 CA VAL A 73 32.750 -15.363 23.293 1.00 63.43 C ATOM 961 C VAL A 73 33.113 -15.560 21.825 1.00 21.31 C ATOM 962 O VAL A 73 32.442 -15.061 20.922 1.00 42.23 O ATOM 963 CB VAL A 73 31.308 -15.852 23.524 1.00 51.14 C ATOM 964 CG1 VAL A 73 31.174 -17.320 23.147 1.00 3.41 C ATOM 965 CG2 VAL A 73 30.894 -15.624 24.970 1.00 72.15 C ATOM 0 H VAL A 73 32.098 -13.382 23.500 1.00 5.01 H new ATOM 0 HA VAL A 73 33.428 -15.949 23.914 1.00 63.43 H new ATOM 0 HB VAL A 73 30.640 -15.276 22.884 1.00 51.14 H new ATOM 0 HG11 VAL A 73 30.148 -17.647 23.317 1.00 3.41 H new ATOM 0 HG12 VAL A 73 31.427 -17.450 22.095 1.00 3.41 H new ATOM 0 HG13 VAL A 73 31.851 -17.916 23.759 1.00 3.41 H new ATOM 0 HG21 VAL A 73 29.872 -15.975 25.116 1.00 72.15 H new ATOM 0 HG22 VAL A 73 31.564 -16.173 25.631 1.00 72.15 H new ATOM 0 HG23 VAL A 73 30.948 -14.560 25.201 1.00 72.15 H new ATOM 975 N PRO A 74 34.200 -16.306 21.579 1.00 23.44 N ATOM 976 CA PRO A 74 34.677 -16.588 20.222 1.00 10.10 C ATOM 977 C PRO A 74 33.743 -17.523 19.462 1.00 71.21 C ATOM 978 O PRO A 74 33.551 -17.380 18.254 1.00 1.32 O ATOM 979 CB PRO A 74 36.033 -17.259 20.454 1.00 31.03 C ATOM 980 CG PRO A 74 35.932 -17.856 21.815 1.00 10.05 C ATOM 981 CD PRO A 74 35.048 -16.933 22.608 1.00 73.23 C ATOM 0 HA PRO A 74 34.732 -15.685 19.614 1.00 10.10 H new ATOM 0 HB2 PRO A 74 36.231 -18.022 19.701 1.00 31.03 H new ATOM 0 HB3 PRO A 74 36.847 -16.536 20.398 1.00 31.03 H new ATOM 0 HG2 PRO A 74 35.508 -18.859 21.770 1.00 10.05 H new ATOM 0 HG3 PRO A 74 36.916 -17.946 22.276 1.00 10.05 H new ATOM 0 HD2 PRO A 74 34.454 -17.478 23.342 1.00 73.23 H new ATOM 0 HD3 PRO A 74 35.630 -16.192 23.156 1.00 73.23 H new ATOM 989 N LYS A 75 33.163 -18.482 20.176 1.00 11.34 N ATOM 990 CA LYS A 75 32.247 -19.441 19.570 1.00 12.54 C ATOM 991 C LYS A 75 31.082 -18.726 18.893 1.00 72.34 C ATOM 992 O LYS A 75 30.741 -19.022 17.747 1.00 41.23 O ATOM 993 CB LYS A 75 31.718 -20.411 20.629 1.00 53.20 C ATOM 994 CG LYS A 75 32.752 -21.417 21.102 1.00 32.55 C ATOM 995 CD LYS A 75 32.874 -22.586 20.139 1.00 22.11 C ATOM 996 CE LYS A 75 33.968 -22.347 19.109 1.00 32.43 C ATOM 997 NZ LYS A 75 33.461 -22.497 17.717 1.00 20.01 N ATOM 0 H LYS A 75 33.311 -18.616 21.176 1.00 11.34 H new ATOM 0 HA LYS A 75 32.795 -20.002 18.814 1.00 12.54 H new ATOM 0 HB2 LYS A 75 31.360 -19.840 21.486 1.00 53.20 H new ATOM 0 HB3 LYS A 75 30.861 -20.947 20.222 1.00 53.20 H new ATOM 0 HG2 LYS A 75 33.720 -20.925 21.203 1.00 32.55 H new ATOM 0 HG3 LYS A 75 32.477 -21.786 22.090 1.00 32.55 H new ATOM 0 HD2 LYS A 75 33.090 -23.497 20.697 1.00 22.11 H new ATOM 0 HD3 LYS A 75 31.922 -22.742 19.631 1.00 22.11 H new ATOM 0 HE2 LYS A 75 34.378 -21.346 19.240 1.00 32.43 H new ATOM 0 HE3 LYS A 75 34.784 -23.050 19.276 1.00 32.43 H new ATOM 0 HZ1 LYS A 75 34.236 -22.326 17.045 1.00 20.01 H new ATOM 0 HZ2 LYS A 75 33.093 -23.460 17.584 1.00 20.01 H new ATOM 0 HZ3 LYS A 75 32.699 -21.809 17.549 1.00 20.01 H new ATOM 1011 N CYS A 76 30.475 -17.784 19.607 1.00 60.32 N ATOM 1012 CA CYS A 76 29.349 -17.027 19.074 1.00 11.35 C ATOM 1013 C CYS A 76 29.834 -15.847 18.237 1.00 3.44 C ATOM 1014 O CYS A 76 29.172 -15.434 17.285 1.00 20.03 O ATOM 1015 CB CYS A 76 28.460 -16.526 20.214 1.00 33.04 C ATOM 1016 SG CYS A 76 26.732 -17.095 20.114 1.00 10.23 S ATOM 0 H CYS A 76 30.744 -17.527 20.557 1.00 60.32 H new ATOM 0 HA CYS A 76 28.768 -17.690 18.433 1.00 11.35 H new ATOM 0 HB2 CYS A 76 28.885 -16.854 21.163 1.00 33.04 H new ATOM 0 HB3 CYS A 76 28.473 -15.436 20.218 1.00 33.04 H new ATOM 1021 N TRP A 77 30.993 -15.309 18.599 1.00 25.24 N ATOM 1022 CA TRP A 77 31.568 -14.177 17.882 1.00 51.22 C ATOM 1023 C TRP A 77 31.703 -14.486 16.395 1.00 72.30 C ATOM 1024 O TRP A 77 31.190 -13.753 15.550 1.00 35.31 O ATOM 1025 CB TRP A 77 32.935 -13.816 18.466 1.00 34.34 C ATOM 1026 CG TRP A 77 33.852 -13.167 17.475 1.00 10.52 C ATOM 1027 CD1 TRP A 77 35.119 -13.560 17.151 1.00 40.41 C ATOM 1028 CD2 TRP A 77 33.574 -12.008 16.681 1.00 34.03 C ATOM 1029 NE1 TRP A 77 35.645 -12.715 16.203 1.00 22.22 N ATOM 1030 CE2 TRP A 77 34.717 -11.756 15.898 1.00 53.43 C ATOM 1031 CE3 TRP A 77 32.470 -11.161 16.554 1.00 13.24 C ATOM 1032 CZ2 TRP A 77 34.785 -10.691 15.003 1.00 60.12 C ATOM 1033 CZ3 TRP A 77 32.539 -10.105 15.666 1.00 2.41 C ATOM 1034 CH2 TRP A 77 33.690 -9.877 14.899 1.00 33.51 C ATOM 0 H TRP A 77 31.553 -15.639 19.385 1.00 25.24 H new ATOM 0 HA TRP A 77 30.896 -13.327 17.998 1.00 51.22 H new ATOM 0 HB2 TRP A 77 32.794 -13.145 19.313 1.00 34.34 H new ATOM 0 HB3 TRP A 77 33.408 -14.720 18.850 1.00 34.34 H new ATOM 0 HD1 TRP A 77 35.632 -14.410 17.577 1.00 40.41 H new ATOM 0 HE1 TRP A 77 36.576 -12.790 15.793 1.00 22.22 H new ATOM 0 HE3 TRP A 77 31.578 -11.329 17.140 1.00 13.24 H new ATOM 0 HZ2 TRP A 77 35.671 -10.514 14.412 1.00 60.12 H new ATOM 0 HZ3 TRP A 77 31.692 -9.444 15.561 1.00 2.41 H new ATOM 0 HH2 TRP A 77 33.713 -9.043 14.213 1.00 33.51 H new ATOM 1045 N ALA A 78 32.396 -15.576 16.082 1.00 21.13 N ATOM 1046 CA ALA A 78 32.596 -15.983 14.697 1.00 71.10 C ATOM 1047 C ALA A 78 31.285 -16.437 14.064 1.00 62.33 C ATOM 1048 O ALA A 78 31.209 -16.645 12.853 1.00 21.43 O ATOM 1049 CB ALA A 78 33.635 -17.092 14.617 1.00 11.32 C ATOM 0 H ALA A 78 32.828 -16.193 16.769 1.00 21.13 H new ATOM 0 HA ALA A 78 32.959 -15.120 14.139 1.00 71.10 H new ATOM 0 HB1 ALA A 78 33.774 -17.386 13.577 1.00 11.32 H new ATOM 0 HB2 ALA A 78 34.581 -16.734 15.023 1.00 11.32 H new ATOM 0 HB3 ALA A 78 33.295 -17.952 15.195 1.00 11.32 H new ATOM 1055 N ALA A 79 30.256 -16.590 14.890 1.00 13.13 N ATOM 1056 CA ALA A 79 28.948 -17.018 14.410 1.00 32.44 C ATOM 1057 C ALA A 79 28.254 -15.902 13.637 1.00 61.21 C ATOM 1058 O ALA A 79 27.562 -16.155 12.651 1.00 72.45 O ATOM 1059 CB ALA A 79 28.081 -17.473 15.575 1.00 22.43 C ATOM 0 H ALA A 79 30.303 -16.424 15.895 1.00 13.13 H new ATOM 0 HA ALA A 79 29.095 -17.858 13.731 1.00 32.44 H new ATOM 0 HB1 ALA A 79 27.107 -17.790 15.202 1.00 22.43 H new ATOM 0 HB2 ALA A 79 28.564 -18.308 16.084 1.00 22.43 H new ATOM 0 HB3 ALA A 79 27.950 -16.648 16.275 1.00 22.43 H new ATOM 1065 N ILE A 80 28.444 -14.668 14.091 1.00 54.11 N ATOM 1066 CA ILE A 80 27.836 -13.514 13.441 1.00 50.44 C ATOM 1067 C ILE A 80 28.827 -12.821 12.512 1.00 44.21 C ATOM 1068 O ILE A 80 28.594 -11.698 12.066 1.00 11.44 O ATOM 1069 CB ILE A 80 27.318 -12.494 14.472 1.00 33.33 C ATOM 1070 CG1 ILE A 80 26.256 -11.592 13.841 1.00 55.11 C ATOM 1071 CG2 ILE A 80 28.468 -11.664 15.020 1.00 4.33 C ATOM 1072 CD1 ILE A 80 25.818 -10.455 14.738 1.00 71.04 C ATOM 0 H ILE A 80 29.014 -14.442 14.906 1.00 54.11 H new ATOM 0 HA ILE A 80 26.994 -13.888 12.858 1.00 50.44 H new ATOM 0 HB ILE A 80 26.861 -13.037 15.300 1.00 33.33 H new ATOM 0 HG12 ILE A 80 26.647 -11.180 12.911 1.00 55.11 H new ATOM 0 HG13 ILE A 80 25.386 -12.195 13.582 1.00 55.11 H new ATOM 0 HG21 ILE A 80 28.086 -10.948 15.747 1.00 4.33 H new ATOM 0 HG22 ILE A 80 29.192 -12.320 15.503 1.00 4.33 H new ATOM 0 HG23 ILE A 80 28.952 -11.128 14.203 1.00 4.33 H new ATOM 0 HD11 ILE A 80 25.064 -9.857 14.226 1.00 71.04 H new ATOM 0 HD12 ILE A 80 25.397 -10.859 15.658 1.00 71.04 H new ATOM 0 HD13 ILE A 80 26.677 -9.828 14.977 1.00 71.04 H new ATOM 1084 N GLN A 81 29.933 -13.499 12.223 1.00 21.44 N ATOM 1085 CA GLN A 81 30.960 -12.949 11.346 1.00 33.02 C ATOM 1086 C GLN A 81 30.395 -12.666 9.958 1.00 0.01 C ATOM 1087 O GLN A 81 30.400 -11.532 9.478 1.00 21.05 O ATOM 1088 CB GLN A 81 32.142 -13.914 11.242 1.00 41.21 C ATOM 1089 CG GLN A 81 33.456 -13.321 11.725 1.00 52.31 C ATOM 1090 CD GLN A 81 34.411 -14.372 12.256 1.00 55.23 C ATOM 1091 OE1 GLN A 81 34.582 -15.432 11.654 1.00 73.23 O ATOM 1092 NE2 GLN A 81 35.039 -14.083 13.389 1.00 0.31 N ATOM 0 H GLN A 81 30.141 -14.430 12.583 1.00 21.44 H new ATOM 0 HA GLN A 81 31.305 -12.009 11.776 1.00 33.02 H new ATOM 0 HB2 GLN A 81 31.922 -14.809 11.823 1.00 41.21 H new ATOM 0 HB3 GLN A 81 32.254 -14.227 10.204 1.00 41.21 H new ATOM 0 HG2 GLN A 81 33.932 -12.785 10.904 1.00 52.31 H new ATOM 0 HG3 GLN A 81 33.254 -12.590 12.508 1.00 52.31 H new ATOM 0 HE21 GLN A 81 34.867 -13.192 13.854 1.00 0.31 H new ATOM 0 HE22 GLN A 81 35.694 -14.752 13.794 1.00 0.31 H new ATOM 1101 N PRO A 82 29.896 -13.720 9.295 1.00 22.14 N ATOM 1102 CA PRO A 82 29.318 -13.610 7.953 1.00 43.23 C ATOM 1103 C PRO A 82 27.992 -12.858 7.952 1.00 12.35 C ATOM 1104 O PRO A 82 27.651 -12.180 6.983 1.00 43.23 O ATOM 1105 CB PRO A 82 29.106 -15.068 7.537 1.00 45.41 C ATOM 1106 CG PRO A 82 28.972 -15.812 8.820 1.00 2.04 C ATOM 1107 CD PRO A 82 29.857 -15.101 9.806 1.00 3.41 C ATOM 0 HA PRO A 82 29.963 -13.049 7.277 1.00 43.23 H new ATOM 0 HB2 PRO A 82 28.214 -15.178 6.920 1.00 45.41 H new ATOM 0 HB3 PRO A 82 29.947 -15.439 6.950 1.00 45.41 H new ATOM 0 HG2 PRO A 82 27.936 -15.820 9.160 1.00 2.04 H new ATOM 0 HG3 PRO A 82 29.276 -16.852 8.702 1.00 2.04 H new ATOM 0 HD2 PRO A 82 29.449 -15.144 10.816 1.00 3.41 H new ATOM 0 HD3 PRO A 82 30.852 -15.544 9.845 1.00 3.41 H new ATOM 1115 N PHE A 83 27.247 -12.981 9.046 1.00 74.32 N ATOM 1116 CA PHE A 83 25.957 -12.313 9.171 1.00 35.22 C ATOM 1117 C PHE A 83 26.139 -10.840 9.525 1.00 70.04 C ATOM 1118 O PHE A 83 25.233 -10.027 9.334 1.00 22.25 O ATOM 1119 CB PHE A 83 25.103 -13.003 10.237 1.00 35.01 C ATOM 1120 CG PHE A 83 23.733 -12.405 10.387 1.00 32.21 C ATOM 1121 CD1 PHE A 83 22.997 -12.038 9.272 1.00 10.42 C ATOM 1122 CD2 PHE A 83 23.181 -12.210 11.643 1.00 24.42 C ATOM 1123 CE1 PHE A 83 21.736 -11.488 9.407 1.00 41.54 C ATOM 1124 CE2 PHE A 83 21.921 -11.661 11.784 1.00 71.32 C ATOM 1125 CZ PHE A 83 21.198 -11.298 10.664 1.00 31.23 C ATOM 0 H PHE A 83 27.515 -13.537 9.858 1.00 74.32 H new ATOM 0 HA PHE A 83 25.448 -12.377 8.209 1.00 35.22 H new ATOM 0 HB2 PHE A 83 25.004 -14.059 9.985 1.00 35.01 H new ATOM 0 HB3 PHE A 83 25.620 -12.951 11.195 1.00 35.01 H new ATOM 0 HD1 PHE A 83 23.413 -12.183 8.286 1.00 10.42 H new ATOM 0 HD2 PHE A 83 23.742 -12.490 12.522 1.00 24.42 H new ATOM 0 HE1 PHE A 83 21.172 -11.207 8.530 1.00 41.54 H new ATOM 0 HE2 PHE A 83 21.502 -11.516 12.769 1.00 71.32 H new ATOM 0 HZ PHE A 83 20.214 -10.866 10.772 1.00 31.23 H new ATOM 1135 N LEU A 84 27.316 -10.503 10.040 1.00 31.25 N ATOM 1136 CA LEU A 84 27.619 -9.128 10.422 1.00 73.03 C ATOM 1137 C LEU A 84 27.324 -8.167 9.274 1.00 34.34 C ATOM 1138 O LEU A 84 27.081 -6.980 9.492 1.00 43.44 O ATOM 1139 CB LEU A 84 29.085 -9.005 10.841 1.00 72.25 C ATOM 1140 CG LEU A 84 29.349 -8.259 12.149 1.00 71.20 C ATOM 1141 CD1 LEU A 84 29.137 -6.765 11.964 1.00 53.24 C ATOM 1142 CD2 LEU A 84 28.454 -8.793 13.257 1.00 34.55 C ATOM 0 H LEU A 84 28.076 -11.163 10.203 1.00 31.25 H new ATOM 0 HA LEU A 84 26.983 -8.863 11.267 1.00 73.03 H new ATOM 0 HB2 LEU A 84 29.503 -10.008 10.928 1.00 72.25 H new ATOM 0 HB3 LEU A 84 29.629 -8.501 10.042 1.00 72.25 H new ATOM 0 HG LEU A 84 30.387 -8.425 12.436 1.00 71.20 H new ATOM 0 HD11 LEU A 84 29.330 -6.251 12.906 1.00 53.24 H new ATOM 0 HD12 LEU A 84 29.820 -6.392 11.201 1.00 53.24 H new ATOM 0 HD13 LEU A 84 28.109 -6.579 11.653 1.00 53.24 H new ATOM 0 HD21 LEU A 84 28.655 -8.251 14.181 1.00 34.55 H new ATOM 0 HD22 LEU A 84 27.409 -8.658 12.977 1.00 34.55 H new ATOM 0 HD23 LEU A 84 28.655 -9.854 13.408 1.00 34.55 H new ATOM 1154 N CYS A 85 27.343 -8.689 8.053 1.00 65.25 N ATOM 1155 CA CYS A 85 27.076 -7.879 6.870 1.00 24.31 C ATOM 1156 C CYS A 85 25.613 -7.993 6.452 1.00 63.42 C ATOM 1157 O CYS A 85 25.002 -7.016 6.021 1.00 43.11 O ATOM 1158 CB CYS A 85 27.983 -8.310 5.716 1.00 63.23 C ATOM 1159 SG CYS A 85 29.721 -8.575 6.194 1.00 0.32 S ATOM 0 H CYS A 85 27.541 -9.670 7.856 1.00 65.25 H new ATOM 0 HA CYS A 85 27.285 -6.838 7.118 1.00 24.31 H new ATOM 0 HB2 CYS A 85 27.591 -9.231 5.285 1.00 63.23 H new ATOM 0 HB3 CYS A 85 27.944 -7.551 4.935 1.00 63.23 H new ATOM 1164 N ALA A 86 25.058 -9.194 6.583 1.00 41.25 N ATOM 1165 CA ALA A 86 23.667 -9.436 6.221 1.00 50.53 C ATOM 1166 C ALA A 86 22.729 -9.055 7.361 1.00 0.41 C ATOM 1167 O ALA A 86 21.519 -9.267 7.281 1.00 61.15 O ATOM 1168 CB ALA A 86 23.468 -10.894 5.836 1.00 54.14 C ATOM 0 H ALA A 86 25.551 -10.014 6.937 1.00 41.25 H new ATOM 0 HA ALA A 86 23.426 -8.809 5.363 1.00 50.53 H new ATOM 0 HB1 ALA A 86 22.425 -11.060 5.568 1.00 54.14 H new ATOM 0 HB2 ALA A 86 24.104 -11.136 4.985 1.00 54.14 H new ATOM 0 HB3 ALA A 86 23.732 -11.532 6.679 1.00 54.14 H new ATOM 1174 N VAL A 87 23.295 -8.491 8.424 1.00 60.03 N ATOM 1175 CA VAL A 87 22.509 -8.080 9.581 1.00 70.02 C ATOM 1176 C VAL A 87 22.421 -6.561 9.674 1.00 40.11 C ATOM 1177 O VAL A 87 21.392 -6.011 10.067 1.00 2.32 O ATOM 1178 CB VAL A 87 23.107 -8.630 10.889 1.00 11.24 C ATOM 1179 CG1 VAL A 87 24.461 -7.995 11.166 1.00 10.33 C ATOM 1180 CG2 VAL A 87 22.152 -8.396 12.050 1.00 30.44 C ATOM 0 H VAL A 87 24.295 -8.308 8.507 1.00 60.03 H new ATOM 0 HA VAL A 87 21.508 -8.491 9.447 1.00 70.02 H new ATOM 0 HB VAL A 87 23.253 -9.705 10.778 1.00 11.24 H new ATOM 0 HG11 VAL A 87 24.868 -8.396 12.094 1.00 10.33 H new ATOM 0 HG12 VAL A 87 25.142 -8.218 10.345 1.00 10.33 H new ATOM 0 HG13 VAL A 87 24.345 -6.915 11.258 1.00 10.33 H new ATOM 0 HG21 VAL A 87 22.590 -8.791 12.967 1.00 30.44 H new ATOM 0 HG22 VAL A 87 21.973 -7.327 12.164 1.00 30.44 H new ATOM 0 HG23 VAL A 87 21.207 -8.903 11.852 1.00 30.44 H new ATOM 1190 N PHE A 88 23.507 -5.887 9.309 1.00 71.40 N ATOM 1191 CA PHE A 88 23.553 -4.430 9.352 1.00 62.54 C ATOM 1192 C PHE A 88 23.610 -3.847 7.943 1.00 41.31 C ATOM 1193 O PHE A 88 23.072 -2.770 7.682 1.00 61.41 O ATOM 1194 CB PHE A 88 24.765 -3.961 10.160 1.00 53.03 C ATOM 1195 CG PHE A 88 24.886 -4.627 11.500 1.00 32.43 C ATOM 1196 CD1 PHE A 88 23.793 -4.711 12.348 1.00 4.25 C ATOM 1197 CD2 PHE A 88 26.092 -5.170 11.912 1.00 3.04 C ATOM 1198 CE1 PHE A 88 23.901 -5.324 13.583 1.00 44.33 C ATOM 1199 CE2 PHE A 88 26.206 -5.784 13.145 1.00 21.41 C ATOM 1200 CZ PHE A 88 25.110 -5.860 13.982 1.00 73.32 C ATOM 0 H PHE A 88 24.367 -6.327 8.980 1.00 71.40 H new ATOM 0 HA PHE A 88 22.643 -4.076 9.837 1.00 62.54 H new ATOM 0 HB2 PHE A 88 25.671 -4.152 9.585 1.00 53.03 H new ATOM 0 HB3 PHE A 88 24.700 -2.882 10.304 1.00 53.03 H new ATOM 0 HD1 PHE A 88 22.846 -4.293 12.041 1.00 4.25 H new ATOM 0 HD2 PHE A 88 26.953 -5.113 11.262 1.00 3.04 H new ATOM 0 HE1 PHE A 88 23.042 -5.384 14.234 1.00 44.33 H new ATOM 0 HE2 PHE A 88 27.152 -6.204 13.454 1.00 21.41 H new ATOM 0 HZ PHE A 88 25.198 -6.338 14.947 1.00 73.32 H new ATOM 1210 N LYS A 89 24.267 -4.564 7.038 1.00 74.43 N ATOM 1211 CA LYS A 89 24.395 -4.120 5.655 1.00 72.32 C ATOM 1212 C LYS A 89 23.601 -5.025 4.717 1.00 1.52 C ATOM 1213 O LYS A 89 24.151 -5.893 4.040 1.00 24.34 O ATOM 1214 CB LYS A 89 25.867 -4.102 5.238 1.00 62.22 C ATOM 1215 CG LYS A 89 26.724 -3.165 6.071 1.00 52.40 C ATOM 1216 CD LYS A 89 27.329 -3.878 7.268 1.00 20.12 C ATOM 1217 CE LYS A 89 27.594 -2.915 8.415 1.00 23.34 C ATOM 1218 NZ LYS A 89 28.898 -2.212 8.259 1.00 32.33 N ATOM 0 H LYS A 89 24.720 -5.456 7.238 1.00 74.43 H new ATOM 0 HA LYS A 89 23.991 -3.110 5.585 1.00 72.32 H new ATOM 0 HB2 LYS A 89 26.270 -5.112 5.313 1.00 62.22 H new ATOM 0 HB3 LYS A 89 25.936 -3.809 4.190 1.00 62.22 H new ATOM 0 HG2 LYS A 89 27.520 -2.752 5.452 1.00 52.40 H new ATOM 0 HG3 LYS A 89 26.119 -2.326 6.414 1.00 52.40 H new ATOM 0 HD2 LYS A 89 26.655 -4.667 7.602 1.00 20.12 H new ATOM 0 HD3 LYS A 89 28.261 -4.360 6.973 1.00 20.12 H new ATOM 0 HE2 LYS A 89 26.790 -2.181 8.466 1.00 23.34 H new ATOM 0 HE3 LYS A 89 27.587 -3.462 9.358 1.00 23.34 H new ATOM 0 HZ1 LYS A 89 29.042 -1.565 9.060 1.00 32.33 H new ATOM 0 HZ2 LYS A 89 29.668 -2.910 8.235 1.00 32.33 H new ATOM 0 HZ3 LYS A 89 28.896 -1.669 7.372 1.00 32.33 H new ATOM 1232 N PRO A 90 22.277 -4.817 4.674 1.00 53.44 N ATOM 1233 CA PRO A 90 21.380 -5.602 3.821 1.00 53.13 C ATOM 1234 C PRO A 90 21.575 -5.298 2.339 1.00 20.12 C ATOM 1235 O PRO A 90 21.957 -4.188 1.967 1.00 24.43 O ATOM 1236 CB PRO A 90 19.985 -5.166 4.277 1.00 70.24 C ATOM 1237 CG PRO A 90 20.180 -3.801 4.840 1.00 0.01 C ATOM 1238 CD PRO A 90 21.553 -3.798 5.453 1.00 20.33 C ATOM 0 HA PRO A 90 21.560 -6.673 3.917 1.00 53.13 H new ATOM 0 HB2 PRO A 90 19.282 -5.154 3.444 1.00 70.24 H new ATOM 0 HB3 PRO A 90 19.582 -5.849 5.025 1.00 70.24 H new ATOM 0 HG2 PRO A 90 20.099 -3.043 4.061 1.00 0.01 H new ATOM 0 HG3 PRO A 90 19.419 -3.574 5.587 1.00 0.01 H new ATOM 0 HD2 PRO A 90 22.027 -2.820 5.373 1.00 20.33 H new ATOM 0 HD3 PRO A 90 21.520 -4.051 6.513 1.00 20.33 H new ATOM 1246 N LYS A 91 21.310 -6.291 1.497 1.00 52.55 N ATOM 1247 CA LYS A 91 21.454 -6.130 0.055 1.00 43.34 C ATOM 1248 C LYS A 91 20.203 -5.502 -0.551 1.00 72.52 C ATOM 1249 O LYS A 91 19.183 -6.171 -0.726 1.00 3.34 O ATOM 1250 CB LYS A 91 21.730 -7.483 -0.605 1.00 51.21 C ATOM 1251 CG LYS A 91 21.926 -7.398 -2.109 1.00 15.20 C ATOM 1252 CD LYS A 91 22.794 -8.533 -2.623 1.00 62.34 C ATOM 1253 CE LYS A 91 22.380 -8.962 -4.023 1.00 1.02 C ATOM 1254 NZ LYS A 91 23.154 -10.144 -4.493 1.00 20.35 N ATOM 0 H LYS A 91 20.994 -7.216 1.788 1.00 52.55 H new ATOM 0 HA LYS A 91 22.298 -5.464 -0.128 1.00 43.34 H new ATOM 0 HB2 LYS A 91 22.621 -7.922 -0.155 1.00 51.21 H new ATOM 0 HB3 LYS A 91 20.900 -8.157 -0.393 1.00 51.21 H new ATOM 0 HG2 LYS A 91 20.956 -7.427 -2.605 1.00 15.20 H new ATOM 0 HG3 LYS A 91 22.386 -6.443 -2.363 1.00 15.20 H new ATOM 0 HD2 LYS A 91 23.838 -8.219 -2.631 1.00 62.34 H new ATOM 0 HD3 LYS A 91 22.722 -9.383 -1.945 1.00 62.34 H new ATOM 0 HE2 LYS A 91 21.316 -9.198 -4.031 1.00 1.02 H new ATOM 0 HE3 LYS A 91 22.527 -8.133 -4.715 1.00 1.02 H new ATOM 0 HZ1 LYS A 91 22.842 -10.405 -5.450 1.00 20.35 H new ATOM 0 HZ2 LYS A 91 24.167 -9.911 -4.510 1.00 20.35 H new ATOM 0 HZ3 LYS A 91 22.994 -10.943 -3.847 1.00 20.35 H new ATOM 1268 N CYS A 92 20.287 -4.216 -0.871 1.00 42.44 N ATOM 1269 CA CYS A 92 19.162 -3.498 -1.459 1.00 4.12 C ATOM 1270 C CYS A 92 19.322 -3.382 -2.972 1.00 14.20 C ATOM 1271 O CYS A 92 20.415 -3.120 -3.472 1.00 51.22 O ATOM 1272 CB CYS A 92 19.040 -2.104 -0.839 1.00 61.34 C ATOM 1273 SG CYS A 92 18.051 -0.936 -1.827 1.00 2.20 S ATOM 0 H CYS A 92 21.123 -3.648 -0.733 1.00 42.44 H new ATOM 0 HA CYS A 92 18.253 -4.062 -1.250 1.00 4.12 H new ATOM 0 HB2 CYS A 92 18.593 -2.196 0.151 1.00 61.34 H new ATOM 0 HB3 CYS A 92 20.039 -1.691 -0.700 1.00 61.34 H new ATOM 1278 N GLU A 93 18.223 -3.579 -3.694 1.00 51.40 N ATOM 1279 CA GLU A 93 18.241 -3.496 -5.150 1.00 24.43 C ATOM 1280 C GLU A 93 16.856 -3.160 -5.693 1.00 53.13 C ATOM 1281 O GLU A 93 15.845 -3.364 -5.020 1.00 4.11 O ATOM 1282 CB GLU A 93 18.731 -4.816 -5.751 1.00 55.30 C ATOM 1283 CG GLU A 93 20.239 -4.987 -5.696 1.00 63.13 C ATOM 1284 CD GLU A 93 20.982 -3.813 -6.303 1.00 3.31 C ATOM 1285 OE1 GLU A 93 20.446 -3.193 -7.245 1.00 31.11 O ATOM 1286 OE2 GLU A 93 22.101 -3.513 -5.835 1.00 33.34 O ATOM 0 H GLU A 93 17.310 -3.797 -3.295 1.00 51.40 H new ATOM 0 HA GLU A 93 18.927 -2.698 -5.435 1.00 24.43 H new ATOM 0 HB2 GLU A 93 18.260 -5.644 -5.221 1.00 55.30 H new ATOM 0 HB3 GLU A 93 18.405 -4.876 -6.789 1.00 55.30 H new ATOM 0 HG2 GLU A 93 20.549 -5.111 -4.658 1.00 63.13 H new ATOM 0 HG3 GLU A 93 20.517 -5.900 -6.223 1.00 63.13 H new ATOM 1293 N LYS A 94 16.816 -2.642 -6.916 1.00 63.34 N ATOM 1294 CA LYS A 94 15.556 -2.277 -7.553 1.00 23.20 C ATOM 1295 C LYS A 94 15.101 -3.364 -8.521 1.00 73.31 C ATOM 1296 O LYS A 94 15.732 -3.593 -9.554 1.00 13.15 O ATOM 1297 CB LYS A 94 15.703 -0.947 -8.295 1.00 71.14 C ATOM 1298 CG LYS A 94 14.983 0.208 -7.621 1.00 41.24 C ATOM 1299 CD LYS A 94 15.013 1.461 -8.480 1.00 41.25 C ATOM 1300 CE LYS A 94 16.438 1.926 -8.739 1.00 2.15 C ATOM 1301 NZ LYS A 94 16.483 3.331 -9.231 1.00 32.21 N ATOM 0 H LYS A 94 17.643 -2.465 -7.487 1.00 63.34 H new ATOM 0 HA LYS A 94 14.801 -2.170 -6.774 1.00 23.20 H new ATOM 0 HB2 LYS A 94 16.762 -0.704 -8.381 1.00 71.14 H new ATOM 0 HB3 LYS A 94 15.319 -1.062 -9.309 1.00 71.14 H new ATOM 0 HG2 LYS A 94 13.949 -0.073 -7.422 1.00 41.24 H new ATOM 0 HG3 LYS A 94 15.448 0.415 -6.657 1.00 41.24 H new ATOM 0 HD2 LYS A 94 14.515 1.264 -9.430 1.00 41.25 H new ATOM 0 HD3 LYS A 94 14.454 2.256 -7.986 1.00 41.25 H new ATOM 0 HE2 LYS A 94 17.019 1.844 -7.820 1.00 2.15 H new ATOM 0 HE3 LYS A 94 16.907 1.269 -9.472 1.00 2.15 H new ATOM 0 HZ1 LYS A 94 17.471 3.610 -9.395 1.00 32.21 H new ATOM 0 HZ2 LYS A 94 15.950 3.404 -10.121 1.00 32.21 H new ATOM 0 HZ3 LYS A 94 16.059 3.961 -8.521 1.00 32.21 H new ATOM 1315 N ILE A 95 14.002 -4.030 -8.182 1.00 0.13 N ATOM 1316 CA ILE A 95 13.462 -5.091 -9.023 1.00 14.33 C ATOM 1317 C ILE A 95 12.378 -4.556 -9.953 1.00 63.24 C ATOM 1318 O ILE A 95 11.300 -4.166 -9.508 1.00 21.03 O ATOM 1319 CB ILE A 95 12.876 -6.237 -8.177 1.00 2.23 C ATOM 1320 CG1 ILE A 95 13.978 -6.907 -7.354 1.00 4.22 C ATOM 1321 CG2 ILE A 95 12.182 -7.254 -9.071 1.00 4.25 C ATOM 1322 CD1 ILE A 95 14.270 -6.203 -6.047 1.00 52.42 C ATOM 0 H ILE A 95 13.468 -3.853 -7.331 1.00 0.13 H new ATOM 0 HA ILE A 95 14.291 -5.476 -9.617 1.00 14.33 H new ATOM 0 HB ILE A 95 12.138 -5.822 -7.491 1.00 2.23 H new ATOM 0 HG12 ILE A 95 13.689 -7.937 -7.146 1.00 4.22 H new ATOM 0 HG13 ILE A 95 14.891 -6.946 -7.948 1.00 4.22 H new ATOM 0 HG21 ILE A 95 11.773 -8.058 -8.459 1.00 4.25 H new ATOM 0 HG22 ILE A 95 11.374 -6.767 -9.617 1.00 4.25 H new ATOM 0 HG23 ILE A 95 12.901 -7.667 -9.779 1.00 4.25 H new ATOM 0 HD11 ILE A 95 15.061 -6.733 -5.517 1.00 52.42 H new ATOM 0 HD12 ILE A 95 14.590 -5.181 -6.248 1.00 52.42 H new ATOM 0 HD13 ILE A 95 13.369 -6.187 -5.433 1.00 52.42 H new ATOM 1334 N ASN A 96 12.673 -4.543 -11.249 1.00 72.44 N ATOM 1335 CA ASN A 96 11.723 -4.058 -12.244 1.00 61.12 C ATOM 1336 C ASN A 96 11.420 -2.578 -12.031 1.00 23.15 C ATOM 1337 O ASN A 96 10.400 -2.069 -12.493 1.00 63.34 O ATOM 1338 CB ASN A 96 10.428 -4.870 -12.181 1.00 55.54 C ATOM 1339 CG ASN A 96 9.552 -4.655 -13.401 1.00 34.53 C ATOM 1340 OD1 ASN A 96 9.838 -5.169 -14.482 1.00 72.13 O ATOM 1341 ND2 ASN A 96 8.477 -3.893 -13.231 1.00 24.42 N ATOM 0 H ASN A 96 13.562 -4.862 -11.635 1.00 72.44 H new ATOM 0 HA ASN A 96 12.173 -4.180 -13.229 1.00 61.12 H new ATOM 0 HB2 ASN A 96 10.670 -5.929 -12.093 1.00 55.54 H new ATOM 0 HB3 ASN A 96 9.872 -4.594 -11.285 1.00 55.54 H new ATOM 0 HD21 ASN A 96 7.850 -3.714 -14.015 1.00 24.42 H new ATOM 0 HD22 ASN A 96 8.279 -3.487 -12.316 1.00 24.42 H new ATOM 1348 N GLY A 97 12.315 -1.892 -11.326 1.00 22.01 N ATOM 1349 CA GLY A 97 12.126 -0.477 -11.064 1.00 21.35 C ATOM 1350 C GLY A 97 11.479 -0.219 -9.717 1.00 51.35 C ATOM 1351 O GLY A 97 10.914 0.850 -9.489 1.00 2.41 O ATOM 0 H GLY A 97 13.167 -2.291 -10.932 1.00 22.01 H new ATOM 0 HA2 GLY A 97 13.091 0.029 -11.103 1.00 21.35 H new ATOM 0 HA3 GLY A 97 11.507 -0.044 -11.850 1.00 21.35 H new ATOM 1355 N GLU A 98 11.560 -1.201 -8.825 1.00 55.12 N ATOM 1356 CA GLU A 98 10.974 -1.074 -7.496 1.00 20.23 C ATOM 1357 C GLU A 98 12.031 -1.276 -6.414 1.00 45.41 C ATOM 1358 O GLU A 98 12.591 -2.363 -6.273 1.00 62.10 O ATOM 1359 CB GLU A 98 9.843 -2.088 -7.314 1.00 31.44 C ATOM 1360 CG GLU A 98 8.742 -1.965 -8.353 1.00 74.02 C ATOM 1361 CD GLU A 98 7.676 -3.033 -8.203 1.00 74.04 C ATOM 1362 OE1 GLU A 98 7.814 -3.886 -7.301 1.00 51.14 O ATOM 1363 OE2 GLU A 98 6.704 -3.016 -8.987 1.00 70.54 O ATOM 0 H GLU A 98 12.025 -2.092 -8.998 1.00 55.12 H new ATOM 0 HA GLU A 98 10.568 -0.067 -7.401 1.00 20.23 H new ATOM 0 HB2 GLU A 98 10.259 -3.095 -7.355 1.00 31.44 H new ATOM 0 HB3 GLU A 98 9.410 -1.962 -6.322 1.00 31.44 H new ATOM 0 HG2 GLU A 98 8.279 -0.981 -8.272 1.00 74.02 H new ATOM 0 HG3 GLU A 98 9.179 -2.031 -9.349 1.00 74.02 H new ATOM 1370 N ASP A 99 12.300 -0.220 -5.654 1.00 12.12 N ATOM 1371 CA ASP A 99 13.289 -0.280 -4.584 1.00 44.43 C ATOM 1372 C ASP A 99 12.872 -1.283 -3.513 1.00 43.34 C ATOM 1373 O ASP A 99 12.041 -0.981 -2.657 1.00 65.50 O ATOM 1374 CB ASP A 99 13.480 1.103 -3.959 1.00 50.10 C ATOM 1375 CG ASP A 99 13.986 2.125 -4.958 1.00 2.34 C ATOM 1376 OD1 ASP A 99 13.180 2.591 -5.791 1.00 3.24 O ATOM 1377 OD2 ASP A 99 15.188 2.460 -4.906 1.00 11.23 O ATOM 0 H ASP A 99 11.847 0.688 -5.759 1.00 12.12 H new ATOM 0 HA ASP A 99 14.234 -0.609 -5.015 1.00 44.43 H new ATOM 0 HB2 ASP A 99 12.532 1.444 -3.543 1.00 50.10 H new ATOM 0 HB3 ASP A 99 14.184 1.030 -3.130 1.00 50.10 H new ATOM 1382 N MET A 100 13.454 -2.476 -3.569 1.00 70.42 N ATOM 1383 CA MET A 100 13.142 -3.524 -2.604 1.00 3.24 C ATOM 1384 C MET A 100 14.377 -3.896 -1.788 1.00 75.43 C ATOM 1385 O MET A 100 15.504 -3.589 -2.175 1.00 2.23 O ATOM 1386 CB MET A 100 12.597 -4.761 -3.319 1.00 70.13 C ATOM 1387 CG MET A 100 11.585 -4.438 -4.406 1.00 55.41 C ATOM 1388 SD MET A 100 10.148 -5.526 -4.363 1.00 71.43 S ATOM 1389 CE MET A 100 10.797 -6.976 -5.191 1.00 51.13 C ATOM 0 H MET A 100 14.144 -2.741 -4.272 1.00 70.42 H new ATOM 0 HA MET A 100 12.380 -3.142 -1.924 1.00 3.24 H new ATOM 0 HB2 MET A 100 13.428 -5.311 -3.760 1.00 70.13 H new ATOM 0 HB3 MET A 100 12.132 -5.419 -2.585 1.00 70.13 H new ATOM 0 HG2 MET A 100 11.257 -3.404 -4.296 1.00 55.41 H new ATOM 0 HG3 MET A 100 12.067 -4.517 -5.381 1.00 55.41 H new ATOM 0 HE1 MET A 100 10.252 -7.859 -4.859 1.00 51.13 H new ATOM 0 HE2 MET A 100 10.681 -6.862 -6.269 1.00 51.13 H new ATOM 0 HE3 MET A 100 11.854 -7.090 -4.950 1.00 51.13 H new ATOM 1399 N VAL A 101 14.156 -4.560 -0.658 1.00 74.30 N ATOM 1400 CA VAL A 101 15.250 -4.975 0.211 1.00 30.33 C ATOM 1401 C VAL A 101 15.308 -6.494 0.335 1.00 40.31 C ATOM 1402 O VAL A 101 14.338 -7.189 0.033 1.00 31.21 O ATOM 1403 CB VAL A 101 15.114 -4.362 1.617 1.00 14.44 C ATOM 1404 CG1 VAL A 101 14.941 -2.853 1.527 1.00 33.13 C ATOM 1405 CG2 VAL A 101 13.950 -4.996 2.365 1.00 64.13 C ATOM 0 H VAL A 101 13.229 -4.822 -0.323 1.00 74.30 H new ATOM 0 HA VAL A 101 16.171 -4.615 -0.247 1.00 30.33 H new ATOM 0 HB VAL A 101 16.029 -4.567 2.173 1.00 14.44 H new ATOM 0 HG11 VAL A 101 14.846 -2.437 2.530 1.00 33.13 H new ATOM 0 HG12 VAL A 101 15.809 -2.416 1.033 1.00 33.13 H new ATOM 0 HG13 VAL A 101 14.043 -2.623 0.953 1.00 33.13 H new ATOM 0 HG21 VAL A 101 13.869 -4.551 3.357 1.00 64.13 H new ATOM 0 HG22 VAL A 101 13.026 -4.824 1.813 1.00 64.13 H new ATOM 0 HG23 VAL A 101 14.120 -6.068 2.462 1.00 64.13 H new ATOM 1415 N TYR A 102 16.451 -7.002 0.781 1.00 43.00 N ATOM 1416 CA TYR A 102 16.637 -8.439 0.943 1.00 22.01 C ATOM 1417 C TYR A 102 16.841 -8.800 2.411 1.00 2.24 C ATOM 1418 O TYR A 102 17.532 -8.093 3.147 1.00 52.03 O ATOM 1419 CB TYR A 102 17.834 -8.916 0.118 1.00 12.03 C ATOM 1420 CG TYR A 102 17.503 -9.176 -1.334 1.00 42.31 C ATOM 1421 CD1 TYR A 102 16.424 -9.975 -1.689 1.00 70.33 C ATOM 1422 CD2 TYR A 102 18.270 -8.620 -2.351 1.00 72.44 C ATOM 1423 CE1 TYR A 102 16.119 -10.216 -3.015 1.00 11.21 C ATOM 1424 CE2 TYR A 102 17.971 -8.854 -3.680 1.00 22.32 C ATOM 1425 CZ TYR A 102 16.895 -9.653 -4.006 1.00 62.04 C ATOM 1426 OH TYR A 102 16.594 -9.889 -5.328 1.00 73.12 O ATOM 0 H TYR A 102 17.263 -6.440 1.037 1.00 43.00 H new ATOM 0 HA TYR A 102 15.736 -8.938 0.587 1.00 22.01 H new ATOM 0 HB2 TYR A 102 18.624 -8.167 0.173 1.00 12.03 H new ATOM 0 HB3 TYR A 102 18.229 -9.830 0.561 1.00 12.03 H new ATOM 0 HD1 TYR A 102 15.813 -10.416 -0.915 1.00 70.33 H new ATOM 0 HD2 TYR A 102 19.114 -7.995 -2.099 1.00 72.44 H new ATOM 0 HE1 TYR A 102 15.278 -10.842 -3.274 1.00 11.21 H new ATOM 0 HE2 TYR A 102 18.576 -8.414 -4.459 1.00 22.32 H new ATOM 0 HH TYR A 102 17.237 -9.419 -5.899 1.00 73.12 H new ATOM 1436 N LEU A 103 16.236 -9.905 2.832 1.00 72.14 N ATOM 1437 CA LEU A 103 16.350 -10.362 4.212 1.00 23.41 C ATOM 1438 C LEU A 103 17.264 -11.580 4.308 1.00 1.04 C ATOM 1439 O LEU A 103 17.466 -12.314 3.340 1.00 12.54 O ATOM 1440 CB LEU A 103 14.969 -10.702 4.774 1.00 54.11 C ATOM 1441 CG LEU A 103 14.025 -9.519 4.996 1.00 24.12 C ATOM 1442 CD1 LEU A 103 12.793 -9.645 4.114 1.00 65.55 C ATOM 1443 CD2 LEU A 103 13.626 -9.423 6.462 1.00 62.34 C ATOM 0 H LEU A 103 15.661 -10.501 2.237 1.00 72.14 H new ATOM 0 HA LEU A 103 16.786 -9.555 4.801 1.00 23.41 H new ATOM 0 HB2 LEU A 103 14.485 -11.405 4.095 1.00 54.11 H new ATOM 0 HB3 LEU A 103 15.103 -11.218 5.725 1.00 54.11 H new ATOM 0 HG LEU A 103 14.550 -8.604 4.722 1.00 24.12 H new ATOM 0 HD11 LEU A 103 12.134 -8.794 4.286 1.00 65.55 H new ATOM 0 HD12 LEU A 103 13.095 -9.664 3.067 1.00 65.55 H new ATOM 0 HD13 LEU A 103 12.265 -10.568 4.356 1.00 65.55 H new ATOM 0 HD21 LEU A 103 12.954 -8.576 6.602 1.00 62.34 H new ATOM 0 HD22 LEU A 103 13.120 -10.341 6.762 1.00 62.34 H new ATOM 0 HD23 LEU A 103 14.518 -9.284 7.073 1.00 62.34 H new ATOM 1455 N PRO A 104 17.829 -11.803 5.504 1.00 3.12 N ATOM 1456 CA PRO A 104 18.729 -12.933 5.756 1.00 13.34 C ATOM 1457 C PRO A 104 17.997 -14.270 5.744 1.00 72.35 C ATOM 1458 O PRO A 104 16.945 -14.419 6.365 1.00 30.25 O ATOM 1459 CB PRO A 104 19.283 -12.640 7.153 1.00 40.11 C ATOM 1460 CG PRO A 104 18.244 -11.792 7.803 1.00 64.33 C ATOM 1461 CD PRO A 104 17.633 -10.969 6.702 1.00 25.43 C ATOM 0 HA PRO A 104 19.497 -13.022 4.988 1.00 13.34 H new ATOM 0 HB2 PRO A 104 19.450 -13.560 7.713 1.00 40.11 H new ATOM 0 HB3 PRO A 104 20.240 -12.121 7.098 1.00 40.11 H new ATOM 0 HG2 PRO A 104 17.490 -12.407 8.295 1.00 64.33 H new ATOM 0 HG3 PRO A 104 18.684 -11.154 8.569 1.00 64.33 H new ATOM 0 HD2 PRO A 104 16.577 -10.772 6.886 1.00 25.43 H new ATOM 0 HD3 PRO A 104 18.125 -10.001 6.603 1.00 25.43 H new ATOM 1469 N SER A 105 18.560 -15.241 5.032 1.00 61.14 N ATOM 1470 CA SER A 105 17.959 -16.566 4.935 1.00 32.13 C ATOM 1471 C SER A 105 18.243 -17.384 6.191 1.00 20.23 C ATOM 1472 O SER A 105 19.073 -17.005 7.018 1.00 15.13 O ATOM 1473 CB SER A 105 18.489 -17.302 3.703 1.00 11.40 C ATOM 1474 OG SER A 105 17.880 -16.817 2.519 1.00 74.52 O ATOM 0 H SER A 105 19.432 -15.135 4.514 1.00 61.14 H new ATOM 0 HA SER A 105 16.880 -16.442 4.839 1.00 32.13 H new ATOM 0 HB2 SER A 105 19.570 -17.177 3.638 1.00 11.40 H new ATOM 0 HB3 SER A 105 18.297 -18.370 3.803 1.00 11.40 H new ATOM 0 HG SER A 105 18.236 -17.302 1.746 1.00 74.52 H new ATOM 1480 N TYR A 106 17.549 -18.508 6.327 1.00 73.52 N ATOM 1481 CA TYR A 106 17.723 -19.380 7.482 1.00 24.15 C ATOM 1482 C TYR A 106 19.193 -19.741 7.675 1.00 21.50 C ATOM 1483 O TYR A 106 19.658 -19.916 8.801 1.00 12.50 O ATOM 1484 CB TYR A 106 16.891 -20.653 7.318 1.00 1.12 C ATOM 1485 CG TYR A 106 17.468 -21.629 6.317 1.00 10.35 C ATOM 1486 CD1 TYR A 106 17.459 -21.346 4.957 1.00 30.22 C ATOM 1487 CD2 TYR A 106 18.023 -22.833 6.733 1.00 50.02 C ATOM 1488 CE1 TYR A 106 17.984 -22.235 4.040 1.00 62.24 C ATOM 1489 CE2 TYR A 106 18.552 -23.727 5.822 1.00 31.33 C ATOM 1490 CZ TYR A 106 18.530 -23.424 4.477 1.00 73.20 C ATOM 1491 OH TYR A 106 19.055 -24.312 3.566 1.00 2.21 O ATOM 0 H TYR A 106 16.860 -18.837 5.651 1.00 73.52 H new ATOM 0 HA TYR A 106 17.380 -18.842 8.366 1.00 24.15 H new ATOM 0 HB2 TYR A 106 16.804 -21.147 8.286 1.00 1.12 H new ATOM 0 HB3 TYR A 106 15.882 -20.380 7.007 1.00 1.12 H new ATOM 0 HD1 TYR A 106 17.034 -20.415 4.611 1.00 30.22 H new ATOM 0 HD2 TYR A 106 18.041 -23.074 7.786 1.00 50.02 H new ATOM 0 HE1 TYR A 106 17.967 -22.001 2.986 1.00 62.24 H new ATOM 0 HE2 TYR A 106 18.981 -24.658 6.162 1.00 31.33 H new ATOM 0 HH TYR A 106 19.400 -25.099 4.038 1.00 2.21 H new ATOM 1501 N GLU A 107 19.919 -19.852 6.567 1.00 52.33 N ATOM 1502 CA GLU A 107 21.336 -20.192 6.613 1.00 71.30 C ATOM 1503 C GLU A 107 22.125 -19.134 7.378 1.00 22.14 C ATOM 1504 O GLU A 107 22.798 -19.438 8.363 1.00 60.11 O ATOM 1505 CB GLU A 107 21.895 -20.336 5.196 1.00 43.20 C ATOM 1506 CG GLU A 107 21.864 -21.761 4.671 1.00 63.31 C ATOM 1507 CD GLU A 107 23.215 -22.224 4.160 1.00 30.31 C ATOM 1508 OE1 GLU A 107 23.784 -21.539 3.285 1.00 61.03 O ATOM 1509 OE2 GLU A 107 23.702 -23.271 4.635 1.00 25.11 O ATOM 0 H GLU A 107 19.549 -19.711 5.627 1.00 52.33 H new ATOM 0 HA GLU A 107 21.438 -21.144 7.134 1.00 71.30 H new ATOM 0 HB2 GLU A 107 21.324 -19.697 4.523 1.00 43.20 H new ATOM 0 HB3 GLU A 107 22.923 -19.975 5.182 1.00 43.20 H new ATOM 0 HG2 GLU A 107 21.531 -22.430 5.465 1.00 63.31 H new ATOM 0 HG3 GLU A 107 21.132 -21.832 3.867 1.00 63.31 H new ATOM 1516 N MET A 108 22.037 -17.891 6.918 1.00 44.44 N ATOM 1517 CA MET A 108 22.743 -16.787 7.559 1.00 55.11 C ATOM 1518 C MET A 108 22.410 -16.720 9.046 1.00 21.31 C ATOM 1519 O MET A 108 23.291 -16.510 9.881 1.00 72.13 O ATOM 1520 CB MET A 108 22.382 -15.462 6.884 1.00 72.21 C ATOM 1521 CG MET A 108 22.920 -15.335 5.468 1.00 22.20 C ATOM 1522 SD MET A 108 24.721 -15.275 5.413 1.00 44.42 S ATOM 1523 CE MET A 108 24.989 -13.565 4.949 1.00 74.54 C ATOM 0 H MET A 108 21.484 -17.622 6.104 1.00 44.44 H new ATOM 0 HA MET A 108 23.814 -16.962 7.451 1.00 55.11 H new ATOM 0 HB2 MET A 108 21.297 -15.358 6.862 1.00 72.21 H new ATOM 0 HB3 MET A 108 22.769 -14.640 7.486 1.00 72.21 H new ATOM 0 HG2 MET A 108 22.570 -16.179 4.873 1.00 22.20 H new ATOM 0 HG3 MET A 108 22.516 -14.432 5.009 1.00 22.20 H new ATOM 0 HE1 MET A 108 25.819 -13.505 4.245 1.00 74.54 H new ATOM 0 HE2 MET A 108 24.087 -13.169 4.481 1.00 74.54 H new ATOM 0 HE3 MET A 108 25.224 -12.979 5.838 1.00 74.54 H new ATOM 1533 N CYS A 109 21.134 -16.900 9.371 1.00 23.13 N ATOM 1534 CA CYS A 109 20.685 -16.860 10.758 1.00 51.34 C ATOM 1535 C CYS A 109 21.111 -18.120 11.504 1.00 21.45 C ATOM 1536 O CYS A 109 21.221 -18.121 12.731 1.00 52.53 O ATOM 1537 CB CYS A 109 19.164 -16.707 10.818 1.00 32.43 C ATOM 1538 SG CYS A 109 18.567 -15.778 12.267 1.00 71.01 S ATOM 0 H CYS A 109 20.393 -17.075 8.693 1.00 23.13 H new ATOM 0 HA CYS A 109 21.149 -16.000 11.240 1.00 51.34 H new ATOM 0 HB2 CYS A 109 18.824 -16.205 9.912 1.00 32.43 H new ATOM 0 HB3 CYS A 109 18.710 -17.698 10.823 1.00 32.43 H new ATOM 1543 N ARG A 110 21.350 -19.192 10.756 1.00 21.42 N ATOM 1544 CA ARG A 110 21.763 -20.460 11.347 1.00 42.31 C ATOM 1545 C ARG A 110 23.208 -20.387 11.833 1.00 33.53 C ATOM 1546 O ARG A 110 23.566 -21.002 12.838 1.00 31.43 O ATOM 1547 CB ARG A 110 21.612 -21.594 10.331 1.00 10.51 C ATOM 1548 CG ARG A 110 20.303 -22.356 10.459 1.00 1.45 C ATOM 1549 CD ARG A 110 20.542 -23.827 10.759 1.00 24.13 C ATOM 1550 NE ARG A 110 19.541 -24.684 10.129 1.00 4.13 N ATOM 1551 CZ ARG A 110 19.598 -25.068 8.859 1.00 74.10 C ATOM 1552 NH1 ARG A 110 20.601 -24.674 8.088 1.00 64.25 N ATOM 1553 NH2 ARG A 110 18.649 -25.849 8.358 1.00 14.40 N ATOM 0 H ARG A 110 21.265 -19.208 9.740 1.00 21.42 H new ATOM 0 HA ARG A 110 21.119 -20.661 12.203 1.00 42.31 H new ATOM 0 HB2 ARG A 110 21.685 -21.181 9.325 1.00 10.51 H new ATOM 0 HB3 ARG A 110 22.442 -22.291 10.451 1.00 10.51 H new ATOM 0 HG2 ARG A 110 19.700 -21.915 11.253 1.00 1.45 H new ATOM 0 HG3 ARG A 110 19.733 -22.260 9.535 1.00 1.45 H new ATOM 0 HD2 ARG A 110 21.534 -24.112 10.410 1.00 24.13 H new ATOM 0 HD3 ARG A 110 20.527 -23.984 11.838 1.00 24.13 H new ATOM 0 HE ARG A 110 18.756 -25.005 10.695 1.00 4.13 H new ATOM 0 HH11 ARG A 110 21.332 -24.074 8.470 1.00 64.25 H new ATOM 0 HH12 ARG A 110 20.642 -24.971 7.113 1.00 64.25 H new ATOM 0 HH21 ARG A 110 17.875 -26.155 8.948 1.00 14.40 H new ATOM 0 HH22 ARG A 110 18.693 -26.144 7.382 1.00 14.40 H new ATOM 1567 N ILE A 111 24.032 -19.634 11.114 1.00 52.53 N ATOM 1568 CA ILE A 111 25.436 -19.481 11.472 1.00 3.05 C ATOM 1569 C ILE A 111 25.586 -18.959 12.897 1.00 22.25 C ATOM 1570 O ILE A 111 26.628 -19.136 13.530 1.00 61.33 O ATOM 1571 CB ILE A 111 26.163 -18.525 10.509 1.00 50.45 C ATOM 1572 CG1 ILE A 111 25.834 -18.881 9.057 1.00 24.44 C ATOM 1573 CG2 ILE A 111 27.665 -18.575 10.745 1.00 40.41 C ATOM 1574 CD1 ILE A 111 26.004 -20.351 8.743 1.00 35.44 C ATOM 0 H ILE A 111 23.751 -19.120 10.279 1.00 52.53 H new ATOM 0 HA ILE A 111 25.889 -20.470 11.399 1.00 3.05 H new ATOM 0 HB ILE A 111 25.819 -17.509 10.701 1.00 50.45 H new ATOM 0 HG12 ILE A 111 24.806 -18.588 8.843 1.00 24.44 H new ATOM 0 HG13 ILE A 111 26.475 -18.300 8.394 1.00 24.44 H new ATOM 0 HG21 ILE A 111 28.164 -17.894 10.056 1.00 40.41 H new ATOM 0 HG22 ILE A 111 27.882 -18.278 11.771 1.00 40.41 H new ATOM 0 HG23 ILE A 111 28.026 -19.590 10.577 1.00 40.41 H new ATOM 0 HD11 ILE A 111 25.754 -20.531 7.697 1.00 35.44 H new ATOM 0 HD12 ILE A 111 27.038 -20.645 8.925 1.00 35.44 H new ATOM 0 HD13 ILE A 111 25.343 -20.938 9.380 1.00 35.44 H new ATOM 1586 N THR A 112 24.537 -18.316 13.400 1.00 52.43 N ATOM 1587 CA THR A 112 24.551 -17.768 14.750 1.00 34.34 C ATOM 1588 C THR A 112 23.984 -18.766 15.754 1.00 74.13 C ATOM 1589 O THR A 112 24.466 -18.869 16.881 1.00 10.22 O ATOM 1590 CB THR A 112 23.744 -16.459 14.834 1.00 10.32 C ATOM 1591 OG1 THR A 112 22.345 -16.737 14.712 1.00 54.43 O ATOM 1592 CG2 THR A 112 24.171 -15.489 13.742 1.00 22.34 C ATOM 0 H THR A 112 23.666 -18.162 12.892 1.00 52.43 H new ATOM 0 HA THR A 112 25.592 -17.560 14.996 1.00 34.34 H new ATOM 0 HB THR A 112 23.939 -15.999 15.803 1.00 10.32 H new ATOM 0 HG1 THR A 112 22.150 -17.042 13.801 1.00 54.43 H new ATOM 0 HG21 THR A 112 23.587 -14.572 13.821 1.00 22.34 H new ATOM 0 HG22 THR A 112 25.230 -15.256 13.856 1.00 22.34 H new ATOM 0 HG23 THR A 112 24.002 -15.943 12.766 1.00 22.34 H new ATOM 1600 N MET A 113 22.957 -19.500 15.336 1.00 64.01 N ATOM 1601 CA MET A 113 22.326 -20.492 16.199 1.00 42.21 C ATOM 1602 C MET A 113 23.222 -21.715 16.368 1.00 42.35 C ATOM 1603 O MET A 113 23.187 -22.383 17.400 1.00 13.11 O ATOM 1604 CB MET A 113 20.973 -20.912 15.623 1.00 35.33 C ATOM 1605 CG MET A 113 21.067 -22.046 14.615 1.00 53.33 C ATOM 1606 SD MET A 113 19.454 -22.557 13.991 1.00 13.45 S ATOM 1607 CE MET A 113 18.773 -20.980 13.481 1.00 62.41 C ATOM 0 H MET A 113 22.545 -19.426 14.406 1.00 64.01 H new ATOM 0 HA MET A 113 22.171 -20.040 17.179 1.00 42.21 H new ATOM 0 HB2 MET A 113 20.318 -21.216 16.440 1.00 35.33 H new ATOM 0 HB3 MET A 113 20.507 -20.050 15.145 1.00 35.33 H new ATOM 0 HG2 MET A 113 21.693 -21.733 13.779 1.00 53.33 H new ATOM 0 HG3 MET A 113 21.560 -22.900 15.080 1.00 53.33 H new ATOM 0 HE1 MET A 113 18.205 -21.110 12.560 1.00 62.41 H new ATOM 0 HE2 MET A 113 18.116 -20.598 14.262 1.00 62.41 H new ATOM 0 HE3 MET A 113 19.584 -20.272 13.310 1.00 62.41 H new ATOM 1617 N GLU A 114 24.024 -22.001 15.346 1.00 33.13 N ATOM 1618 CA GLU A 114 24.928 -23.145 15.383 1.00 54.21 C ATOM 1619 C GLU A 114 25.552 -23.301 16.766 1.00 1.45 C ATOM 1620 O GLU A 114 25.359 -24.304 17.453 1.00 34.02 O ATOM 1621 CB GLU A 114 26.027 -22.988 14.330 1.00 74.31 C ATOM 1622 CG GLU A 114 25.890 -23.949 13.160 1.00 1.43 C ATOM 1623 CD GLU A 114 26.178 -25.386 13.549 1.00 52.21 C ATOM 1624 OE1 GLU A 114 25.242 -26.074 14.007 1.00 30.51 O ATOM 1625 OE2 GLU A 114 27.338 -25.822 13.395 1.00 13.22 O ATOM 0 H GLU A 114 24.066 -21.457 14.484 1.00 33.13 H new ATOM 0 HA GLU A 114 24.348 -24.041 15.162 1.00 54.21 H new ATOM 0 HB2 GLU A 114 26.014 -21.965 13.953 1.00 74.31 H new ATOM 0 HB3 GLU A 114 26.997 -23.141 14.803 1.00 74.31 H new ATOM 0 HG2 GLU A 114 24.880 -23.881 12.755 1.00 1.43 H new ATOM 0 HG3 GLU A 114 26.573 -23.648 12.365 1.00 1.43 H new ATOM 1632 N PRO A 115 26.320 -22.285 17.186 1.00 5.52 N ATOM 1633 CA PRO A 115 26.989 -22.284 18.491 1.00 64.34 C ATOM 1634 C PRO A 115 26.005 -22.146 19.647 1.00 60.31 C ATOM 1635 O PRO A 115 25.546 -23.142 20.207 1.00 72.20 O ATOM 1636 CB PRO A 115 27.905 -21.060 18.419 1.00 4.12 C ATOM 1637 CG PRO A 115 27.255 -20.158 17.428 1.00 43.22 C ATOM 1638 CD PRO A 115 26.595 -21.057 16.420 1.00 71.30 C ATOM 0 HA PRO A 115 27.518 -23.219 18.679 1.00 64.34 H new ATOM 0 HB2 PRO A 115 27.998 -20.578 19.392 1.00 4.12 H new ATOM 0 HB3 PRO A 115 28.911 -21.336 18.103 1.00 4.12 H new ATOM 0 HG2 PRO A 115 26.524 -19.510 17.911 1.00 43.22 H new ATOM 0 HG3 PRO A 115 27.989 -19.509 16.951 1.00 43.22 H new ATOM 0 HD2 PRO A 115 25.679 -20.615 16.026 1.00 71.30 H new ATOM 0 HD3 PRO A 115 27.247 -21.252 15.568 1.00 71.30 H new ATOM 1646 N CYS A 116 25.684 -20.906 20.000 1.00 61.11 N ATOM 1647 CA CYS A 116 24.754 -20.637 21.090 1.00 71.22 C ATOM 1648 C CYS A 116 23.389 -21.258 20.806 1.00 40.34 C ATOM 1649 O CYS A 116 22.562 -20.671 20.108 1.00 50.33 O ATOM 1650 CB CYS A 116 24.607 -19.129 21.302 1.00 75.20 C ATOM 1651 SG CYS A 116 26.183 -18.261 21.584 1.00 13.43 S ATOM 0 H CYS A 116 26.055 -20.071 19.547 1.00 61.11 H new ATOM 0 HA CYS A 116 25.156 -21.087 21.998 1.00 71.22 H new ATOM 0 HB2 CYS A 116 24.117 -18.696 20.430 1.00 75.20 H new ATOM 0 HB3 CYS A 116 23.951 -18.955 22.155 1.00 75.20 H new ATOM 1656 N ARG A 117 23.161 -22.448 21.351 1.00 1.24 N ATOM 1657 CA ARG A 117 21.898 -23.149 21.156 1.00 14.42 C ATOM 1658 C ARG A 117 20.788 -22.511 21.988 1.00 63.14 C ATOM 1659 O ARG A 117 19.604 -22.691 21.702 1.00 30.02 O ATOM 1660 CB ARG A 117 22.046 -24.625 21.530 1.00 54.33 C ATOM 1661 CG ARG A 117 20.721 -25.364 21.626 1.00 63.44 C ATOM 1662 CD ARG A 117 20.907 -26.864 21.456 1.00 62.04 C ATOM 1663 NE ARG A 117 20.257 -27.363 20.247 1.00 41.43 N ATOM 1664 CZ ARG A 117 20.134 -28.653 19.957 1.00 23.22 C ATOM 1665 NH1 ARG A 117 20.615 -29.570 20.786 1.00 75.45 N ATOM 1666 NH2 ARG A 117 19.530 -29.029 18.837 1.00 14.34 N ATOM 0 H ARG A 117 23.835 -22.947 21.931 1.00 1.24 H new ATOM 0 HA ARG A 117 21.628 -23.074 20.103 1.00 14.42 H new ATOM 0 HB2 ARG A 117 22.675 -25.118 20.788 1.00 54.33 H new ATOM 0 HB3 ARG A 117 22.564 -24.699 22.486 1.00 54.33 H new ATOM 0 HG2 ARG A 117 20.259 -25.161 22.592 1.00 63.44 H new ATOM 0 HG3 ARG A 117 20.039 -24.992 20.861 1.00 63.44 H new ATOM 0 HD2 ARG A 117 21.972 -27.095 21.417 1.00 62.04 H new ATOM 0 HD3 ARG A 117 20.500 -27.380 22.326 1.00 62.04 H new ATOM 0 HE ARG A 117 19.876 -26.683 19.589 1.00 41.43 H new ATOM 0 HH11 ARG A 117 21.080 -29.285 21.648 1.00 75.45 H new ATOM 0 HH12 ARG A 117 20.520 -30.560 20.562 1.00 75.45 H new ATOM 0 HH21 ARG A 117 19.159 -28.327 18.197 1.00 14.34 H new ATOM 0 HH22 ARG A 117 19.437 -30.020 18.616 1.00 14.34 H new ATOM 1680 N ILE A 118 21.180 -21.767 23.016 1.00 22.03 N ATOM 1681 CA ILE A 118 20.219 -21.103 23.888 1.00 22.02 C ATOM 1682 C ILE A 118 19.311 -20.169 23.095 1.00 31.51 C ATOM 1683 O ILE A 118 18.226 -19.806 23.551 1.00 52.12 O ATOM 1684 CB ILE A 118 20.926 -20.297 24.994 1.00 54.31 C ATOM 1685 CG1 ILE A 118 21.848 -21.206 25.808 1.00 31.14 C ATOM 1686 CG2 ILE A 118 19.901 -19.626 25.897 1.00 23.21 C ATOM 1687 CD1 ILE A 118 21.138 -22.390 26.426 1.00 75.33 C ATOM 0 H ILE A 118 22.156 -21.609 23.266 1.00 22.03 H new ATOM 0 HA ILE A 118 19.617 -21.886 24.349 1.00 22.02 H new ATOM 0 HB ILE A 118 21.533 -19.521 24.527 1.00 54.31 H new ATOM 0 HG12 ILE A 118 22.649 -21.569 25.163 1.00 31.14 H new ATOM 0 HG13 ILE A 118 22.316 -20.620 26.599 1.00 31.14 H new ATOM 0 HG21 ILE A 118 20.415 -19.060 26.674 1.00 23.21 H new ATOM 0 HG22 ILE A 118 19.282 -18.951 25.306 1.00 23.21 H new ATOM 0 HG23 ILE A 118 19.270 -20.386 26.359 1.00 23.21 H new ATOM 0 HD11 ILE A 118 21.853 -22.990 26.988 1.00 75.33 H new ATOM 0 HD12 ILE A 118 20.355 -22.035 27.097 1.00 75.33 H new ATOM 0 HD13 ILE A 118 20.693 -22.999 25.639 1.00 75.33 H new ATOM 1699 N LEU A 119 19.760 -19.786 21.905 1.00 3.13 N ATOM 1700 CA LEU A 119 18.987 -18.896 21.046 1.00 4.52 C ATOM 1701 C LEU A 119 18.150 -19.691 20.050 1.00 32.33 C ATOM 1702 O LEU A 119 17.894 -19.236 18.935 1.00 21.13 O ATOM 1703 CB LEU A 119 19.919 -17.941 20.298 1.00 3.31 C ATOM 1704 CG LEU A 119 20.417 -16.731 21.090 1.00 54.44 C ATOM 1705 CD1 LEU A 119 19.244 -15.899 21.585 1.00 2.44 C ATOM 1706 CD2 LEU A 119 21.287 -17.177 22.255 1.00 0.13 C ATOM 0 H LEU A 119 20.655 -20.078 21.513 1.00 3.13 H new ATOM 0 HA LEU A 119 18.313 -18.317 21.678 1.00 4.52 H new ATOM 0 HB2 LEU A 119 20.785 -18.506 19.954 1.00 3.31 H new ATOM 0 HB3 LEU A 119 19.400 -17.580 19.410 1.00 3.31 H new ATOM 0 HG LEU A 119 21.022 -16.111 20.428 1.00 54.44 H new ATOM 0 HD11 LEU A 119 19.617 -15.042 22.146 1.00 2.44 H new ATOM 0 HD12 LEU A 119 18.661 -15.549 20.733 1.00 2.44 H new ATOM 0 HD13 LEU A 119 18.612 -16.509 22.231 1.00 2.44 H new ATOM 0 HD21 LEU A 119 21.632 -16.303 22.807 1.00 0.13 H new ATOM 0 HD22 LEU A 119 20.706 -17.819 22.918 1.00 0.13 H new ATOM 0 HD23 LEU A 119 22.147 -17.730 21.876 1.00 0.13 H new ATOM 1718 N TYR A 120 17.724 -20.881 20.461 1.00 51.41 N ATOM 1719 CA TYR A 120 16.915 -21.740 19.605 1.00 60.12 C ATOM 1720 C TYR A 120 15.807 -20.943 18.924 1.00 74.01 C ATOM 1721 O TYR A 120 15.469 -21.192 17.767 1.00 11.44 O ATOM 1722 CB TYR A 120 16.309 -22.883 20.421 1.00 71.12 C ATOM 1723 CG TYR A 120 16.191 -22.577 21.897 1.00 60.22 C ATOM 1724 CD1 TYR A 120 15.263 -21.654 22.363 1.00 23.24 C ATOM 1725 CD2 TYR A 120 17.007 -23.212 22.825 1.00 21.11 C ATOM 1726 CE1 TYR A 120 15.153 -21.371 23.711 1.00 72.21 C ATOM 1727 CE2 TYR A 120 16.903 -22.936 24.175 1.00 74.42 C ATOM 1728 CZ TYR A 120 15.974 -22.015 24.613 1.00 44.13 C ATOM 1729 OH TYR A 120 15.866 -21.737 25.956 1.00 5.20 O ATOM 0 H TYR A 120 17.926 -21.272 21.381 1.00 51.41 H new ATOM 0 HA TYR A 120 17.564 -22.157 18.834 1.00 60.12 H new ATOM 0 HB2 TYR A 120 15.320 -23.115 20.026 1.00 71.12 H new ATOM 0 HB3 TYR A 120 16.921 -23.775 20.291 1.00 71.12 H new ATOM 0 HD1 TYR A 120 14.617 -21.149 21.660 1.00 23.24 H new ATOM 0 HD2 TYR A 120 17.735 -23.934 22.485 1.00 21.11 H new ATOM 0 HE1 TYR A 120 14.428 -20.649 24.057 1.00 72.21 H new ATOM 0 HE2 TYR A 120 17.545 -23.438 24.883 1.00 74.42 H new ATOM 0 HH TYR A 120 16.515 -22.276 26.455 1.00 5.20 H new ATOM 1739 N ASN A 121 15.245 -19.983 19.651 1.00 10.32 N ATOM 1740 CA ASN A 121 14.174 -19.148 19.119 1.00 44.33 C ATOM 1741 C ASN A 121 13.787 -18.059 20.115 1.00 44.34 C ATOM 1742 O ASN A 121 13.444 -16.941 19.728 1.00 42.11 O ATOM 1743 CB ASN A 121 12.952 -20.003 18.781 1.00 31.50 C ATOM 1744 CG ASN A 121 12.016 -20.167 19.963 1.00 1.22 C ATOM 1745 OD1 ASN A 121 11.039 -19.430 20.102 1.00 23.52 O ATOM 1746 ND2 ASN A 121 12.312 -21.135 20.822 1.00 32.42 N ATOM 0 H ASN A 121 15.513 -19.764 20.610 1.00 10.32 H new ATOM 0 HA ASN A 121 14.538 -18.671 18.209 1.00 44.33 H new ATOM 0 HB2 ASN A 121 12.410 -19.546 17.953 1.00 31.50 H new ATOM 0 HB3 ASN A 121 13.282 -20.985 18.443 1.00 31.50 H new ATOM 0 HD21 ASN A 121 11.719 -21.292 21.637 1.00 32.42 H new ATOM 0 HD22 ASN A 121 13.132 -21.722 20.667 1.00 32.42 H new ATOM 1753 N THR A 122 13.846 -18.392 21.400 1.00 35.23 N ATOM 1754 CA THR A 122 13.501 -17.444 22.452 1.00 20.11 C ATOM 1755 C THR A 122 14.234 -16.121 22.261 1.00 33.03 C ATOM 1756 O THR A 122 15.160 -16.022 21.456 1.00 23.31 O ATOM 1757 CB THR A 122 13.835 -18.006 23.847 1.00 61.43 C ATOM 1758 OG1 THR A 122 13.345 -17.123 24.861 1.00 11.15 O ATOM 1759 CG2 THR A 122 15.336 -18.192 24.010 1.00 1.53 C ATOM 0 H THR A 122 14.130 -19.312 21.738 1.00 35.23 H new ATOM 0 HA THR A 122 12.426 -17.274 22.385 1.00 20.11 H new ATOM 0 HB THR A 122 13.352 -18.978 23.949 1.00 61.43 H new ATOM 0 HG1 THR A 122 13.560 -17.488 25.745 1.00 11.15 H new ATOM 0 HG21 THR A 122 15.548 -18.590 25.003 1.00 1.53 H new ATOM 0 HG22 THR A 122 15.700 -18.888 23.255 1.00 1.53 H new ATOM 0 HG23 THR A 122 15.837 -17.231 23.890 1.00 1.53 H new ATOM 1767 N THR A 123 13.814 -15.104 23.008 1.00 73.14 N ATOM 1768 CA THR A 123 14.430 -13.786 22.920 1.00 32.22 C ATOM 1769 C THR A 123 15.176 -13.442 24.204 1.00 2.00 C ATOM 1770 O THR A 123 15.069 -12.328 24.717 1.00 52.33 O ATOM 1771 CB THR A 123 13.381 -12.693 22.641 1.00 61.23 C ATOM 1772 OG1 THR A 123 14.023 -11.420 22.511 1.00 1.23 O ATOM 1773 CG2 THR A 123 12.349 -12.635 23.757 1.00 60.41 C ATOM 0 H THR A 123 13.050 -15.168 23.680 1.00 73.14 H new ATOM 0 HA THR A 123 15.136 -13.822 22.090 1.00 32.22 H new ATOM 0 HB THR A 123 12.871 -12.939 21.710 1.00 61.23 H new ATOM 0 HG1 THR A 123 14.484 -11.199 23.347 1.00 1.23 H new ATOM 0 HG21 THR A 123 11.619 -11.856 23.537 1.00 60.41 H new ATOM 0 HG22 THR A 123 11.841 -13.597 23.834 1.00 60.41 H new ATOM 0 HG23 THR A 123 12.846 -12.411 24.701 1.00 60.41 H new ATOM 1781 N PHE A 124 15.933 -14.405 24.719 1.00 4.11 N ATOM 1782 CA PHE A 124 16.698 -14.203 25.944 1.00 21.33 C ATOM 1783 C PHE A 124 17.805 -13.175 25.731 1.00 2.04 C ATOM 1784 O PHE A 124 18.066 -12.339 26.597 1.00 41.24 O ATOM 1785 CB PHE A 124 17.301 -15.527 26.418 1.00 32.42 C ATOM 1786 CG PHE A 124 18.157 -15.391 27.645 1.00 62.44 C ATOM 1787 CD1 PHE A 124 17.632 -14.878 28.819 1.00 14.32 C ATOM 1788 CD2 PHE A 124 19.488 -15.778 27.623 1.00 54.41 C ATOM 1789 CE1 PHE A 124 18.418 -14.751 29.949 1.00 51.33 C ATOM 1790 CE2 PHE A 124 20.279 -15.653 28.750 1.00 73.44 C ATOM 1791 CZ PHE A 124 19.743 -15.140 29.914 1.00 34.23 C ATOM 0 H PHE A 124 16.033 -15.333 24.307 1.00 4.11 H new ATOM 0 HA PHE A 124 16.019 -13.826 26.709 1.00 21.33 H new ATOM 0 HB2 PHE A 124 16.495 -16.231 26.623 1.00 32.42 H new ATOM 0 HB3 PHE A 124 17.899 -15.953 25.613 1.00 32.42 H new ATOM 0 HD1 PHE A 124 16.596 -14.574 28.852 1.00 14.32 H new ATOM 0 HD2 PHE A 124 19.912 -16.182 26.715 1.00 54.41 H new ATOM 0 HE1 PHE A 124 17.997 -14.348 30.858 1.00 51.33 H new ATOM 0 HE2 PHE A 124 21.315 -15.956 28.720 1.00 73.44 H new ATOM 0 HZ PHE A 124 20.359 -15.043 30.796 1.00 34.23 H new ATOM 1801 N PHE A 125 18.454 -13.244 24.573 1.00 13.25 N ATOM 1802 CA PHE A 125 19.534 -12.321 24.246 1.00 0.42 C ATOM 1803 C PHE A 125 18.980 -10.960 23.834 1.00 43.15 C ATOM 1804 O PHE A 125 17.809 -10.819 23.482 1.00 12.32 O ATOM 1805 CB PHE A 125 20.400 -12.893 23.123 1.00 61.55 C ATOM 1806 CG PHE A 125 21.551 -13.723 23.616 1.00 32.12 C ATOM 1807 CD1 PHE A 125 21.351 -14.713 24.565 1.00 64.23 C ATOM 1808 CD2 PHE A 125 22.832 -13.513 23.131 1.00 33.23 C ATOM 1809 CE1 PHE A 125 22.409 -15.477 25.021 1.00 33.41 C ATOM 1810 CE2 PHE A 125 23.893 -14.275 23.584 1.00 51.42 C ATOM 1811 CZ PHE A 125 23.681 -15.259 24.529 1.00 12.32 C ATOM 0 H PHE A 125 18.250 -13.930 23.846 1.00 13.25 H new ATOM 0 HA PHE A 125 20.148 -12.189 25.137 1.00 0.42 H new ATOM 0 HB2 PHE A 125 19.777 -13.503 22.469 1.00 61.55 H new ATOM 0 HB3 PHE A 125 20.787 -12.072 22.519 1.00 61.55 H new ATOM 0 HD1 PHE A 125 20.358 -14.889 24.952 1.00 64.23 H new ATOM 0 HD2 PHE A 125 23.004 -12.745 22.391 1.00 33.23 H new ATOM 0 HE1 PHE A 125 22.241 -16.244 25.762 1.00 33.41 H new ATOM 0 HE2 PHE A 125 24.887 -14.101 23.199 1.00 51.42 H new ATOM 0 HZ PHE A 125 24.508 -15.857 24.883 1.00 12.32 H new ATOM 1821 N PRO A 126 19.842 -9.933 23.877 1.00 22.12 N ATOM 1822 CA PRO A 126 19.463 -8.565 23.512 1.00 72.15 C ATOM 1823 C PRO A 126 19.207 -8.415 22.016 1.00 42.42 C ATOM 1824 O PRO A 126 19.009 -9.401 21.307 1.00 64.44 O ATOM 1825 CB PRO A 126 20.678 -7.735 23.933 1.00 63.45 C ATOM 1826 CG PRO A 126 21.820 -8.691 23.897 1.00 63.45 C ATOM 1827 CD PRO A 126 21.254 -10.029 24.286 1.00 15.53 C ATOM 0 HA PRO A 126 18.534 -8.258 23.992 1.00 72.15 H new ATOM 0 HB2 PRO A 126 20.841 -6.898 23.254 1.00 63.45 H new ATOM 0 HB3 PRO A 126 20.544 -7.315 24.930 1.00 63.45 H new ATOM 0 HG2 PRO A 126 22.265 -8.730 22.903 1.00 63.45 H new ATOM 0 HG3 PRO A 126 22.607 -8.385 24.587 1.00 63.45 H new ATOM 0 HD2 PRO A 126 21.766 -10.845 23.776 1.00 15.53 H new ATOM 0 HD3 PRO A 126 21.351 -10.211 25.356 1.00 15.53 H new ATOM 1835 N LYS A 127 19.213 -7.174 21.541 1.00 1.53 N ATOM 1836 CA LYS A 127 18.984 -6.893 20.129 1.00 52.20 C ATOM 1837 C LYS A 127 20.135 -7.417 19.276 1.00 35.21 C ATOM 1838 O LYS A 127 20.068 -7.398 18.047 1.00 61.31 O ATOM 1839 CB LYS A 127 18.816 -5.388 19.908 1.00 54.22 C ATOM 1840 CG LYS A 127 20.130 -4.649 19.728 1.00 43.14 C ATOM 1841 CD LYS A 127 21.004 -4.756 20.966 1.00 2.41 C ATOM 1842 CE LYS A 127 20.369 -4.056 22.158 1.00 4.21 C ATOM 1843 NZ LYS A 127 20.189 -2.598 21.914 1.00 41.11 N ATOM 0 H LYS A 127 19.374 -6.346 22.114 1.00 1.53 H new ATOM 0 HA LYS A 127 18.069 -7.403 19.827 1.00 52.20 H new ATOM 0 HB2 LYS A 127 18.194 -5.226 19.028 1.00 54.22 H new ATOM 0 HB3 LYS A 127 18.283 -4.962 20.758 1.00 54.22 H new ATOM 0 HG2 LYS A 127 20.663 -5.057 18.869 1.00 43.14 H new ATOM 0 HG3 LYS A 127 19.931 -3.599 19.511 1.00 43.14 H new ATOM 0 HD2 LYS A 127 21.170 -5.806 21.206 1.00 2.41 H new ATOM 0 HD3 LYS A 127 21.981 -4.317 20.762 1.00 2.41 H new ATOM 0 HE2 LYS A 127 19.402 -4.510 22.373 1.00 4.21 H new ATOM 0 HE3 LYS A 127 20.993 -4.202 23.040 1.00 4.21 H new ATOM 0 HZ1 LYS A 127 19.981 -2.119 22.813 1.00 41.11 H new ATOM 0 HZ2 LYS A 127 21.061 -2.204 21.505 1.00 41.11 H new ATOM 0 HZ3 LYS A 127 19.400 -2.452 21.253 1.00 41.11 H new ATOM 1857 N PHE A 128 21.188 -7.886 19.936 1.00 23.02 N ATOM 1858 CA PHE A 128 22.354 -8.416 19.238 1.00 33.31 C ATOM 1859 C PHE A 128 21.931 -9.323 18.086 1.00 44.24 C ATOM 1860 O PHE A 128 22.589 -9.371 17.045 1.00 1.22 O ATOM 1861 CB PHE A 128 23.248 -9.190 20.209 1.00 32.22 C ATOM 1862 CG PHE A 128 23.640 -10.551 19.708 1.00 10.24 C ATOM 1863 CD1 PHE A 128 22.823 -11.648 19.932 1.00 43.43 C ATOM 1864 CD2 PHE A 128 24.825 -10.733 19.014 1.00 51.02 C ATOM 1865 CE1 PHE A 128 23.182 -12.901 19.473 1.00 43.25 C ATOM 1866 CE2 PHE A 128 25.189 -11.984 18.552 1.00 40.21 C ATOM 1867 CZ PHE A 128 24.366 -13.069 18.781 1.00 51.12 C ATOM 0 H PHE A 128 21.258 -7.910 20.953 1.00 23.02 H new ATOM 0 HA PHE A 128 22.915 -7.576 18.830 1.00 33.31 H new ATOM 0 HB2 PHE A 128 24.150 -8.609 20.402 1.00 32.22 H new ATOM 0 HB3 PHE A 128 22.729 -9.298 21.161 1.00 32.22 H new ATOM 0 HD1 PHE A 128 21.896 -11.522 20.471 1.00 43.43 H new ATOM 0 HD2 PHE A 128 25.472 -9.888 18.832 1.00 51.02 H new ATOM 0 HE1 PHE A 128 22.538 -13.748 19.655 1.00 43.25 H new ATOM 0 HE2 PHE A 128 26.116 -12.113 18.013 1.00 40.21 H new ATOM 0 HZ PHE A 128 24.647 -14.047 18.420 1.00 51.12 H new ATOM 1877 N LEU A 129 20.830 -10.041 18.278 1.00 4.44 N ATOM 1878 CA LEU A 129 20.319 -10.947 17.256 1.00 50.20 C ATOM 1879 C LEU A 129 19.624 -10.173 16.141 1.00 54.33 C ATOM 1880 O LEU A 129 20.169 -10.013 15.049 1.00 64.12 O ATOM 1881 CB LEU A 129 19.347 -11.952 17.877 1.00 5.11 C ATOM 1882 CG LEU A 129 19.904 -13.353 18.134 1.00 2.32 C ATOM 1883 CD1 LEU A 129 18.825 -14.259 18.706 1.00 25.15 C ATOM 1884 CD2 LEU A 129 20.475 -13.943 16.853 1.00 20.10 C ATOM 0 H LEU A 129 20.274 -10.013 19.133 1.00 4.44 H new ATOM 0 HA LEU A 129 21.164 -11.486 16.827 1.00 50.20 H new ATOM 0 HB2 LEU A 129 18.990 -11.545 18.823 1.00 5.11 H new ATOM 0 HB3 LEU A 129 18.481 -12.042 17.222 1.00 5.11 H new ATOM 0 HG LEU A 129 20.709 -13.275 18.865 1.00 2.32 H new ATOM 0 HD11 LEU A 129 19.239 -15.252 18.883 1.00 25.15 H new ATOM 0 HD12 LEU A 129 18.463 -13.844 19.647 1.00 25.15 H new ATOM 0 HD13 LEU A 129 17.998 -14.331 17.999 1.00 25.15 H new ATOM 0 HD21 LEU A 129 20.867 -14.940 17.055 1.00 20.10 H new ATOM 0 HD22 LEU A 129 19.689 -14.007 16.100 1.00 20.10 H new ATOM 0 HD23 LEU A 129 21.279 -13.305 16.485 1.00 20.10 H new ATOM 1896 N ARG A 130 18.417 -9.692 16.424 1.00 63.40 N ATOM 1897 CA ARG A 130 17.648 -8.934 15.445 1.00 12.12 C ATOM 1898 C ARG A 130 17.430 -9.750 14.174 1.00 1.23 C ATOM 1899 O ARG A 130 17.165 -9.197 13.106 1.00 2.24 O ATOM 1900 CB ARG A 130 18.362 -7.624 15.107 1.00 24.21 C ATOM 1901 CG ARG A 130 17.934 -6.454 15.977 1.00 33.24 C ATOM 1902 CD ARG A 130 16.446 -6.170 15.836 1.00 24.43 C ATOM 1903 NE ARG A 130 15.992 -6.305 14.455 1.00 43.22 N ATOM 1904 CZ ARG A 130 16.200 -5.384 13.520 1.00 64.41 C ATOM 1905 NH1 ARG A 130 16.852 -4.269 13.817 1.00 43.31 N ATOM 1906 NH2 ARG A 130 15.756 -5.579 12.285 1.00 63.22 N ATOM 0 H ARG A 130 17.951 -9.814 17.323 1.00 63.40 H new ATOM 0 HA ARG A 130 16.675 -8.707 15.882 1.00 12.12 H new ATOM 0 HB2 ARG A 130 19.437 -7.769 15.211 1.00 24.21 H new ATOM 0 HB3 ARG A 130 18.174 -7.377 14.062 1.00 24.21 H new ATOM 0 HG2 ARG A 130 18.167 -6.670 17.020 1.00 33.24 H new ATOM 0 HG3 ARG A 130 18.503 -5.566 15.700 1.00 33.24 H new ATOM 0 HD2 ARG A 130 15.884 -6.855 16.471 1.00 24.43 H new ATOM 0 HD3 ARG A 130 16.234 -5.161 16.190 1.00 24.43 H new ATOM 0 HE ARG A 130 15.488 -7.152 14.194 1.00 43.22 H new ATOM 0 HH11 ARG A 130 17.196 -4.116 14.765 1.00 43.31 H new ATOM 0 HH12 ARG A 130 17.010 -3.564 13.097 1.00 43.31 H new ATOM 0 HH21 ARG A 130 15.255 -6.436 12.053 1.00 63.22 H new ATOM 0 HH22 ARG A 130 15.916 -4.872 11.568 1.00 63.22 H new ATOM 1920 N CYS A 131 17.544 -11.068 14.297 1.00 40.01 N ATOM 1921 CA CYS A 131 17.361 -11.961 13.159 1.00 10.02 C ATOM 1922 C CYS A 131 16.164 -12.882 13.378 1.00 60.04 C ATOM 1923 O CYS A 131 15.863 -13.268 14.506 1.00 13.22 O ATOM 1924 CB CYS A 131 18.624 -12.794 12.929 1.00 12.52 C ATOM 1925 SG CYS A 131 18.560 -13.846 11.443 1.00 5.44 S ATOM 0 H CYS A 131 17.762 -11.542 15.174 1.00 40.01 H new ATOM 0 HA CYS A 131 17.171 -11.350 12.276 1.00 10.02 H new ATOM 0 HB2 CYS A 131 19.479 -12.123 12.850 1.00 12.52 H new ATOM 0 HB3 CYS A 131 18.794 -13.425 13.801 1.00 12.52 H new ATOM 1930 N ASN A 132 15.486 -13.230 12.289 1.00 70.31 N ATOM 1931 CA ASN A 132 14.322 -14.106 12.361 1.00 52.21 C ATOM 1932 C ASN A 132 14.696 -15.540 12.000 1.00 25.01 C ATOM 1933 O ASN A 132 15.082 -15.824 10.867 1.00 61.23 O ATOM 1934 CB ASN A 132 13.221 -13.603 11.424 1.00 21.34 C ATOM 1935 CG ASN A 132 13.501 -12.209 10.899 1.00 2.40 C ATOM 1936 OD1 ASN A 132 13.159 -11.213 11.537 1.00 43.31 O ATOM 1937 ND2 ASN A 132 14.126 -12.131 9.730 1.00 62.41 N ATOM 0 H ASN A 132 15.722 -12.919 11.347 1.00 70.31 H new ATOM 0 HA ASN A 132 13.952 -14.093 13.386 1.00 52.21 H new ATOM 0 HB2 ASN A 132 13.120 -14.291 10.585 1.00 21.34 H new ATOM 0 HB3 ASN A 132 12.268 -13.604 11.954 1.00 21.34 H new ATOM 0 HD21 ASN A 132 14.341 -11.219 9.326 1.00 62.41 H new ATOM 0 HD22 ASN A 132 14.391 -12.983 9.236 1.00 62.41 H new ATOM 1944 N GLU A 133 14.579 -16.439 12.972 1.00 23.04 N ATOM 1945 CA GLU A 133 14.906 -17.844 12.756 1.00 1.45 C ATOM 1946 C GLU A 133 13.672 -18.723 12.934 1.00 14.00 C ATOM 1947 O GLU A 133 13.574 -19.802 12.349 1.00 21.53 O ATOM 1948 CB GLU A 133 16.006 -18.289 13.723 1.00 50.34 C ATOM 1949 CG GLU A 133 15.802 -17.796 15.146 1.00 70.34 C ATOM 1950 CD GLU A 133 16.769 -16.692 15.525 1.00 41.31 C ATOM 1951 OE1 GLU A 133 16.808 -15.666 14.814 1.00 71.23 O ATOM 1952 OE2 GLU A 133 17.487 -16.853 16.534 1.00 21.40 O ATOM 0 H GLU A 133 14.261 -16.220 13.916 1.00 23.04 H new ATOM 0 HA GLU A 133 15.265 -17.954 11.733 1.00 1.45 H new ATOM 0 HB2 GLU A 133 16.055 -19.378 13.728 1.00 50.34 H new ATOM 0 HB3 GLU A 133 16.967 -17.929 13.357 1.00 50.34 H new ATOM 0 HG2 GLU A 133 14.780 -17.433 15.258 1.00 70.34 H new ATOM 0 HG3 GLU A 133 15.921 -18.631 15.836 1.00 70.34 H new ATOM 1959 N THR A 134 12.730 -18.253 13.746 1.00 34.53 N ATOM 1960 CA THR A 134 11.502 -18.996 14.003 1.00 23.22 C ATOM 1961 C THR A 134 10.300 -18.309 13.365 1.00 21.25 C ATOM 1962 O THR A 134 9.195 -18.854 13.353 1.00 3.41 O ATOM 1963 CB THR A 134 11.247 -19.154 15.514 1.00 61.30 C ATOM 1964 OG1 THR A 134 9.903 -19.593 15.741 1.00 52.45 O ATOM 1965 CG2 THR A 134 11.488 -17.841 16.244 1.00 75.43 C ATOM 0 H THR A 134 12.794 -17.361 14.237 1.00 34.53 H new ATOM 0 HA THR A 134 11.631 -19.983 13.559 1.00 23.22 H new ATOM 0 HB THR A 134 11.942 -19.899 15.901 1.00 61.30 H new ATOM 0 HG1 THR A 134 9.457 -19.741 14.881 1.00 52.45 H new ATOM 0 HG21 THR A 134 11.302 -17.977 17.309 1.00 75.43 H new ATOM 0 HG22 THR A 134 12.520 -17.525 16.094 1.00 75.43 H new ATOM 0 HG23 THR A 134 10.815 -17.078 15.853 1.00 75.43 H new ATOM 1973 N LEU A 135 10.522 -17.111 12.836 1.00 74.21 N ATOM 1974 CA LEU A 135 9.456 -16.349 12.195 1.00 74.23 C ATOM 1975 C LEU A 135 9.177 -16.877 10.791 1.00 22.10 C ATOM 1976 O LEU A 135 8.185 -17.569 10.562 1.00 55.50 O ATOM 1977 CB LEU A 135 9.829 -14.867 12.130 1.00 62.22 C ATOM 1978 CG LEU A 135 10.029 -14.166 13.474 1.00 53.22 C ATOM 1979 CD1 LEU A 135 10.233 -12.673 13.271 1.00 4.54 C ATOM 1980 CD2 LEU A 135 8.843 -14.424 14.391 1.00 15.14 C ATOM 0 H LEU A 135 11.430 -16.646 12.838 1.00 74.21 H new ATOM 0 HA LEU A 135 8.552 -16.464 12.793 1.00 74.23 H new ATOM 0 HB2 LEU A 135 10.748 -14.769 11.552 1.00 62.22 H new ATOM 0 HB3 LEU A 135 9.049 -14.340 11.581 1.00 62.22 H new ATOM 0 HG LEU A 135 10.923 -14.574 13.946 1.00 53.22 H new ATOM 0 HD11 LEU A 135 10.374 -12.190 14.238 1.00 4.54 H new ATOM 0 HD12 LEU A 135 11.114 -12.507 12.651 1.00 4.54 H new ATOM 0 HD13 LEU A 135 9.358 -12.250 12.778 1.00 4.54 H new ATOM 0 HD21 LEU A 135 9.002 -13.918 15.343 1.00 15.14 H new ATOM 0 HD22 LEU A 135 7.934 -14.044 13.925 1.00 15.14 H new ATOM 0 HD23 LEU A 135 8.742 -15.496 14.562 1.00 15.14 H new ATOM 1992 N PHE A 136 10.061 -16.548 9.855 1.00 61.42 N ATOM 1993 CA PHE A 136 9.911 -16.990 8.473 1.00 25.52 C ATOM 1994 C PHE A 136 11.202 -16.770 7.689 1.00 54.22 C ATOM 1995 O PHE A 136 11.256 -15.984 6.743 1.00 50.32 O ATOM 1996 CB PHE A 136 8.758 -16.245 7.799 1.00 34.21 C ATOM 1997 CG PHE A 136 7.453 -16.988 7.851 1.00 40.25 C ATOM 1998 CD1 PHE A 136 7.296 -18.187 7.175 1.00 65.24 C ATOM 1999 CD2 PHE A 136 6.384 -16.487 8.575 1.00 14.11 C ATOM 2000 CE1 PHE A 136 6.097 -18.872 7.220 1.00 72.03 C ATOM 2001 CE2 PHE A 136 5.182 -17.168 8.624 1.00 14.52 C ATOM 2002 CZ PHE A 136 5.039 -18.362 7.946 1.00 35.33 C ATOM 0 H PHE A 136 10.888 -15.977 10.028 1.00 61.42 H new ATOM 0 HA PHE A 136 9.689 -18.057 8.481 1.00 25.52 H new ATOM 0 HB2 PHE A 136 8.634 -15.274 8.278 1.00 34.21 H new ATOM 0 HB3 PHE A 136 9.018 -16.055 6.758 1.00 34.21 H new ATOM 0 HD1 PHE A 136 8.120 -18.591 6.606 1.00 65.24 H new ATOM 0 HD2 PHE A 136 6.491 -15.553 9.107 1.00 14.11 H new ATOM 0 HE1 PHE A 136 5.987 -19.805 6.688 1.00 72.03 H new ATOM 0 HE2 PHE A 136 4.356 -16.766 9.192 1.00 14.52 H new ATOM 0 HZ PHE A 136 4.101 -18.896 7.983 1.00 35.33 H new ATOM 2012 N PRO A 137 12.266 -17.479 8.091 1.00 64.55 N ATOM 2013 CA PRO A 137 13.576 -17.379 7.440 1.00 41.03 C ATOM 2014 C PRO A 137 13.576 -17.986 6.041 1.00 63.02 C ATOM 2015 O PRO A 137 14.031 -17.362 5.081 1.00 23.15 O ATOM 2016 CB PRO A 137 14.496 -18.176 8.368 1.00 12.44 C ATOM 2017 CG PRO A 137 13.594 -19.139 9.059 1.00 31.15 C ATOM 2018 CD PRO A 137 12.274 -18.435 9.211 1.00 72.22 C ATOM 0 HA PRO A 137 13.883 -16.342 7.300 1.00 41.03 H new ATOM 0 HB2 PRO A 137 15.273 -18.694 7.806 1.00 12.44 H new ATOM 0 HB3 PRO A 137 15.000 -17.524 9.081 1.00 12.44 H new ATOM 0 HG2 PRO A 137 13.483 -20.055 8.479 1.00 31.15 H new ATOM 0 HG3 PRO A 137 13.998 -19.424 10.030 1.00 31.15 H new ATOM 0 HD2 PRO A 137 11.438 -19.132 9.151 1.00 72.22 H new ATOM 0 HD3 PRO A 137 12.198 -17.928 10.173 1.00 72.22 H new ATOM 2026 N THR A 138 13.063 -19.207 5.930 1.00 32.35 N ATOM 2027 CA THR A 138 13.004 -19.899 4.649 1.00 44.00 C ATOM 2028 C THR A 138 11.807 -19.435 3.828 1.00 74.40 C ATOM 2029 O THR A 138 11.956 -18.692 2.858 1.00 54.10 O ATOM 2030 CB THR A 138 12.923 -21.426 4.838 1.00 41.43 C ATOM 2031 OG1 THR A 138 12.570 -21.734 6.191 1.00 44.21 O ATOM 2032 CG2 THR A 138 14.249 -22.085 4.491 1.00 25.12 C ATOM 0 H THR A 138 12.682 -19.738 6.713 1.00 32.35 H new ATOM 0 HA THR A 138 13.923 -19.655 4.116 1.00 44.00 H new ATOM 0 HB THR A 138 12.157 -21.813 4.166 1.00 41.43 H new ATOM 0 HG1 THR A 138 11.685 -21.363 6.391 1.00 44.21 H new ATOM 0 HG21 THR A 138 14.168 -23.163 4.632 1.00 25.12 H new ATOM 0 HG22 THR A 138 14.500 -21.873 3.452 1.00 25.12 H new ATOM 0 HG23 THR A 138 15.031 -21.692 5.140 1.00 25.12 H new ATOM 2040 N LYS A 139 10.618 -19.878 4.223 1.00 73.33 N ATOM 2041 CA LYS A 139 9.392 -19.507 3.525 1.00 63.42 C ATOM 2042 C LYS A 139 8.164 -19.859 4.358 1.00 70.51 C ATOM 2043 O LYS A 139 7.037 -19.832 3.862 1.00 1.45 O ATOM 2044 CB LYS A 139 9.321 -20.212 2.168 1.00 15.21 C ATOM 2045 CG LYS A 139 9.412 -21.725 2.263 1.00 75.02 C ATOM 2046 CD LYS A 139 8.288 -22.400 1.494 1.00 20.45 C ATOM 2047 CE LYS A 139 8.511 -23.901 1.385 1.00 42.12 C ATOM 2048 NZ LYS A 139 7.690 -24.657 2.370 1.00 74.31 N ATOM 0 H LYS A 139 10.477 -20.495 5.023 1.00 73.33 H new ATOM 0 HA LYS A 139 9.405 -18.429 3.367 1.00 63.42 H new ATOM 0 HB2 LYS A 139 8.386 -19.943 1.677 1.00 15.21 H new ATOM 0 HB3 LYS A 139 10.130 -19.847 1.535 1.00 15.21 H new ATOM 0 HG2 LYS A 139 10.373 -22.058 1.872 1.00 75.02 H new ATOM 0 HG3 LYS A 139 9.372 -22.028 3.309 1.00 75.02 H new ATOM 0 HD2 LYS A 139 7.338 -22.207 1.992 1.00 20.45 H new ATOM 0 HD3 LYS A 139 8.218 -21.968 0.496 1.00 20.45 H new ATOM 0 HE2 LYS A 139 8.264 -24.232 0.376 1.00 42.12 H new ATOM 0 HE3 LYS A 139 9.566 -24.124 1.545 1.00 42.12 H new ATOM 0 HZ1 LYS A 139 7.871 -25.676 2.263 1.00 74.31 H new ATOM 0 HZ2 LYS A 139 7.943 -24.360 3.334 1.00 74.31 H new ATOM 0 HZ3 LYS A 139 6.682 -24.465 2.202 1.00 74.31 H new TER 2062 LYS A 139