USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1086 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 116 LYS NZ :NH3+ -161:sc= 0.0396 (180deg=0) USER MOD Set 1.2: A 117 SER OG : rot 180:sc= 0.0388 USER MOD Set 2.1: A 19 MET CE :methyl -138:sc= -1.78 (180deg=-1.8) USER MOD Set 2.2: A 115 MET CE :methyl -135:sc= -2.81! (180deg=-5.51!) USER MOD Set 3.1: A 110 HIS : no HD1:sc= 0 X(o=-2.6,f=-3.1) USER MOD Set 3.2: A 113 LYS NZ :NH3+ -121:sc= -2.58! (180deg=-7.66!) USER MOD Set 4.1: A 41 SER OG : rot 164:sc= -1.74 USER MOD Set 4.2: A 119 SER OG : rot 170:sc= 0 USER MOD Set 5.1: A 31 GLN : amide:sc= -0.398 X(o=-0.4,f=-0.45) USER MOD Set 5.2: A 34 LYS NZ :NH3+ -156:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -1.12 K(o=-1.1,f=-2.2) USER MOD Single : A 10 GLN : amide:sc= -0.475 X(o=-0.47,f=-0.18) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0274) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -178:sc= -1.71 USER MOD Single : A 44 ASN : amide:sc= -0.0877 K(o=-0.088,f=-3!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -144:sc= -0.227 (180deg=-1.21) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 80 SER OG : rot 170:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -0.016 X(o=-0.016,f=-0.4) USER MOD Single : A 86 SER OG : rot 180:sc= -0.0338 USER MOD Single : A 87 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.334) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot -48:sc= 0.538 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 150:sc= -0.0701 USER MOD Single : A 93 THR OG1 : rot -62:sc= 0.17 USER MOD Single : A 94 HIS : no HD1:sc= -0.0114 X(o=-0.011,f=-0.14) USER MOD Single : A 95 ASN : amide:sc=-0.00873 K(o=-0.0087,f=-1.6) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -135:sc= 0.148 USER MOD Single : A 108 GLN : amide:sc= -2.69! C(o=-2.7!,f=-5.7!) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -52:sc= 1.19 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= -0.551 USER MOD Single : A 130 GLN : amide:sc= -0.0718 K(o=-0.072,f=-0.78) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -24.898 16.115 19.132 1.00 0.00 N ATOM 2 CA GLY A 1 -24.279 16.837 18.036 1.00 0.00 C ATOM 3 C GLY A 1 -24.984 16.600 16.715 1.00 0.00 C ATOM 4 O GLY A 1 -25.987 17.247 16.414 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.380 16.310 20.013 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.886 16.423 19.236 1.00 0.00 H new ATOM 0 H3 GLY A 1 -24.872 15.094 18.934 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.282 17.904 18.260 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -23.236 16.533 17.948 1.00 0.00 H new ATOM 8 N SER A 2 -24.457 15.671 15.924 1.00 0.00 N ATOM 9 CA SER A 2 -25.039 15.354 14.625 1.00 0.00 C ATOM 10 C SER A 2 -24.994 16.567 13.699 1.00 0.00 C ATOM 11 O SER A 2 -25.960 16.858 12.993 1.00 0.00 O ATOM 12 CB SER A 2 -26.484 14.879 14.792 1.00 0.00 C ATOM 13 OG SER A 2 -26.530 13.534 15.235 1.00 0.00 O ATOM 0 H SER A 2 -23.628 15.125 16.160 1.00 0.00 H new ATOM 0 HA SER A 2 -24.451 14.554 14.176 1.00 0.00 H new ATOM 0 HB2 SER A 2 -27.000 15.519 15.508 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.012 14.971 13.843 1.00 0.00 H new ATOM 0 HG SER A 2 -27.464 13.255 15.336 1.00 0.00 H new ATOM 19 N SER A 3 -23.866 17.269 13.708 1.00 0.00 N ATOM 20 CA SER A 3 -23.695 18.452 12.873 1.00 0.00 C ATOM 21 C SER A 3 -23.907 18.113 11.401 1.00 0.00 C ATOM 22 O SER A 3 -24.761 18.697 10.735 1.00 0.00 O ATOM 23 CB SER A 3 -22.300 19.048 13.075 1.00 0.00 C ATOM 24 OG SER A 3 -22.042 19.288 14.448 1.00 0.00 O ATOM 0 H SER A 3 -23.056 17.039 14.284 1.00 0.00 H new ATOM 0 HA SER A 3 -24.443 19.187 13.170 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.549 18.368 12.674 1.00 0.00 H new ATOM 0 HB3 SER A 3 -22.215 19.981 12.517 1.00 0.00 H new ATOM 0 HG SER A 3 -21.144 19.667 14.551 1.00 0.00 H new ATOM 30 N GLY A 4 -23.123 17.163 10.900 1.00 0.00 N ATOM 31 CA GLY A 4 -23.239 16.762 9.510 1.00 0.00 C ATOM 32 C GLY A 4 -21.922 16.857 8.767 1.00 0.00 C ATOM 33 O GLY A 4 -21.199 17.845 8.895 1.00 0.00 O ATOM 0 H GLY A 4 -22.410 16.664 11.432 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.607 15.737 9.460 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -23.978 17.391 9.014 1.00 0.00 H new ATOM 37 N SER A 5 -21.608 15.827 7.988 1.00 0.00 N ATOM 38 CA SER A 5 -20.365 15.796 7.225 1.00 0.00 C ATOM 39 C SER A 5 -20.648 15.669 5.732 1.00 0.00 C ATOM 40 O SER A 5 -21.654 15.088 5.326 1.00 0.00 O ATOM 41 CB SER A 5 -19.485 14.634 7.690 1.00 0.00 C ATOM 42 OG SER A 5 -20.025 13.390 7.279 1.00 0.00 O ATOM 0 H SER A 5 -22.197 15.003 7.868 1.00 0.00 H new ATOM 0 HA SER A 5 -19.837 16.734 7.399 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.480 14.750 7.284 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.395 14.654 8.776 1.00 0.00 H new ATOM 0 HG SER A 5 -19.444 12.663 7.587 1.00 0.00 H new ATOM 48 N SER A 6 -19.751 16.217 4.917 1.00 0.00 N ATOM 49 CA SER A 6 -19.905 16.170 3.468 1.00 0.00 C ATOM 50 C SER A 6 -20.374 14.790 3.017 1.00 0.00 C ATOM 51 O SER A 6 -21.435 14.651 2.410 1.00 0.00 O ATOM 52 CB SER A 6 -18.583 16.521 2.782 1.00 0.00 C ATOM 53 OG SER A 6 -18.627 16.209 1.401 1.00 0.00 O ATOM 0 H SER A 6 -18.910 16.698 5.236 1.00 0.00 H new ATOM 0 HA SER A 6 -20.660 16.903 3.183 1.00 0.00 H new ATOM 0 HB2 SER A 6 -18.373 17.583 2.912 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.767 15.975 3.256 1.00 0.00 H new ATOM 0 HG SER A 6 -17.771 16.444 0.985 1.00 0.00 H new ATOM 59 N GLY A 7 -19.574 13.771 3.318 1.00 0.00 N ATOM 60 CA GLY A 7 -19.924 12.416 2.937 1.00 0.00 C ATOM 61 C GLY A 7 -18.704 11.546 2.705 1.00 0.00 C ATOM 62 O GLY A 7 -17.745 11.969 2.060 1.00 0.00 O ATOM 0 H GLY A 7 -18.690 13.861 3.819 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.541 11.970 3.717 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.527 12.441 2.029 1.00 0.00 H new ATOM 66 N SER A 8 -18.739 10.327 3.234 1.00 0.00 N ATOM 67 CA SER A 8 -17.625 9.397 3.086 1.00 0.00 C ATOM 68 C SER A 8 -17.698 8.672 1.745 1.00 0.00 C ATOM 69 O SER A 8 -16.689 8.517 1.057 1.00 0.00 O ATOM 70 CB SER A 8 -17.627 8.381 4.229 1.00 0.00 C ATOM 71 OG SER A 8 -17.527 9.028 5.486 1.00 0.00 O ATOM 0 H SER A 8 -19.526 9.960 3.769 1.00 0.00 H new ATOM 0 HA SER A 8 -16.698 9.969 3.120 1.00 0.00 H new ATOM 0 HB2 SER A 8 -18.542 7.790 4.193 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.794 7.688 4.106 1.00 0.00 H new ATOM 0 HG SER A 8 -17.532 8.357 6.200 1.00 0.00 H new ATOM 77 N GLN A 9 -18.898 8.230 1.383 1.00 0.00 N ATOM 78 CA GLN A 9 -19.102 7.520 0.126 1.00 0.00 C ATOM 79 C GLN A 9 -18.504 8.298 -1.042 1.00 0.00 C ATOM 80 O GLN A 9 -17.805 7.732 -1.882 1.00 0.00 O ATOM 81 CB GLN A 9 -20.594 7.284 -0.114 1.00 0.00 C ATOM 82 CG GLN A 9 -20.902 6.666 -1.469 1.00 0.00 C ATOM 83 CD GLN A 9 -22.357 6.263 -1.609 1.00 0.00 C ATOM 84 OE1 GLN A 9 -23.128 6.336 -0.652 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.740 5.835 -2.807 1.00 0.00 N ATOM 0 H GLN A 9 -19.743 8.351 1.942 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.595 6.557 0.195 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.981 6.633 0.670 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -21.122 8.234 -0.029 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.649 7.378 -2.255 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -20.270 5.790 -1.617 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -22.067 5.791 -3.572 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.707 5.551 -2.962 1.00 0.00 H new ATOM 94 N GLN A 10 -18.784 9.596 -1.087 1.00 0.00 N ATOM 95 CA GLN A 10 -18.274 10.450 -2.153 1.00 0.00 C ATOM 96 C GLN A 10 -16.749 10.481 -2.144 1.00 0.00 C ATOM 97 O GLN A 10 -16.110 10.344 -3.187 1.00 0.00 O ATOM 98 CB GLN A 10 -18.825 11.870 -2.005 1.00 0.00 C ATOM 99 CG GLN A 10 -20.343 11.939 -2.031 1.00 0.00 C ATOM 100 CD GLN A 10 -20.946 11.116 -3.152 1.00 0.00 C ATOM 101 OE1 GLN A 10 -21.138 11.607 -4.264 1.00 0.00 O ATOM 102 NE2 GLN A 10 -21.248 9.855 -2.864 1.00 0.00 N ATOM 0 H GLN A 10 -19.361 10.079 -0.398 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.605 10.036 -3.105 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.466 12.294 -1.067 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -18.428 12.491 -2.808 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.735 11.588 -1.076 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -20.654 12.978 -2.141 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.072 9.489 -1.928 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.656 9.252 -3.579 1.00 0.00 H new ATOM 111 N ARG A 11 -16.173 10.660 -0.960 1.00 0.00 N ATOM 112 CA ARG A 11 -14.723 10.710 -0.816 1.00 0.00 C ATOM 113 C ARG A 11 -14.076 9.455 -1.393 1.00 0.00 C ATOM 114 O ARG A 11 -13.208 9.534 -2.263 1.00 0.00 O ATOM 115 CB ARG A 11 -14.341 10.862 0.658 1.00 0.00 C ATOM 116 CG ARG A 11 -12.887 11.250 0.873 1.00 0.00 C ATOM 117 CD ARG A 11 -12.643 11.730 2.295 1.00 0.00 C ATOM 118 NE ARG A 11 -12.981 13.141 2.462 1.00 0.00 N ATOM 119 CZ ARG A 11 -13.327 13.681 3.626 1.00 0.00 C ATOM 120 NH1 ARG A 11 -13.380 12.931 4.718 1.00 0.00 N ATOM 121 NH2 ARG A 11 -13.621 14.973 3.698 1.00 0.00 N ATOM 0 H ARG A 11 -16.688 10.773 -0.087 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.357 11.574 -1.370 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.981 11.617 1.115 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.538 9.923 1.174 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.246 10.394 0.662 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.611 12.036 0.170 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -13.236 11.131 2.986 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -11.596 11.575 2.555 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.950 13.745 1.641 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.155 11.938 4.666 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -13.646 13.348 5.610 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.582 15.553 2.860 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -13.886 15.387 4.592 1.00 0.00 H new ATOM 135 N VAL A 12 -14.504 8.295 -0.903 1.00 0.00 N ATOM 136 CA VAL A 12 -13.967 7.023 -1.370 1.00 0.00 C ATOM 137 C VAL A 12 -13.810 7.016 -2.886 1.00 0.00 C ATOM 138 O VAL A 12 -12.715 6.807 -3.408 1.00 0.00 O ATOM 139 CB VAL A 12 -14.869 5.846 -0.952 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.334 4.538 -1.514 1.00 0.00 C ATOM 141 CG2 VAL A 12 -14.986 5.777 0.563 1.00 0.00 C ATOM 0 H VAL A 12 -15.221 8.211 -0.183 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.988 6.903 -0.906 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.865 6.010 -1.363 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.984 3.718 -1.208 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.307 4.594 -2.602 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.327 4.364 -1.135 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.627 4.940 0.841 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.997 5.637 0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.419 6.705 0.937 1.00 0.00 H new ATOM 151 N LYS A 13 -14.913 7.246 -3.590 1.00 0.00 N ATOM 152 CA LYS A 13 -14.900 7.269 -5.048 1.00 0.00 C ATOM 153 C LYS A 13 -13.635 7.943 -5.571 1.00 0.00 C ATOM 154 O LYS A 13 -12.992 7.445 -6.494 1.00 0.00 O ATOM 155 CB LYS A 13 -16.136 7.999 -5.578 1.00 0.00 C ATOM 156 CG LYS A 13 -16.264 7.959 -7.092 1.00 0.00 C ATOM 157 CD LYS A 13 -16.686 6.583 -7.579 1.00 0.00 C ATOM 158 CE LYS A 13 -16.451 6.426 -9.074 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.553 5.004 -9.505 1.00 0.00 N ATOM 0 H LYS A 13 -15.828 7.419 -3.174 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.914 6.238 -5.403 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -17.028 7.556 -5.135 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -16.101 9.039 -5.252 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.994 8.701 -7.416 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.311 8.230 -7.546 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.128 5.818 -7.039 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.741 6.425 -7.357 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.180 7.024 -9.621 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -15.465 6.813 -9.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -16.387 4.939 -10.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -15.841 4.437 -9.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.503 4.642 -9.285 1.00 0.00 H new ATOM 173 N ARG A 14 -13.285 9.077 -4.973 1.00 0.00 N ATOM 174 CA ARG A 14 -12.097 9.819 -5.378 1.00 0.00 C ATOM 175 C ARG A 14 -10.868 8.914 -5.387 1.00 0.00 C ATOM 176 O ARG A 14 -10.083 8.927 -6.335 1.00 0.00 O ATOM 177 CB ARG A 14 -11.864 11.004 -4.439 1.00 0.00 C ATOM 178 CG ARG A 14 -13.033 11.974 -4.382 1.00 0.00 C ATOM 179 CD ARG A 14 -12.568 13.388 -4.068 1.00 0.00 C ATOM 180 NE ARG A 14 -13.623 14.186 -3.450 1.00 0.00 N ATOM 181 CZ ARG A 14 -13.449 14.908 -2.349 1.00 0.00 C ATOM 182 NH1 ARG A 14 -12.268 14.932 -1.747 1.00 0.00 N ATOM 183 NH2 ARG A 14 -14.458 15.609 -1.847 1.00 0.00 N ATOM 0 H ARG A 14 -13.807 9.502 -4.207 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.260 10.193 -6.389 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.665 10.628 -3.435 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.972 11.542 -4.760 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -13.560 11.967 -5.336 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -13.743 11.646 -3.623 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.707 13.347 -3.401 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -12.237 13.873 -4.986 1.00 0.00 H new ATOM 0 HE ARG A 14 -14.544 14.189 -3.888 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -11.490 14.395 -2.129 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -12.138 15.488 -0.902 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -15.368 15.594 -2.307 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -14.323 16.163 -1.001 1.00 0.00 H new ATOM 197 N TRP A 15 -10.709 8.131 -4.326 1.00 0.00 N ATOM 198 CA TRP A 15 -9.575 7.221 -4.212 1.00 0.00 C ATOM 199 C TRP A 15 -9.401 6.404 -5.488 1.00 0.00 C ATOM 200 O TRP A 15 -8.292 5.994 -5.827 1.00 0.00 O ATOM 201 CB TRP A 15 -9.764 6.287 -3.015 1.00 0.00 C ATOM 202 CG TRP A 15 -10.117 7.007 -1.749 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.971 8.341 -1.497 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.673 6.431 -0.562 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.402 8.629 -0.225 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.839 7.474 0.369 1.00 0.00 C ATOM 207 CE3 TRP A 15 -11.048 5.135 -0.196 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.362 7.260 1.641 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.568 4.924 1.067 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.722 5.982 1.973 1.00 0.00 C ATOM 0 H TRP A 15 -11.350 8.108 -3.533 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.676 7.818 -4.061 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.549 5.567 -3.246 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.847 5.719 -2.858 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.575 9.064 -2.195 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -10.398 9.553 0.207 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.933 4.314 -0.888 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.480 8.074 2.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.861 3.927 1.361 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.133 5.785 2.952 1.00 0.00 H new ATOM 221 N GLY A 16 -10.505 6.172 -6.191 1.00 0.00 N ATOM 222 CA GLY A 16 -10.453 5.405 -7.422 1.00 0.00 C ATOM 223 C GLY A 16 -9.964 6.228 -8.597 1.00 0.00 C ATOM 224 O GLY A 16 -10.333 5.969 -9.743 1.00 0.00 O ATOM 0 H GLY A 16 -11.434 6.501 -5.930 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.795 4.547 -7.284 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.445 5.013 -7.645 1.00 0.00 H new ATOM 228 N PHE A 17 -9.132 7.225 -8.314 1.00 0.00 N ATOM 229 CA PHE A 17 -8.594 8.091 -9.357 1.00 0.00 C ATOM 230 C PHE A 17 -7.077 7.951 -9.451 1.00 0.00 C ATOM 231 O PHE A 17 -6.402 8.781 -10.059 1.00 0.00 O ATOM 232 CB PHE A 17 -8.966 9.549 -9.081 1.00 0.00 C ATOM 233 CG PHE A 17 -10.410 9.861 -9.354 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.002 9.476 -10.546 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.175 10.540 -8.419 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.330 9.761 -10.800 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.503 10.827 -8.667 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.082 10.439 -9.860 1.00 0.00 C ATOM 0 H PHE A 17 -8.816 7.453 -7.372 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.030 7.786 -10.308 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.743 9.782 -8.040 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.340 10.198 -9.694 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.419 8.947 -11.285 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.728 10.848 -7.486 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -12.780 9.454 -11.733 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.089 11.355 -7.929 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.120 10.665 -10.057 1.00 0.00 H new ATOM 248 N GLY A 18 -6.547 6.893 -8.844 1.00 0.00 N ATOM 249 CA GLY A 18 -5.115 6.663 -8.870 1.00 0.00 C ATOM 250 C GLY A 18 -4.496 6.703 -7.487 1.00 0.00 C ATOM 251 O GLY A 18 -4.995 7.389 -6.596 1.00 0.00 O ATOM 0 H GLY A 18 -7.084 6.191 -8.335 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -4.914 5.694 -9.327 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.641 7.416 -9.499 1.00 0.00 H new ATOM 255 N MET A 19 -3.407 5.962 -7.306 1.00 0.00 N ATOM 256 CA MET A 19 -2.720 5.916 -6.021 1.00 0.00 C ATOM 257 C MET A 19 -2.591 7.313 -5.422 1.00 0.00 C ATOM 258 O MET A 19 -2.903 7.527 -4.250 1.00 0.00 O ATOM 259 CB MET A 19 -1.334 5.287 -6.181 1.00 0.00 C ATOM 260 CG MET A 19 -0.724 4.819 -4.870 1.00 0.00 C ATOM 261 SD MET A 19 0.480 3.495 -5.098 1.00 0.00 S ATOM 262 CE MET A 19 1.732 4.339 -6.062 1.00 0.00 C ATOM 0 H MET A 19 -2.982 5.386 -8.033 1.00 0.00 H new ATOM 0 HA MET A 19 -3.313 5.303 -5.343 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.405 4.439 -6.862 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.666 6.013 -6.644 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.242 5.663 -4.377 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.517 4.473 -4.207 1.00 0.00 H new ATOM 0 HE1 MET A 19 2.084 3.681 -6.856 1.00 0.00 H new ATOM 0 HE2 MET A 19 1.307 5.242 -6.500 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.568 4.608 -5.417 1.00 0.00 H new ATOM 272 N ASP A 20 -2.129 8.258 -6.232 1.00 0.00 N ATOM 273 CA ASP A 20 -1.960 9.635 -5.783 1.00 0.00 C ATOM 274 C ASP A 20 -3.051 10.020 -4.788 1.00 0.00 C ATOM 275 O ASP A 20 -2.772 10.281 -3.618 1.00 0.00 O ATOM 276 CB ASP A 20 -1.981 10.591 -6.977 1.00 0.00 C ATOM 277 CG ASP A 20 -1.193 11.860 -6.717 1.00 0.00 C ATOM 278 OD1 ASP A 20 0.054 11.794 -6.715 1.00 0.00 O ATOM 279 OD2 ASP A 20 -1.824 12.919 -6.513 1.00 0.00 O ATOM 0 H ASP A 20 -1.865 8.096 -7.204 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.994 9.712 -5.284 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.571 10.085 -7.851 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.013 10.850 -7.213 1.00 0.00 H new ATOM 284 N GLU A 21 -4.292 10.053 -5.262 1.00 0.00 N ATOM 285 CA GLU A 21 -5.424 10.409 -4.414 1.00 0.00 C ATOM 286 C GLU A 21 -5.526 9.465 -3.220 1.00 0.00 C ATOM 287 O GLU A 21 -5.622 9.904 -2.074 1.00 0.00 O ATOM 288 CB GLU A 21 -6.724 10.372 -5.220 1.00 0.00 C ATOM 289 CG GLU A 21 -7.028 11.672 -5.945 1.00 0.00 C ATOM 290 CD GLU A 21 -7.469 12.776 -5.003 1.00 0.00 C ATOM 291 OE1 GLU A 21 -6.930 12.848 -3.879 1.00 0.00 O ATOM 292 OE2 GLU A 21 -8.354 13.567 -5.391 1.00 0.00 O ATOM 0 H GLU A 21 -4.539 9.838 -6.228 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.264 11.421 -4.043 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.666 9.564 -5.949 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.551 10.138 -4.549 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.141 11.996 -6.489 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.809 11.497 -6.685 1.00 0.00 H new ATOM 299 N ALA A 22 -5.504 8.165 -3.496 1.00 0.00 N ATOM 300 CA ALA A 22 -5.593 7.159 -2.446 1.00 0.00 C ATOM 301 C ALA A 22 -4.704 7.522 -1.261 1.00 0.00 C ATOM 302 O ALA A 22 -5.125 7.436 -0.107 1.00 0.00 O ATOM 303 CB ALA A 22 -5.213 5.790 -2.992 1.00 0.00 C ATOM 0 H ALA A 22 -5.425 7.784 -4.439 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.625 7.125 -2.097 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.284 5.048 -2.196 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.891 5.520 -3.801 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.191 5.820 -3.370 1.00 0.00 H new ATOM 309 N LEU A 23 -3.473 7.928 -1.554 1.00 0.00 N ATOM 310 CA LEU A 23 -2.524 8.304 -0.512 1.00 0.00 C ATOM 311 C LEU A 23 -2.973 9.576 0.201 1.00 0.00 C ATOM 312 O LEU A 23 -3.016 9.629 1.430 1.00 0.00 O ATOM 313 CB LEU A 23 -1.132 8.507 -1.112 1.00 0.00 C ATOM 314 CG LEU A 23 -0.623 7.388 -2.021 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.419 7.921 -2.992 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.049 6.248 -1.193 1.00 0.00 C ATOM 0 H LEU A 23 -3.109 8.005 -2.504 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.484 7.495 0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.136 9.437 -1.681 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.422 8.636 -0.295 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.464 7.004 -2.598 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.770 7.110 -3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.024 8.703 -3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.260 8.333 -2.434 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.308 5.461 -1.856 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.780 6.618 -0.590 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.824 5.848 -0.539 1.00 0.00 H new ATOM 328 N LYS A 24 -3.310 10.597 -0.579 1.00 0.00 N ATOM 329 CA LYS A 24 -3.760 11.868 -0.024 1.00 0.00 C ATOM 330 C LYS A 24 -4.558 11.650 1.257 1.00 0.00 C ATOM 331 O LYS A 24 -4.165 12.109 2.330 1.00 0.00 O ATOM 332 CB LYS A 24 -4.613 12.622 -1.047 1.00 0.00 C ATOM 333 CG LYS A 24 -3.869 12.963 -2.326 1.00 0.00 C ATOM 334 CD LYS A 24 -3.124 14.282 -2.203 1.00 0.00 C ATOM 335 CE LYS A 24 -1.914 14.327 -3.122 1.00 0.00 C ATOM 336 NZ LYS A 24 -0.786 13.509 -2.595 1.00 0.00 N ATOM 0 H LYS A 24 -3.280 10.569 -1.598 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.879 12.464 0.214 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.486 12.019 -1.295 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.980 13.543 -0.594 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.163 12.166 -2.561 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.575 13.019 -3.155 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -3.797 15.105 -2.445 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.804 14.425 -1.171 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.195 13.964 -4.111 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -1.588 15.360 -3.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.075 13.710 -3.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.623 13.745 -1.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.021 12.499 -2.678 1.00 0.00 H new ATOM 350 N ASP A 25 -5.679 10.947 1.138 1.00 0.00 N ATOM 351 CA ASP A 25 -6.531 10.666 2.288 1.00 0.00 C ATOM 352 C ASP A 25 -5.852 9.687 3.241 1.00 0.00 C ATOM 353 O ASP A 25 -5.178 8.745 2.825 1.00 0.00 O ATOM 354 CB ASP A 25 -7.875 10.099 1.827 1.00 0.00 C ATOM 355 CG ASP A 25 -8.827 9.856 2.981 1.00 0.00 C ATOM 356 OD1 ASP A 25 -9.571 10.791 3.345 1.00 0.00 O ATOM 357 OD2 ASP A 25 -8.829 8.730 3.521 1.00 0.00 O ATOM 0 H ASP A 25 -6.019 10.561 0.257 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.703 11.602 2.819 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.334 10.790 1.120 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.708 9.163 1.294 1.00 0.00 H new ATOM 362 N PRO A 26 -6.033 9.914 4.551 1.00 0.00 N ATOM 363 CA PRO A 26 -5.445 9.064 5.590 1.00 0.00 C ATOM 364 C PRO A 26 -6.089 7.682 5.641 1.00 0.00 C ATOM 365 O PRO A 26 -5.398 6.667 5.727 1.00 0.00 O ATOM 366 CB PRO A 26 -5.730 9.834 6.882 1.00 0.00 C ATOM 367 CG PRO A 26 -6.931 10.659 6.573 1.00 0.00 C ATOM 368 CD PRO A 26 -6.825 11.019 5.117 1.00 0.00 C ATOM 0 HA PRO A 26 -4.386 8.878 5.413 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.919 9.156 7.714 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.883 10.458 7.166 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.847 10.103 6.771 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.960 11.554 7.195 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.806 11.092 4.648 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.332 11.981 4.975 1.00 0.00 H new ATOM 376 N VAL A 27 -7.417 7.651 5.587 1.00 0.00 N ATOM 377 CA VAL A 27 -8.154 6.394 5.626 1.00 0.00 C ATOM 378 C VAL A 27 -7.863 5.548 4.391 1.00 0.00 C ATOM 379 O VAL A 27 -7.637 4.343 4.491 1.00 0.00 O ATOM 380 CB VAL A 27 -9.672 6.636 5.722 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.433 5.328 5.566 1.00 0.00 C ATOM 382 CG2 VAL A 27 -10.021 7.310 7.040 1.00 0.00 C ATOM 0 H VAL A 27 -8.004 8.482 5.516 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.822 5.860 6.516 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.968 7.300 4.910 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.504 5.519 5.637 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.206 4.889 4.595 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.135 4.637 6.355 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.097 7.474 7.091 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.711 6.672 7.868 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.505 8.268 7.107 1.00 0.00 H new ATOM 392 N GLY A 28 -7.870 6.189 3.226 1.00 0.00 N ATOM 393 CA GLY A 28 -7.605 5.480 1.988 1.00 0.00 C ATOM 394 C GLY A 28 -6.266 4.770 2.001 1.00 0.00 C ATOM 395 O GLY A 28 -6.094 3.742 1.347 1.00 0.00 O ATOM 0 H GLY A 28 -8.054 7.186 3.118 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.397 4.752 1.813 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.631 6.185 1.157 1.00 0.00 H new ATOM 399 N ARG A 29 -5.313 5.321 2.747 1.00 0.00 N ATOM 400 CA ARG A 29 -3.981 4.736 2.840 1.00 0.00 C ATOM 401 C ARG A 29 -4.036 3.363 3.503 1.00 0.00 C ATOM 402 O ARG A 29 -3.466 2.396 2.998 1.00 0.00 O ATOM 403 CB ARG A 29 -3.050 5.658 3.629 1.00 0.00 C ATOM 404 CG ARG A 29 -2.360 6.706 2.771 1.00 0.00 C ATOM 405 CD ARG A 29 -1.418 7.569 3.595 1.00 0.00 C ATOM 406 NE ARG A 29 -2.097 8.729 4.166 1.00 0.00 N ATOM 407 CZ ARG A 29 -1.651 9.392 5.227 1.00 0.00 C ATOM 408 NH1 ARG A 29 -0.532 9.013 5.829 1.00 0.00 N ATOM 409 NH2 ARG A 29 -2.324 10.438 5.689 1.00 0.00 N ATOM 0 H ARG A 29 -5.439 6.172 3.296 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.592 4.617 1.829 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.624 6.159 4.408 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.293 5.054 4.129 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.802 6.215 1.974 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.109 7.337 2.293 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.986 6.970 4.397 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.592 7.905 2.968 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.961 9.047 3.726 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.011 8.210 5.478 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.193 9.525 6.644 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -3.185 10.734 5.229 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.980 10.946 6.504 1.00 0.00 H new ATOM 423 N GLU A 30 -4.726 3.286 4.637 1.00 0.00 N ATOM 424 CA GLU A 30 -4.854 2.031 5.369 1.00 0.00 C ATOM 425 C GLU A 30 -5.808 1.079 4.654 1.00 0.00 C ATOM 426 O GLU A 30 -5.549 -0.121 4.563 1.00 0.00 O ATOM 427 CB GLU A 30 -5.349 2.294 6.793 1.00 0.00 C ATOM 428 CG GLU A 30 -6.863 2.333 6.913 1.00 0.00 C ATOM 429 CD GLU A 30 -7.330 2.610 8.329 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.557 3.218 9.099 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.466 2.218 8.667 1.00 0.00 O ATOM 0 H GLU A 30 -5.204 4.077 5.068 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.870 1.564 5.415 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.960 1.518 7.453 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.941 3.243 7.141 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.257 3.102 6.248 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.275 1.381 6.579 1.00 0.00 H new ATOM 438 N GLN A 31 -6.911 1.623 4.151 1.00 0.00 N ATOM 439 CA GLN A 31 -7.905 0.822 3.446 1.00 0.00 C ATOM 440 C GLN A 31 -7.280 0.109 2.251 1.00 0.00 C ATOM 441 O GLN A 31 -7.308 -1.119 2.164 1.00 0.00 O ATOM 442 CB GLN A 31 -9.064 1.704 2.980 1.00 0.00 C ATOM 443 CG GLN A 31 -10.108 1.955 4.056 1.00 0.00 C ATOM 444 CD GLN A 31 -10.647 0.672 4.657 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.325 -0.106 3.984 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.349 0.443 5.930 1.00 0.00 N ATOM 0 H GLN A 31 -7.139 2.615 4.218 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.286 0.070 4.137 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.668 2.661 2.640 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.545 1.235 2.122 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.671 2.566 4.846 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.933 2.527 3.630 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.784 1.114 6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.685 -0.404 6.388 1.00 0.00 H new ATOM 455 N PHE A 32 -6.717 0.886 1.332 1.00 0.00 N ATOM 456 CA PHE A 32 -6.087 0.329 0.141 1.00 0.00 C ATOM 457 C PHE A 32 -5.025 -0.700 0.519 1.00 0.00 C ATOM 458 O PHE A 32 -4.811 -1.679 -0.197 1.00 0.00 O ATOM 459 CB PHE A 32 -5.457 1.443 -0.697 1.00 0.00 C ATOM 460 CG PHE A 32 -4.466 0.945 -1.710 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.879 0.164 -2.777 1.00 0.00 C ATOM 462 CD2 PHE A 32 -3.121 1.257 -1.594 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.969 -0.297 -3.709 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.206 0.799 -2.524 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.631 0.022 -3.583 1.00 0.00 C ATOM 0 H PHE A 32 -6.684 1.904 1.389 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.857 -0.168 -0.448 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.247 1.990 -1.212 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.961 2.150 -0.032 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.924 -0.087 -2.882 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.783 1.865 -0.768 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.304 -0.906 -4.535 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.160 1.049 -2.422 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.919 -0.336 -4.312 1.00 0.00 H new ATOM 475 N LEU A 33 -4.363 -0.472 1.648 1.00 0.00 N ATOM 476 CA LEU A 33 -3.323 -1.378 2.122 1.00 0.00 C ATOM 477 C LEU A 33 -3.911 -2.736 2.490 1.00 0.00 C ATOM 478 O LEU A 33 -3.486 -3.770 1.974 1.00 0.00 O ATOM 479 CB LEU A 33 -2.606 -0.775 3.331 1.00 0.00 C ATOM 480 CG LEU A 33 -1.853 -1.761 4.225 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.428 -1.950 3.728 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.857 -1.281 5.669 1.00 0.00 C ATOM 0 H LEU A 33 -4.528 0.333 2.252 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.604 -1.521 1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.899 -0.027 2.973 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.342 -0.251 3.941 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.362 -2.724 4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.093 -2.655 4.376 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.446 -2.339 2.710 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.092 -0.992 3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.317 -1.995 6.291 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.372 -0.307 5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.885 -1.197 6.022 1.00 0.00 H new ATOM 494 N LYS A 34 -4.893 -2.727 3.385 1.00 0.00 N ATOM 495 CA LYS A 34 -5.543 -3.958 3.821 1.00 0.00 C ATOM 496 C LYS A 34 -5.637 -4.959 2.675 1.00 0.00 C ATOM 497 O LYS A 34 -5.155 -6.087 2.781 1.00 0.00 O ATOM 498 CB LYS A 34 -6.942 -3.655 4.364 1.00 0.00 C ATOM 499 CG LYS A 34 -6.945 -2.677 5.526 1.00 0.00 C ATOM 500 CD LYS A 34 -8.105 -2.939 6.471 1.00 0.00 C ATOM 501 CE LYS A 34 -8.033 -2.049 7.703 1.00 0.00 C ATOM 502 NZ LYS A 34 -9.363 -1.890 8.352 1.00 0.00 N ATOM 0 H LYS A 34 -5.257 -1.881 3.823 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.939 -4.397 4.615 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.556 -3.251 3.559 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.408 -4.587 4.683 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.005 -2.756 6.072 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.008 -1.658 5.145 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.046 -2.765 5.950 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.098 -3.985 6.776 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.329 -2.475 8.418 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -7.647 -1.069 7.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.378 -1.007 8.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -10.104 -1.857 7.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.538 -2.695 8.987 1.00 0.00 H new ATOM 516 N PHE A 35 -6.259 -4.540 1.578 1.00 0.00 N ATOM 517 CA PHE A 35 -6.415 -5.400 0.411 1.00 0.00 C ATOM 518 C PHE A 35 -5.074 -5.998 -0.007 1.00 0.00 C ATOM 519 O PHE A 35 -4.994 -7.167 -0.385 1.00 0.00 O ATOM 520 CB PHE A 35 -7.020 -4.612 -0.753 1.00 0.00 C ATOM 521 CG PHE A 35 -6.921 -5.322 -2.073 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.738 -6.405 -2.355 1.00 0.00 C ATOM 523 CD2 PHE A 35 -6.011 -4.907 -3.032 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.651 -7.061 -3.569 1.00 0.00 C ATOM 525 CE2 PHE A 35 -5.919 -5.558 -4.247 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.739 -6.637 -4.516 1.00 0.00 C ATOM 0 H PHE A 35 -6.663 -3.610 1.473 1.00 0.00 H new ATOM 0 HA PHE A 35 -7.089 -6.214 0.678 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -8.069 -4.408 -0.537 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.517 -3.648 -0.829 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.452 -6.741 -1.617 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.366 -4.065 -2.827 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.295 -7.903 -3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.206 -5.224 -4.986 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.667 -7.148 -5.465 1.00 0.00 H new ATOM 536 N LEU A 36 -4.024 -5.187 0.062 1.00 0.00 N ATOM 537 CA LEU A 36 -2.686 -5.634 -0.309 1.00 0.00 C ATOM 538 C LEU A 36 -2.270 -6.849 0.514 1.00 0.00 C ATOM 539 O LEU A 36 -2.014 -7.922 -0.031 1.00 0.00 O ATOM 540 CB LEU A 36 -1.676 -4.502 -0.115 1.00 0.00 C ATOM 541 CG LEU A 36 -1.999 -3.186 -0.824 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.853 -2.199 -0.664 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.292 -3.432 -2.297 1.00 0.00 C ATOM 0 H LEU A 36 -4.073 -4.216 0.371 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.704 -5.920 -1.361 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.584 -4.303 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.702 -4.848 -0.460 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.889 -2.756 -0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.100 -1.268 -1.175 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.690 -1.999 0.395 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.054 -2.621 -1.097 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.520 -2.485 -2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.421 -3.884 -2.771 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.146 -4.103 -2.391 1.00 0.00 H new ATOM 555 N GLU A 37 -2.206 -6.672 1.830 1.00 0.00 N ATOM 556 CA GLU A 37 -1.822 -7.755 2.728 1.00 0.00 C ATOM 557 C GLU A 37 -2.385 -9.088 2.244 1.00 0.00 C ATOM 558 O GLU A 37 -1.692 -10.106 2.253 1.00 0.00 O ATOM 559 CB GLU A 37 -2.313 -7.467 4.149 1.00 0.00 C ATOM 560 CG GLU A 37 -1.789 -6.161 4.721 1.00 0.00 C ATOM 561 CD GLU A 37 -2.449 -5.794 6.036 1.00 0.00 C ATOM 562 OE1 GLU A 37 -2.072 -6.377 7.074 1.00 0.00 O ATOM 563 OE2 GLU A 37 -3.344 -4.922 6.026 1.00 0.00 O ATOM 0 H GLU A 37 -2.415 -5.790 2.298 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.734 -7.820 2.733 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.403 -7.443 4.150 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.012 -8.286 4.802 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.712 -6.240 4.869 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.954 -5.361 4.000 1.00 0.00 H new ATOM 570 N SER A 38 -3.645 -9.074 1.823 1.00 0.00 N ATOM 571 CA SER A 38 -4.303 -10.282 1.339 1.00 0.00 C ATOM 572 C SER A 38 -3.516 -10.907 0.191 1.00 0.00 C ATOM 573 O SER A 38 -3.155 -12.083 0.240 1.00 0.00 O ATOM 574 CB SER A 38 -5.728 -9.964 0.882 1.00 0.00 C ATOM 575 OG SER A 38 -6.550 -9.612 1.981 1.00 0.00 O ATOM 0 H SER A 38 -4.231 -8.239 1.807 1.00 0.00 H new ATOM 0 HA SER A 38 -4.344 -10.998 2.160 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.708 -9.146 0.162 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.150 -10.829 0.370 1.00 0.00 H new ATOM 0 HG SER A 38 -7.455 -9.412 1.662 1.00 0.00 H new ATOM 581 N GLU A 39 -3.253 -10.111 -0.840 1.00 0.00 N ATOM 582 CA GLU A 39 -2.509 -10.586 -2.001 1.00 0.00 C ATOM 583 C GLU A 39 -1.006 -10.541 -1.740 1.00 0.00 C ATOM 584 O GLU A 39 -0.201 -10.703 -2.656 1.00 0.00 O ATOM 585 CB GLU A 39 -2.849 -9.743 -3.232 1.00 0.00 C ATOM 586 CG GLU A 39 -2.496 -8.273 -3.080 1.00 0.00 C ATOM 587 CD GLU A 39 -3.121 -7.408 -4.157 1.00 0.00 C ATOM 588 OE1 GLU A 39 -3.221 -7.877 -5.310 1.00 0.00 O ATOM 589 OE2 GLU A 39 -3.511 -6.263 -3.847 1.00 0.00 O ATOM 0 H GLU A 39 -3.544 -9.135 -0.895 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.797 -11.621 -2.187 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.321 -10.147 -4.096 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.915 -9.832 -3.440 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.826 -7.923 -2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.412 -8.158 -3.111 1.00 0.00 H new ATOM 596 N PHE A 40 -0.637 -10.320 -0.483 1.00 0.00 N ATOM 597 CA PHE A 40 0.769 -10.253 -0.100 1.00 0.00 C ATOM 598 C PHE A 40 1.507 -9.202 -0.924 1.00 0.00 C ATOM 599 O PHE A 40 2.654 -9.404 -1.323 1.00 0.00 O ATOM 600 CB PHE A 40 1.434 -11.619 -0.279 1.00 0.00 C ATOM 601 CG PHE A 40 0.580 -12.767 0.178 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.354 -13.334 -0.673 1.00 0.00 C ATOM 603 CD2 PHE A 40 0.712 -13.278 1.459 1.00 0.00 C ATOM 604 CE1 PHE A 40 -1.142 -14.390 -0.255 1.00 0.00 C ATOM 605 CE2 PHE A 40 -0.072 -14.334 1.883 1.00 0.00 C ATOM 606 CZ PHE A 40 -1.000 -14.891 1.024 1.00 0.00 C ATOM 0 H PHE A 40 -1.291 -10.184 0.288 1.00 0.00 H new ATOM 0 HA PHE A 40 0.821 -9.967 0.951 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.682 -11.758 -1.331 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.373 -11.632 0.275 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.468 -12.947 -1.675 1.00 0.00 H new ATOM 0 HD2 PHE A 40 1.436 -12.846 2.134 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.868 -14.823 -0.928 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.040 -14.723 2.884 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.613 -15.717 1.352 1.00 0.00 H new ATOM 616 N SER A 41 0.840 -8.080 -1.176 1.00 0.00 N ATOM 617 CA SER A 41 1.430 -6.999 -1.956 1.00 0.00 C ATOM 618 C SER A 41 1.564 -5.733 -1.116 1.00 0.00 C ATOM 619 O SER A 41 1.737 -4.636 -1.648 1.00 0.00 O ATOM 620 CB SER A 41 0.581 -6.714 -3.196 1.00 0.00 C ATOM 621 OG SER A 41 -0.657 -6.124 -2.841 1.00 0.00 O ATOM 0 H SER A 41 -0.109 -7.896 -0.851 1.00 0.00 H new ATOM 0 HA SER A 41 2.425 -7.313 -2.270 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.125 -6.050 -3.868 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.403 -7.642 -3.740 1.00 0.00 H new ATOM 0 HG SER A 41 -1.066 -5.720 -3.635 1.00 0.00 H new ATOM 627 N SER A 42 1.483 -5.893 0.201 1.00 0.00 N ATOM 628 CA SER A 42 1.590 -4.763 1.117 1.00 0.00 C ATOM 629 C SER A 42 3.012 -4.208 1.130 1.00 0.00 C ATOM 630 O SER A 42 3.215 -2.997 1.192 1.00 0.00 O ATOM 631 CB SER A 42 1.182 -5.184 2.530 1.00 0.00 C ATOM 632 OG SER A 42 1.382 -4.128 3.454 1.00 0.00 O ATOM 0 H SER A 42 1.344 -6.794 0.658 1.00 0.00 H new ATOM 0 HA SER A 42 0.915 -3.980 0.770 1.00 0.00 H new ATOM 0 HB2 SER A 42 0.134 -5.483 2.536 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.763 -6.054 2.836 1.00 0.00 H new ATOM 0 HG SER A 42 1.143 -4.432 4.355 1.00 0.00 H new ATOM 638 N GLU A 43 3.991 -5.106 1.072 1.00 0.00 N ATOM 639 CA GLU A 43 5.393 -4.706 1.079 1.00 0.00 C ATOM 640 C GLU A 43 5.631 -3.538 0.126 1.00 0.00 C ATOM 641 O GLU A 43 6.222 -2.527 0.502 1.00 0.00 O ATOM 642 CB GLU A 43 6.285 -5.887 0.687 1.00 0.00 C ATOM 643 CG GLU A 43 5.903 -6.525 -0.638 1.00 0.00 C ATOM 644 CD GLU A 43 6.255 -7.998 -0.699 1.00 0.00 C ATOM 645 OE1 GLU A 43 7.237 -8.401 -0.041 1.00 0.00 O ATOM 646 OE2 GLU A 43 5.550 -8.749 -1.405 1.00 0.00 O ATOM 0 H GLU A 43 3.839 -6.113 1.020 1.00 0.00 H new ATOM 0 HA GLU A 43 5.648 -4.386 2.089 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.319 -5.548 0.632 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.238 -6.643 1.471 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.832 -6.404 -0.800 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.409 -6.001 -1.449 1.00 0.00 H new ATOM 653 N ASN A 44 5.165 -3.686 -1.110 1.00 0.00 N ATOM 654 CA ASN A 44 5.327 -2.645 -2.118 1.00 0.00 C ATOM 655 C ASN A 44 5.006 -1.271 -1.537 1.00 0.00 C ATOM 656 O ASN A 44 5.720 -0.298 -1.785 1.00 0.00 O ATOM 657 CB ASN A 44 4.425 -2.925 -3.321 1.00 0.00 C ATOM 658 CG ASN A 44 4.844 -4.169 -4.080 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.691 -4.935 -3.620 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.250 -4.377 -5.250 1.00 0.00 N ATOM 0 H ASN A 44 4.672 -4.517 -1.437 1.00 0.00 H new ATOM 0 HA ASN A 44 6.367 -2.649 -2.444 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.396 -3.039 -2.981 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.445 -2.068 -3.994 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.491 -5.198 -5.805 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.553 -3.716 -5.593 1.00 0.00 H new ATOM 667 N LEU A 45 3.929 -1.199 -0.762 1.00 0.00 N ATOM 668 CA LEU A 45 3.514 0.055 -0.144 1.00 0.00 C ATOM 669 C LEU A 45 4.329 0.339 1.113 1.00 0.00 C ATOM 670 O LEU A 45 4.858 1.437 1.287 1.00 0.00 O ATOM 671 CB LEU A 45 2.024 0.008 0.199 1.00 0.00 C ATOM 672 CG LEU A 45 1.445 1.265 0.850 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.515 2.443 -0.110 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.010 1.022 1.295 1.00 0.00 C ATOM 0 H LEU A 45 3.328 -1.994 -0.547 1.00 0.00 H new ATOM 0 HA LEU A 45 3.691 0.860 -0.858 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.467 -0.192 -0.716 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.852 -0.835 0.868 1.00 0.00 H new ATOM 0 HG LEU A 45 2.042 1.504 1.730 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.099 3.329 0.370 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.554 2.631 -0.380 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.942 2.214 -1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.386 1.927 1.756 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.599 0.759 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.014 0.206 2.018 1.00 0.00 H new ATOM 686 N ARG A 46 4.426 -0.658 1.986 1.00 0.00 N ATOM 687 CA ARG A 46 5.178 -0.515 3.228 1.00 0.00 C ATOM 688 C ARG A 46 6.503 0.201 2.982 1.00 0.00 C ATOM 689 O ARG A 46 6.862 1.129 3.706 1.00 0.00 O ATOM 690 CB ARG A 46 5.436 -1.888 3.853 1.00 0.00 C ATOM 691 CG ARG A 46 4.216 -2.486 4.534 1.00 0.00 C ATOM 692 CD ARG A 46 4.143 -2.086 5.999 1.00 0.00 C ATOM 693 NE ARG A 46 3.964 -0.646 6.166 1.00 0.00 N ATOM 694 CZ ARG A 46 2.918 -0.102 6.776 1.00 0.00 C ATOM 695 NH1 ARG A 46 1.962 -0.873 7.276 1.00 0.00 N ATOM 696 NH2 ARG A 46 2.826 1.217 6.889 1.00 0.00 N ATOM 0 H ARG A 46 3.994 -1.573 1.857 1.00 0.00 H new ATOM 0 HA ARG A 46 4.583 0.085 3.917 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.780 -2.572 3.077 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.242 -1.801 4.582 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.313 -2.156 4.020 1.00 0.00 H new ATOM 0 HG3 ARG A 46 4.249 -3.573 4.454 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.317 -2.612 6.477 1.00 0.00 H new ATOM 0 HD3 ARG A 46 5.056 -2.399 6.506 1.00 0.00 H new ATOM 0 HE ARG A 46 4.682 -0.024 5.794 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.029 -1.887 7.193 1.00 0.00 H new ATOM 0 HH12 ARG A 46 1.160 -0.452 7.744 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.559 1.814 6.507 1.00 0.00 H new ATOM 0 HH22 ARG A 46 2.022 1.634 7.358 1.00 0.00 H new ATOM 710 N PHE A 47 7.225 -0.238 1.956 1.00 0.00 N ATOM 711 CA PHE A 47 8.511 0.360 1.615 1.00 0.00 C ATOM 712 C PHE A 47 8.335 1.808 1.165 1.00 0.00 C ATOM 713 O PHE A 47 9.100 2.688 1.559 1.00 0.00 O ATOM 714 CB PHE A 47 9.197 -0.449 0.513 1.00 0.00 C ATOM 715 CG PHE A 47 10.108 0.372 -0.355 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.095 1.164 0.209 1.00 0.00 C ATOM 717 CD2 PHE A 47 9.976 0.351 -1.734 1.00 0.00 C ATOM 718 CE1 PHE A 47 11.933 1.921 -0.588 1.00 0.00 C ATOM 719 CE2 PHE A 47 10.812 1.106 -2.535 1.00 0.00 C ATOM 720 CZ PHE A 47 11.793 1.891 -1.961 1.00 0.00 C ATOM 0 H PHE A 47 6.942 -1.005 1.347 1.00 0.00 H new ATOM 0 HA PHE A 47 9.137 0.349 2.507 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.772 -1.255 0.969 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.435 -0.915 -0.112 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.211 1.190 1.282 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.212 -0.262 -2.188 1.00 0.00 H new ATOM 0 HE1 PHE A 47 12.697 2.536 -0.137 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.698 1.082 -3.609 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.449 2.480 -2.585 1.00 0.00 H new ATOM 730 N TRP A 48 7.324 2.045 0.337 1.00 0.00 N ATOM 731 CA TRP A 48 7.048 3.385 -0.168 1.00 0.00 C ATOM 732 C TRP A 48 6.818 4.362 0.979 1.00 0.00 C ATOM 733 O TRP A 48 7.418 5.437 1.023 1.00 0.00 O ATOM 734 CB TRP A 48 5.828 3.364 -1.089 1.00 0.00 C ATOM 735 CG TRP A 48 5.703 4.592 -1.939 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.371 4.855 -3.101 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.862 5.724 -1.692 1.00 0.00 C ATOM 738 NE1 TRP A 48 5.995 6.083 -3.591 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.070 6.635 -2.746 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.953 6.055 -0.684 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.402 7.855 -2.817 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.290 7.266 -0.757 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.517 8.153 -1.817 1.00 0.00 C ATOM 0 H TRP A 48 6.682 1.327 0.001 1.00 0.00 H new ATOM 0 HA TRP A 48 7.917 3.718 -0.736 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.885 2.488 -1.735 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.927 3.256 -0.484 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.089 4.195 -3.566 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.348 6.513 -4.446 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.772 5.377 0.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.576 8.541 -3.632 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.585 7.533 0.017 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.983 9.091 -1.846 1.00 0.00 H new ATOM 754 N LEU A 49 5.945 3.984 1.907 1.00 0.00 N ATOM 755 CA LEU A 49 5.636 4.828 3.056 1.00 0.00 C ATOM 756 C LEU A 49 6.859 4.997 3.953 1.00 0.00 C ATOM 757 O LEU A 49 7.247 6.116 4.285 1.00 0.00 O ATOM 758 CB LEU A 49 4.480 4.227 3.858 1.00 0.00 C ATOM 759 CG LEU A 49 3.115 4.226 3.170 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.132 3.354 3.936 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.582 5.646 3.040 1.00 0.00 C ATOM 0 H LEU A 49 5.439 3.099 1.886 1.00 0.00 H new ATOM 0 HA LEU A 49 5.342 5.810 2.686 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.737 3.199 4.113 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.391 4.775 4.796 1.00 0.00 H new ATOM 0 HG LEU A 49 3.234 3.811 2.169 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.166 3.365 3.432 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.508 2.332 3.977 1.00 0.00 H new ATOM 0 HD13 LEU A 49 2.017 3.739 4.949 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.610 5.626 2.548 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.478 6.088 4.031 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.276 6.242 2.448 1.00 0.00 H new ATOM 773 N ALA A 50 7.462 3.877 4.339 1.00 0.00 N ATOM 774 CA ALA A 50 8.642 3.901 5.193 1.00 0.00 C ATOM 775 C ALA A 50 9.574 5.047 4.810 1.00 0.00 C ATOM 776 O ALA A 50 10.062 5.778 5.672 1.00 0.00 O ATOM 777 CB ALA A 50 9.378 2.572 5.115 1.00 0.00 C ATOM 0 H ALA A 50 7.152 2.942 4.073 1.00 0.00 H new ATOM 0 HA ALA A 50 8.313 4.062 6.220 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.257 2.605 5.758 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.717 1.770 5.444 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.688 2.387 4.086 1.00 0.00 H new ATOM 783 N VAL A 51 9.817 5.197 3.512 1.00 0.00 N ATOM 784 CA VAL A 51 10.690 6.254 3.015 1.00 0.00 C ATOM 785 C VAL A 51 10.126 7.631 3.344 1.00 0.00 C ATOM 786 O VAL A 51 10.807 8.464 3.941 1.00 0.00 O ATOM 787 CB VAL A 51 10.892 6.144 1.492 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.747 7.295 0.983 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.517 4.805 1.133 1.00 0.00 C ATOM 0 H VAL A 51 9.422 4.600 2.786 1.00 0.00 H new ATOM 0 HA VAL A 51 11.652 6.131 3.511 1.00 0.00 H new ATOM 0 HB VAL A 51 9.917 6.205 1.008 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.879 7.201 -0.095 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.254 8.241 1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.721 7.269 1.472 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.652 4.745 0.053 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.485 4.711 1.626 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.862 3.998 1.462 1.00 0.00 H new ATOM 799 N GLU A 52 8.878 7.864 2.950 1.00 0.00 N ATOM 800 CA GLU A 52 8.224 9.142 3.203 1.00 0.00 C ATOM 801 C GLU A 52 8.451 9.594 4.643 1.00 0.00 C ATOM 802 O GLU A 52 8.621 10.783 4.913 1.00 0.00 O ATOM 803 CB GLU A 52 6.724 9.038 2.921 1.00 0.00 C ATOM 804 CG GLU A 52 6.376 9.114 1.444 1.00 0.00 C ATOM 805 CD GLU A 52 6.481 10.522 0.891 1.00 0.00 C ATOM 806 OE1 GLU A 52 7.436 11.235 1.264 1.00 0.00 O ATOM 807 OE2 GLU A 52 5.609 10.911 0.086 1.00 0.00 O ATOM 0 H GLU A 52 8.300 7.185 2.455 1.00 0.00 H new ATOM 0 HA GLU A 52 8.662 9.883 2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.351 8.097 3.326 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.207 9.839 3.449 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.041 8.457 0.884 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.362 8.744 1.294 1.00 0.00 H new ATOM 814 N ASP A 53 8.451 8.636 5.564 1.00 0.00 N ATOM 815 CA ASP A 53 8.658 8.934 6.977 1.00 0.00 C ATOM 816 C ASP A 53 10.145 9.037 7.298 1.00 0.00 C ATOM 817 O ASP A 53 10.571 9.925 8.039 1.00 0.00 O ATOM 818 CB ASP A 53 8.009 7.857 7.847 1.00 0.00 C ATOM 819 CG ASP A 53 7.852 8.295 9.290 1.00 0.00 C ATOM 820 OD1 ASP A 53 7.115 9.272 9.536 1.00 0.00 O ATOM 821 OD2 ASP A 53 8.467 7.661 10.173 1.00 0.00 O ATOM 0 H ASP A 53 8.310 7.647 5.358 1.00 0.00 H new ATOM 0 HA ASP A 53 8.191 9.895 7.193 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.030 7.605 7.438 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.613 6.951 7.809 1.00 0.00 H new ATOM 826 N LEU A 54 10.931 8.125 6.738 1.00 0.00 N ATOM 827 CA LEU A 54 12.372 8.112 6.966 1.00 0.00 C ATOM 828 C LEU A 54 12.905 9.528 7.161 1.00 0.00 C ATOM 829 O LEU A 54 13.399 9.875 8.234 1.00 0.00 O ATOM 830 CB LEU A 54 13.088 7.442 5.792 1.00 0.00 C ATOM 831 CG LEU A 54 14.612 7.571 5.773 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.220 6.893 6.991 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.181 6.980 4.492 1.00 0.00 C ATOM 0 H LEU A 54 10.595 7.384 6.122 1.00 0.00 H new ATOM 0 HA LEU A 54 12.566 7.542 7.875 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.833 6.382 5.794 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.696 7.862 4.866 1.00 0.00 H new ATOM 0 HG LEU A 54 14.868 8.630 5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.305 6.995 6.961 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.837 7.362 7.897 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.955 5.836 6.989 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.266 7.081 4.496 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.914 5.925 4.428 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.770 7.510 3.633 1.00 0.00 H new ATOM 845 N LYS A 55 12.800 10.343 6.117 1.00 0.00 N ATOM 846 CA LYS A 55 13.268 11.723 6.172 1.00 0.00 C ATOM 847 C LYS A 55 12.771 12.415 7.438 1.00 0.00 C ATOM 848 O LYS A 55 13.516 13.145 8.092 1.00 0.00 O ATOM 849 CB LYS A 55 12.795 12.494 4.938 1.00 0.00 C ATOM 850 CG LYS A 55 11.284 12.519 4.779 1.00 0.00 C ATOM 851 CD LYS A 55 10.877 13.003 3.397 1.00 0.00 C ATOM 852 CE LYS A 55 10.849 11.861 2.393 1.00 0.00 C ATOM 853 NZ LYS A 55 11.168 12.327 1.014 1.00 0.00 N ATOM 0 H LYS A 55 12.394 10.071 5.221 1.00 0.00 H new ATOM 0 HA LYS A 55 14.358 11.710 6.189 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.163 13.518 4.997 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.238 12.047 4.048 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.883 11.520 4.948 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.848 13.170 5.537 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.893 13.468 3.448 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.574 13.769 3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.565 11.096 2.693 1.00 0.00 H new ATOM 0 HE3 LYS A 55 9.864 11.395 2.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.139 11.520 0.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.470 13.038 0.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.119 12.749 1.001 1.00 0.00 H new ATOM 867 N LYS A 56 11.508 12.180 7.779 1.00 0.00 N ATOM 868 CA LYS A 56 10.912 12.778 8.967 1.00 0.00 C ATOM 869 C LYS A 56 11.716 12.426 10.215 1.00 0.00 C ATOM 870 O LYS A 56 11.926 13.269 11.088 1.00 0.00 O ATOM 871 CB LYS A 56 9.466 12.306 9.130 1.00 0.00 C ATOM 872 CG LYS A 56 8.610 12.531 7.895 1.00 0.00 C ATOM 873 CD LYS A 56 8.245 13.997 7.728 1.00 0.00 C ATOM 874 CE LYS A 56 9.196 14.703 6.774 1.00 0.00 C ATOM 875 NZ LYS A 56 8.816 16.128 6.566 1.00 0.00 N ATOM 0 H LYS A 56 10.877 11.579 7.248 1.00 0.00 H new ATOM 0 HA LYS A 56 10.923 13.861 8.842 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.465 11.244 9.374 1.00 0.00 H new ATOM 0 HB3 LYS A 56 9.015 12.828 9.974 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.147 12.186 7.011 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.700 11.935 7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.225 14.079 7.353 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.268 14.492 8.699 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.211 14.652 7.169 1.00 0.00 H new ATOM 0 HE3 LYS A 56 9.200 14.184 5.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 9.488 16.574 5.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.857 16.177 6.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 8.837 16.629 7.477 1.00 0.00 H new ATOM 889 N ARG A 57 12.165 11.178 10.291 1.00 0.00 N ATOM 890 CA ARG A 57 12.946 10.715 11.432 1.00 0.00 C ATOM 891 C ARG A 57 14.147 11.625 11.674 1.00 0.00 C ATOM 892 O ARG A 57 14.696 12.227 10.751 1.00 0.00 O ATOM 893 CB ARG A 57 13.419 9.278 11.205 1.00 0.00 C ATOM 894 CG ARG A 57 12.300 8.251 11.269 1.00 0.00 C ATOM 895 CD ARG A 57 11.715 8.151 12.669 1.00 0.00 C ATOM 896 NE ARG A 57 10.593 9.067 12.860 1.00 0.00 N ATOM 897 CZ ARG A 57 9.638 8.880 13.764 1.00 0.00 C ATOM 898 NH1 ARG A 57 9.669 7.817 14.556 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.650 9.758 13.878 1.00 0.00 N ATOM 0 H ARG A 57 12.002 10.469 9.576 1.00 0.00 H new ATOM 0 HA ARG A 57 12.306 10.744 12.314 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.904 9.214 10.231 1.00 0.00 H new ATOM 0 HB3 ARG A 57 14.172 9.030 11.953 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.515 8.523 10.564 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.681 7.277 10.962 1.00 0.00 H new ATOM 0 HD2 ARG A 57 11.384 7.129 12.851 1.00 0.00 H new ATOM 0 HD3 ARG A 57 12.491 8.370 13.403 1.00 0.00 H new ATOM 0 HE ARG A 57 10.540 9.895 12.267 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.428 7.140 14.472 1.00 0.00 H new ATOM 0 HH12 ARG A 57 8.934 7.676 15.249 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.623 10.577 13.271 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.917 9.614 14.572 1.00 0.00 H new ATOM 913 N PRO A 58 14.565 11.728 12.944 1.00 0.00 N ATOM 914 CA PRO A 58 15.705 12.562 13.336 1.00 0.00 C ATOM 915 C PRO A 58 17.033 11.999 12.842 1.00 0.00 C ATOM 916 O PRO A 58 17.109 10.846 12.417 1.00 0.00 O ATOM 917 CB PRO A 58 15.651 12.540 14.866 1.00 0.00 C ATOM 918 CG PRO A 58 14.950 11.269 15.201 1.00 0.00 C ATOM 919 CD PRO A 58 13.958 11.039 14.095 1.00 0.00 C ATOM 0 HA PRO A 58 15.644 13.562 12.908 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.651 12.566 15.298 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.113 13.404 15.256 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.655 10.441 15.271 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.448 11.343 16.166 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.815 9.977 13.898 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.980 11.452 14.340 1.00 0.00 H new ATOM 927 N ILE A 59 18.077 12.820 12.900 1.00 0.00 N ATOM 928 CA ILE A 59 19.402 12.402 12.459 1.00 0.00 C ATOM 929 C ILE A 59 19.866 11.161 13.214 1.00 0.00 C ATOM 930 O ILE A 59 20.603 10.334 12.677 1.00 0.00 O ATOM 931 CB ILE A 59 20.439 13.524 12.652 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.706 13.220 11.849 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.768 13.694 14.127 1.00 0.00 C ATOM 934 CD1 ILE A 59 22.486 12.036 12.376 1.00 0.00 C ATOM 0 H ILE A 59 18.031 13.778 13.248 1.00 0.00 H new ATOM 0 HA ILE A 59 19.323 12.170 11.397 1.00 0.00 H new ATOM 0 HB ILE A 59 20.014 14.458 12.285 1.00 0.00 H new ATOM 0 HG12 ILE A 59 21.432 13.031 10.811 1.00 0.00 H new ATOM 0 HG13 ILE A 59 22.349 14.100 11.854 1.00 0.00 H new ATOM 0 HG21 ILE A 59 21.502 14.491 14.247 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.861 13.951 14.675 1.00 0.00 H new ATOM 0 HG23 ILE A 59 21.177 12.762 14.518 1.00 0.00 H new ATOM 0 HD11 ILE A 59 23.371 11.879 11.759 1.00 0.00 H new ATOM 0 HD12 ILE A 59 22.791 12.230 13.404 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.859 11.145 12.345 1.00 0.00 H new ATOM 946 N LYS A 60 19.428 11.036 14.462 1.00 0.00 N ATOM 947 CA LYS A 60 19.795 9.894 15.291 1.00 0.00 C ATOM 948 C LYS A 60 19.141 8.616 14.778 1.00 0.00 C ATOM 949 O LYS A 60 19.694 7.526 14.918 1.00 0.00 O ATOM 950 CB LYS A 60 19.386 10.141 16.745 1.00 0.00 C ATOM 951 CG LYS A 60 17.889 10.312 16.935 1.00 0.00 C ATOM 952 CD LYS A 60 17.536 10.567 18.391 1.00 0.00 C ATOM 953 CE LYS A 60 17.483 12.056 18.698 1.00 0.00 C ATOM 954 NZ LYS A 60 18.844 12.651 18.799 1.00 0.00 N ATOM 0 H LYS A 60 18.818 11.712 14.922 1.00 0.00 H new ATOM 0 HA LYS A 60 20.877 9.773 15.240 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.728 9.306 17.357 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.894 11.033 17.110 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.536 11.143 16.324 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.373 9.418 16.586 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.571 10.113 18.618 1.00 0.00 H new ATOM 0 HD3 LYS A 60 18.273 10.087 19.035 1.00 0.00 H new ATOM 0 HE2 LYS A 60 16.920 12.568 17.917 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.947 12.215 19.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.849 13.383 19.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.530 11.909 19.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 19.105 13.078 17.887 1.00 0.00 H new ATOM 968 N GLU A 61 17.961 8.758 14.182 1.00 0.00 N ATOM 969 CA GLU A 61 17.233 7.614 13.647 1.00 0.00 C ATOM 970 C GLU A 61 17.128 7.697 12.127 1.00 0.00 C ATOM 971 O GLU A 61 16.391 6.935 11.502 1.00 0.00 O ATOM 972 CB GLU A 61 15.834 7.539 14.263 1.00 0.00 C ATOM 973 CG GLU A 61 15.824 7.019 15.690 1.00 0.00 C ATOM 974 CD GLU A 61 14.427 6.696 16.184 1.00 0.00 C ATOM 975 OE1 GLU A 61 13.470 7.359 15.731 1.00 0.00 O ATOM 976 OE2 GLU A 61 14.290 5.782 17.023 1.00 0.00 O ATOM 0 H GLU A 61 17.489 9.654 14.058 1.00 0.00 H new ATOM 0 HA GLU A 61 17.786 6.711 13.906 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.384 8.532 14.244 1.00 0.00 H new ATOM 0 HB3 GLU A 61 15.209 6.894 13.646 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.443 6.124 15.751 1.00 0.00 H new ATOM 0 HG3 GLU A 61 16.275 7.763 16.347 1.00 0.00 H new ATOM 983 N VAL A 62 17.871 8.629 11.539 1.00 0.00 N ATOM 984 CA VAL A 62 17.864 8.813 10.093 1.00 0.00 C ATOM 985 C VAL A 62 18.619 7.690 9.392 1.00 0.00 C ATOM 986 O VAL A 62 18.076 6.974 8.550 1.00 0.00 O ATOM 987 CB VAL A 62 18.489 10.164 9.695 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.195 10.051 8.353 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.426 11.252 9.658 1.00 0.00 C ATOM 0 H VAL A 62 18.486 9.269 12.042 1.00 0.00 H new ATOM 0 HA VAL A 62 16.821 8.797 9.778 1.00 0.00 H new ATOM 0 HB VAL A 62 19.230 10.437 10.446 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.630 11.015 8.088 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.984 9.302 8.419 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.477 9.755 7.588 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.885 12.199 9.375 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.660 10.988 8.929 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.971 11.349 10.643 1.00 0.00 H new ATOM 999 N PRO A 63 19.903 7.529 9.746 1.00 0.00 N ATOM 1000 CA PRO A 63 20.761 6.493 9.164 1.00 0.00 C ATOM 1001 C PRO A 63 20.361 5.091 9.609 1.00 0.00 C ATOM 1002 O PRO A 63 20.171 4.198 8.783 1.00 0.00 O ATOM 1003 CB PRO A 63 22.153 6.846 9.695 1.00 0.00 C ATOM 1004 CG PRO A 63 21.898 7.592 10.959 1.00 0.00 C ATOM 1005 CD PRO A 63 20.615 8.346 10.743 1.00 0.00 C ATOM 0 HA PRO A 63 20.697 6.474 8.076 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.746 5.950 9.877 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.707 7.455 8.980 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.812 6.909 11.804 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.719 8.274 11.182 1.00 0.00 H new ATOM 0 HD2 PRO A 63 20.044 8.441 11.667 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.799 9.356 10.377 1.00 0.00 H new ATOM 1013 N SER A 64 20.233 4.905 10.919 1.00 0.00 N ATOM 1014 CA SER A 64 19.859 3.609 11.474 1.00 0.00 C ATOM 1015 C SER A 64 18.749 2.965 10.648 1.00 0.00 C ATOM 1016 O SER A 64 18.723 1.748 10.466 1.00 0.00 O ATOM 1017 CB SER A 64 19.404 3.765 12.926 1.00 0.00 C ATOM 1018 OG SER A 64 20.426 4.341 13.721 1.00 0.00 O ATOM 0 H SER A 64 20.383 5.635 11.616 1.00 0.00 H new ATOM 0 HA SER A 64 20.735 2.961 11.443 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.512 4.390 12.966 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.129 2.791 13.331 1.00 0.00 H new ATOM 0 HG SER A 64 20.110 4.432 14.644 1.00 0.00 H new ATOM 1024 N ARG A 65 17.834 3.791 10.152 1.00 0.00 N ATOM 1025 CA ARG A 65 16.720 3.303 9.347 1.00 0.00 C ATOM 1026 C ARG A 65 17.170 3.008 7.919 1.00 0.00 C ATOM 1027 O ARG A 65 16.780 2.000 7.330 1.00 0.00 O ATOM 1028 CB ARG A 65 15.585 4.329 9.334 1.00 0.00 C ATOM 1029 CG ARG A 65 14.207 3.709 9.170 1.00 0.00 C ATOM 1030 CD ARG A 65 13.597 3.342 10.514 1.00 0.00 C ATOM 1031 NE ARG A 65 12.139 3.408 10.489 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.357 2.668 11.267 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.891 1.810 12.126 1.00 0.00 N ATOM 1034 NH2 ARG A 65 10.037 2.784 11.187 1.00 0.00 N ATOM 0 H ARG A 65 17.842 4.801 10.293 1.00 0.00 H new ATOM 0 HA ARG A 65 16.359 2.377 9.794 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.610 4.898 10.263 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.755 5.036 8.522 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.552 4.408 8.651 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.280 2.818 8.547 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.910 2.335 10.791 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.977 4.017 11.281 1.00 0.00 H new ATOM 0 HE ARG A 65 11.697 4.058 9.839 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.905 1.717 12.190 1.00 0.00 H new ATOM 0 HH12 ARG A 65 11.288 1.243 12.722 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.622 3.442 10.527 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.438 2.215 11.785 1.00 0.00 H new ATOM 1048 N VAL A 66 17.994 3.894 7.368 1.00 0.00 N ATOM 1049 CA VAL A 66 18.497 3.729 6.010 1.00 0.00 C ATOM 1050 C VAL A 66 18.727 2.257 5.685 1.00 0.00 C ATOM 1051 O VAL A 66 18.038 1.683 4.843 1.00 0.00 O ATOM 1052 CB VAL A 66 19.814 4.501 5.802 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.480 4.079 4.501 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.559 6.001 5.819 1.00 0.00 C ATOM 0 H VAL A 66 18.327 4.734 7.842 1.00 0.00 H new ATOM 0 HA VAL A 66 17.738 4.132 5.340 1.00 0.00 H new ATOM 0 HB VAL A 66 20.490 4.261 6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.409 4.635 4.371 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.697 3.011 4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.812 4.288 3.666 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.499 6.532 5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.866 6.261 5.019 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.129 6.286 6.779 1.00 0.00 H new ATOM 1064 N GLN A 67 19.701 1.653 6.359 1.00 0.00 N ATOM 1065 CA GLN A 67 20.022 0.247 6.141 1.00 0.00 C ATOM 1066 C GLN A 67 18.806 -0.635 6.402 1.00 0.00 C ATOM 1067 O GLN A 67 18.504 -1.538 5.622 1.00 0.00 O ATOM 1068 CB GLN A 67 21.180 -0.179 7.045 1.00 0.00 C ATOM 1069 CG GLN A 67 20.790 -0.317 8.508 1.00 0.00 C ATOM 1070 CD GLN A 67 21.993 -0.406 9.426 1.00 0.00 C ATOM 1071 OE1 GLN A 67 23.138 -0.403 8.971 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.741 -0.485 10.727 1.00 0.00 N ATOM 0 H GLN A 67 20.281 2.115 7.060 1.00 0.00 H new ATOM 0 HA GLN A 67 20.320 0.125 5.100 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.575 -1.131 6.691 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.985 0.551 6.959 1.00 0.00 H new ATOM 0 HG2 GLN A 67 20.178 0.537 8.799 1.00 0.00 H new ATOM 0 HG3 GLN A 67 20.175 -1.208 8.634 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.777 -0.484 11.061 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.511 -0.546 11.393 1.00 0.00 H new ATOM 1081 N GLU A 68 18.112 -0.368 7.503 1.00 0.00 N ATOM 1082 CA GLU A 68 16.929 -1.140 7.866 1.00 0.00 C ATOM 1083 C GLU A 68 15.957 -1.229 6.694 1.00 0.00 C ATOM 1084 O GLU A 68 15.727 -2.308 6.145 1.00 0.00 O ATOM 1085 CB GLU A 68 16.232 -0.509 9.074 1.00 0.00 C ATOM 1086 CG GLU A 68 16.977 -0.714 10.382 1.00 0.00 C ATOM 1087 CD GLU A 68 16.793 -2.110 10.945 1.00 0.00 C ATOM 1088 OE1 GLU A 68 16.561 -3.045 10.151 1.00 0.00 O ATOM 1089 OE2 GLU A 68 16.882 -2.267 12.181 1.00 0.00 O ATOM 0 H GLU A 68 18.348 0.376 8.159 1.00 0.00 H new ATOM 0 HA GLU A 68 17.250 -2.148 8.127 1.00 0.00 H new ATOM 0 HB2 GLU A 68 16.113 0.560 8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 68 15.231 -0.930 9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 68 18.039 -0.527 10.224 1.00 0.00 H new ATOM 0 HG3 GLU A 68 16.630 0.017 11.112 1.00 0.00 H new ATOM 1096 N ILE A 69 15.388 -0.090 6.316 1.00 0.00 N ATOM 1097 CA ILE A 69 14.441 -0.039 5.208 1.00 0.00 C ATOM 1098 C ILE A 69 14.897 -0.926 4.055 1.00 0.00 C ATOM 1099 O ILE A 69 14.086 -1.595 3.415 1.00 0.00 O ATOM 1100 CB ILE A 69 14.255 1.400 4.692 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.723 2.301 5.809 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.313 1.416 3.498 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.915 3.776 5.538 1.00 0.00 C ATOM 0 H ILE A 69 15.566 0.811 6.760 1.00 0.00 H new ATOM 0 HA ILE A 69 13.488 -0.405 5.590 1.00 0.00 H new ATOM 0 HB ILE A 69 15.224 1.784 4.372 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.661 2.101 5.951 1.00 0.00 H new ATOM 0 HG13 ILE A 69 14.224 2.043 6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.191 2.440 3.144 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.729 0.803 2.698 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.343 1.017 3.794 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.515 4.354 6.371 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.978 3.990 5.425 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.391 4.049 4.622 1.00 0.00 H new ATOM 1115 N TRP A 70 16.200 -0.927 3.796 1.00 0.00 N ATOM 1116 CA TRP A 70 16.764 -1.733 2.719 1.00 0.00 C ATOM 1117 C TRP A 70 16.846 -3.201 3.124 1.00 0.00 C ATOM 1118 O TRP A 70 16.716 -4.093 2.286 1.00 0.00 O ATOM 1119 CB TRP A 70 18.154 -1.217 2.343 1.00 0.00 C ATOM 1120 CG TRP A 70 19.152 -2.312 2.115 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.657 -3.168 3.051 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.767 -2.666 0.872 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.550 -4.033 2.465 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.634 -3.746 1.128 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.669 -2.177 -0.434 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.397 -4.342 0.127 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.427 -2.769 -1.426 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.281 -3.843 -1.142 1.00 0.00 C ATOM 0 H TRP A 70 16.885 -0.379 4.317 1.00 0.00 H new ATOM 0 HA TRP A 70 16.107 -1.650 1.854 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.077 -0.611 1.440 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.518 -0.563 3.135 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.393 -3.166 4.098 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.066 -4.769 2.947 1.00 0.00 H new ATOM 0 HE3 TRP A 70 19.012 -1.351 -0.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.057 -5.169 0.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 20.360 -2.397 -2.438 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.859 -4.286 -1.940 1.00 0.00 H new ATOM 1139 N GLN A 71 17.062 -3.444 4.413 1.00 0.00 N ATOM 1140 CA GLN A 71 17.161 -4.804 4.928 1.00 0.00 C ATOM 1141 C GLN A 71 15.777 -5.402 5.157 1.00 0.00 C ATOM 1142 O GLN A 71 15.648 -6.571 5.518 1.00 0.00 O ATOM 1143 CB GLN A 71 17.960 -4.822 6.232 1.00 0.00 C ATOM 1144 CG GLN A 71 19.443 -4.554 6.041 1.00 0.00 C ATOM 1145 CD GLN A 71 20.299 -5.229 7.095 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.918 -5.309 8.263 1.00 0.00 O ATOM 1147 NE2 GLN A 71 21.464 -5.718 6.687 1.00 0.00 N ATOM 0 H GLN A 71 17.172 -2.716 5.119 1.00 0.00 H new ATOM 0 HA GLN A 71 17.680 -5.410 4.185 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.549 -4.075 6.910 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.834 -5.792 6.712 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.747 -4.902 5.054 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.620 -3.479 6.068 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.740 -5.629 5.709 1.00 0.00 H new ATOM 0 HE22 GLN A 71 22.083 -6.182 7.352 1.00 0.00 H new ATOM 1156 N GLU A 72 14.745 -4.591 4.946 1.00 0.00 N ATOM 1157 CA GLU A 72 13.370 -5.041 5.131 1.00 0.00 C ATOM 1158 C GLU A 72 12.759 -5.482 3.804 1.00 0.00 C ATOM 1159 O GLU A 72 12.143 -6.545 3.715 1.00 0.00 O ATOM 1160 CB GLU A 72 12.524 -3.926 5.749 1.00 0.00 C ATOM 1161 CG GLU A 72 11.076 -4.320 5.984 1.00 0.00 C ATOM 1162 CD GLU A 72 10.433 -3.534 7.111 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.921 -2.426 7.416 1.00 0.00 O ATOM 1164 OE2 GLU A 72 9.442 -4.029 7.688 1.00 0.00 O ATOM 0 H GLU A 72 14.835 -3.620 4.647 1.00 0.00 H new ATOM 0 HA GLU A 72 13.382 -5.896 5.808 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.969 -3.627 6.698 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.553 -3.054 5.095 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.508 -4.164 5.067 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.026 -5.384 6.213 1.00 0.00 H new ATOM 1171 N PHE A 73 12.932 -4.658 2.776 1.00 0.00 N ATOM 1172 CA PHE A 73 12.397 -4.962 1.454 1.00 0.00 C ATOM 1173 C PHE A 73 13.520 -5.098 0.431 1.00 0.00 C ATOM 1174 O PHE A 73 13.464 -5.947 -0.460 1.00 0.00 O ATOM 1175 CB PHE A 73 11.419 -3.870 1.014 1.00 0.00 C ATOM 1176 CG PHE A 73 10.526 -3.384 2.119 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.996 -2.488 3.065 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.214 -3.823 2.211 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.176 -2.040 4.083 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.389 -3.378 3.227 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.871 -2.484 4.163 1.00 0.00 C ATOM 0 H PHE A 73 13.439 -3.774 2.833 1.00 0.00 H new ATOM 0 HA PHE A 73 11.867 -5.913 1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 73 11.984 -3.027 0.617 1.00 0.00 H new ATOM 0 HB3 PHE A 73 10.802 -4.252 0.201 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.015 -2.135 3.006 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.832 -4.521 1.480 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.556 -1.343 4.816 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.369 -3.729 3.289 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.228 -2.133 4.956 1.00 0.00 H new ATOM 1191 N LEU A 74 14.538 -4.255 0.563 1.00 0.00 N ATOM 1192 CA LEU A 74 15.676 -4.280 -0.350 1.00 0.00 C ATOM 1193 C LEU A 74 16.699 -5.325 0.084 1.00 0.00 C ATOM 1194 O LEU A 74 17.854 -5.289 -0.340 1.00 0.00 O ATOM 1195 CB LEU A 74 16.334 -2.901 -0.414 1.00 0.00 C ATOM 1196 CG LEU A 74 15.389 -1.715 -0.610 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.161 -0.405 -0.574 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.627 -1.851 -1.921 1.00 0.00 C ATOM 0 H LEU A 74 14.599 -3.546 1.293 1.00 0.00 H new ATOM 0 HA LEU A 74 15.310 -4.547 -1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.894 -2.745 0.508 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.057 -2.903 -1.230 1.00 0.00 H new ATOM 0 HG LEU A 74 14.668 -1.711 0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.472 0.428 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.660 -0.303 0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.905 -0.399 -1.371 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.959 -0.998 -2.044 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.333 -1.882 -2.751 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.042 -2.771 -1.908 1.00 0.00 H new ATOM 1210 N ALA A 75 16.266 -6.255 0.928 1.00 0.00 N ATOM 1211 CA ALA A 75 17.144 -7.312 1.415 1.00 0.00 C ATOM 1212 C ALA A 75 16.736 -8.668 0.849 1.00 0.00 C ATOM 1213 O ALA A 75 15.568 -8.917 0.550 1.00 0.00 O ATOM 1214 CB ALA A 75 17.133 -7.348 2.936 1.00 0.00 C ATOM 0 H ALA A 75 15.313 -6.298 1.289 1.00 0.00 H new ATOM 0 HA ALA A 75 18.157 -7.095 1.075 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.793 -8.142 3.286 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.479 -6.390 3.325 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.119 -7.537 3.288 1.00 0.00 H new ATOM 1220 N PRO A 76 17.720 -9.567 0.698 1.00 0.00 N ATOM 1221 CA PRO A 76 17.487 -10.914 0.166 1.00 0.00 C ATOM 1222 C PRO A 76 16.701 -11.791 1.135 1.00 0.00 C ATOM 1223 O PRO A 76 15.695 -12.395 0.764 1.00 0.00 O ATOM 1224 CB PRO A 76 18.900 -11.467 -0.030 1.00 0.00 C ATOM 1225 CG PRO A 76 19.741 -10.712 0.941 1.00 0.00 C ATOM 1226 CD PRO A 76 19.135 -9.339 1.034 1.00 0.00 C ATOM 0 HA PRO A 76 16.892 -10.895 -0.747 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.936 -12.539 0.165 1.00 0.00 H new ATOM 0 HB3 PRO A 76 19.245 -11.317 -1.053 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.748 -11.202 1.915 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.776 -10.660 0.603 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.248 -8.917 2.033 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.606 -8.644 0.339 1.00 0.00 H new ATOM 1234 N GLY A 77 17.168 -11.857 2.378 1.00 0.00 N ATOM 1235 CA GLY A 77 16.496 -12.663 3.381 1.00 0.00 C ATOM 1236 C GLY A 77 15.554 -11.848 4.244 1.00 0.00 C ATOM 1237 O GLY A 77 15.543 -11.989 5.467 1.00 0.00 O ATOM 0 H GLY A 77 17.999 -11.367 2.708 1.00 0.00 H new ATOM 0 HA2 GLY A 77 15.936 -13.458 2.888 1.00 0.00 H new ATOM 0 HA3 GLY A 77 17.241 -13.143 4.015 1.00 0.00 H new ATOM 1241 N ALA A 78 14.762 -10.992 3.608 1.00 0.00 N ATOM 1242 CA ALA A 78 13.812 -10.151 4.326 1.00 0.00 C ATOM 1243 C ALA A 78 12.378 -10.599 4.068 1.00 0.00 C ATOM 1244 O ALA A 78 12.067 -11.207 3.043 1.00 0.00 O ATOM 1245 CB ALA A 78 13.991 -8.693 3.929 1.00 0.00 C ATOM 0 H ALA A 78 14.759 -10.862 2.596 1.00 0.00 H new ATOM 0 HA ALA A 78 14.010 -10.252 5.393 1.00 0.00 H new ATOM 0 HB1 ALA A 78 13.275 -8.077 4.473 1.00 0.00 H new ATOM 0 HB2 ALA A 78 15.004 -8.372 4.171 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.823 -8.584 2.858 1.00 0.00 H new ATOM 1251 N PRO A 79 11.481 -10.294 5.018 1.00 0.00 N ATOM 1252 CA PRO A 79 10.064 -10.656 4.915 1.00 0.00 C ATOM 1253 C PRO A 79 9.339 -9.859 3.837 1.00 0.00 C ATOM 1254 O PRO A 79 8.621 -10.424 3.012 1.00 0.00 O ATOM 1255 CB PRO A 79 9.509 -10.312 6.299 1.00 0.00 C ATOM 1256 CG PRO A 79 10.421 -9.256 6.821 1.00 0.00 C ATOM 1257 CD PRO A 79 11.782 -9.571 6.265 1.00 0.00 C ATOM 0 HA PRO A 79 9.929 -11.701 4.634 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.482 -9.952 6.235 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.501 -11.186 6.951 1.00 0.00 H new ATOM 0 HG2 PRO A 79 10.091 -8.266 6.507 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.435 -9.257 7.911 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.358 -8.665 6.076 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.366 -10.182 6.953 1.00 0.00 H new ATOM 1265 N SER A 80 9.531 -8.544 3.849 1.00 0.00 N ATOM 1266 CA SER A 80 8.892 -7.669 2.874 1.00 0.00 C ATOM 1267 C SER A 80 9.781 -7.481 1.648 1.00 0.00 C ATOM 1268 O SER A 80 9.595 -6.546 0.870 1.00 0.00 O ATOM 1269 CB SER A 80 8.579 -6.310 3.504 1.00 0.00 C ATOM 1270 OG SER A 80 7.851 -6.463 4.710 1.00 0.00 O ATOM 0 H SER A 80 10.124 -8.061 4.524 1.00 0.00 H new ATOM 0 HA SER A 80 7.960 -8.138 2.558 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.508 -5.775 3.701 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.005 -5.704 2.803 1.00 0.00 H new ATOM 0 HG SER A 80 7.803 -5.601 5.174 1.00 0.00 H new ATOM 1276 N ALA A 81 10.748 -8.377 1.483 1.00 0.00 N ATOM 1277 CA ALA A 81 11.665 -8.312 0.352 1.00 0.00 C ATOM 1278 C ALA A 81 10.913 -8.066 -0.951 1.00 0.00 C ATOM 1279 O ALA A 81 10.164 -8.924 -1.419 1.00 0.00 O ATOM 1280 CB ALA A 81 12.480 -9.594 0.259 1.00 0.00 C ATOM 0 H ALA A 81 10.917 -9.157 2.118 1.00 0.00 H new ATOM 0 HA ALA A 81 12.343 -7.474 0.514 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.161 -9.532 -0.590 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.055 -9.727 1.176 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.809 -10.443 0.125 1.00 0.00 H new ATOM 1286 N ILE A 82 11.116 -6.888 -1.533 1.00 0.00 N ATOM 1287 CA ILE A 82 10.456 -6.530 -2.782 1.00 0.00 C ATOM 1288 C ILE A 82 11.350 -6.830 -3.981 1.00 0.00 C ATOM 1289 O ILE A 82 12.456 -7.346 -3.830 1.00 0.00 O ATOM 1290 CB ILE A 82 10.068 -5.040 -2.806 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.313 -4.163 -2.660 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.067 -4.736 -1.702 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.196 -2.826 -3.357 1.00 0.00 C ATOM 0 H ILE A 82 11.732 -6.166 -1.159 1.00 0.00 H new ATOM 0 HA ILE A 82 9.551 -7.134 -2.846 1.00 0.00 H new ATOM 0 HB ILE A 82 9.601 -4.817 -3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.507 -3.995 -1.601 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.174 -4.698 -3.061 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.802 -3.679 -1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.171 -5.339 -1.848 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.510 -4.972 -0.734 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.115 -2.258 -3.211 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.033 -2.984 -4.423 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.356 -2.271 -2.940 1.00 0.00 H new ATOM 1305 N ASN A 83 10.861 -6.502 -5.173 1.00 0.00 N ATOM 1306 CA ASN A 83 11.616 -6.735 -6.399 1.00 0.00 C ATOM 1307 C ASN A 83 11.751 -5.449 -7.208 1.00 0.00 C ATOM 1308 O ASN A 83 10.775 -4.725 -7.412 1.00 0.00 O ATOM 1309 CB ASN A 83 10.935 -7.814 -7.244 1.00 0.00 C ATOM 1310 CG ASN A 83 11.758 -8.203 -8.457 1.00 0.00 C ATOM 1311 OD1 ASN A 83 11.788 -7.485 -9.457 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.431 -9.344 -8.373 1.00 0.00 N ATOM 0 H ASN A 83 9.946 -6.074 -5.316 1.00 0.00 H new ATOM 0 HA ASN A 83 12.614 -7.075 -6.123 1.00 0.00 H new ATOM 0 HB2 ASN A 83 10.760 -8.697 -6.629 1.00 0.00 H new ATOM 0 HB3 ASN A 83 9.959 -7.454 -7.570 1.00 0.00 H new ATOM 0 HD21 ASN A 83 13.003 -9.658 -9.157 1.00 0.00 H new ATOM 0 HD22 ASN A 83 12.376 -9.907 -7.524 1.00 0.00 H new ATOM 1319 N LEU A 84 12.966 -5.170 -7.667 1.00 0.00 N ATOM 1320 CA LEU A 84 13.230 -3.971 -8.455 1.00 0.00 C ATOM 1321 C LEU A 84 13.987 -4.315 -9.733 1.00 0.00 C ATOM 1322 O LEU A 84 14.392 -5.459 -9.938 1.00 0.00 O ATOM 1323 CB LEU A 84 14.031 -2.961 -7.631 1.00 0.00 C ATOM 1324 CG LEU A 84 13.351 -2.438 -6.365 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.379 -1.846 -5.413 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.290 -1.406 -6.716 1.00 0.00 C ATOM 0 H LEU A 84 13.784 -5.758 -7.507 1.00 0.00 H new ATOM 0 HA LEU A 84 12.272 -3.529 -8.730 1.00 0.00 H new ATOM 0 HB2 LEU A 84 14.977 -3.422 -7.347 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.270 -2.110 -8.269 1.00 0.00 H new ATOM 0 HG LEU A 84 12.863 -3.275 -5.866 1.00 0.00 H new ATOM 0 HD11 LEU A 84 13.877 -1.479 -4.518 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.102 -2.613 -5.135 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.896 -1.021 -5.903 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.817 -1.045 -5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.755 -0.570 -7.239 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.537 -1.862 -7.359 1.00 0.00 H new ATOM 1338 N ASP A 85 14.175 -3.318 -10.590 1.00 0.00 N ATOM 1339 CA ASP A 85 14.886 -3.514 -11.848 1.00 0.00 C ATOM 1340 C ASP A 85 16.352 -3.850 -11.596 1.00 0.00 C ATOM 1341 O ASP A 85 16.808 -3.868 -10.453 1.00 0.00 O ATOM 1342 CB ASP A 85 14.780 -2.261 -12.719 1.00 0.00 C ATOM 1343 CG ASP A 85 15.165 -2.525 -14.162 1.00 0.00 C ATOM 1344 OD1 ASP A 85 14.287 -2.950 -14.942 1.00 0.00 O ATOM 1345 OD2 ASP A 85 16.343 -2.306 -14.510 1.00 0.00 O ATOM 0 H ASP A 85 13.845 -2.365 -10.437 1.00 0.00 H new ATOM 0 HA ASP A 85 14.424 -4.351 -12.372 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.759 -1.882 -12.682 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.424 -1.482 -12.311 1.00 0.00 H new ATOM 1350 N SER A 86 17.086 -4.118 -12.672 1.00 0.00 N ATOM 1351 CA SER A 86 18.500 -4.459 -12.567 1.00 0.00 C ATOM 1352 C SER A 86 19.349 -3.206 -12.378 1.00 0.00 C ATOM 1353 O SER A 86 20.195 -3.143 -11.486 1.00 0.00 O ATOM 1354 CB SER A 86 18.957 -5.215 -13.816 1.00 0.00 C ATOM 1355 OG SER A 86 18.707 -4.461 -14.989 1.00 0.00 O ATOM 0 H SER A 86 16.725 -4.106 -13.626 1.00 0.00 H new ATOM 0 HA SER A 86 18.630 -5.099 -11.695 1.00 0.00 H new ATOM 0 HB2 SER A 86 20.022 -5.436 -13.742 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.437 -6.171 -13.877 1.00 0.00 H new ATOM 0 HG SER A 86 19.009 -4.965 -15.773 1.00 0.00 H new ATOM 1361 N LYS A 87 19.116 -2.208 -13.225 1.00 0.00 N ATOM 1362 CA LYS A 87 19.857 -0.954 -13.153 1.00 0.00 C ATOM 1363 C LYS A 87 19.469 -0.164 -11.907 1.00 0.00 C ATOM 1364 O LYS A 87 20.326 0.405 -11.230 1.00 0.00 O ATOM 1365 CB LYS A 87 19.597 -0.112 -14.404 1.00 0.00 C ATOM 1366 CG LYS A 87 18.191 0.457 -14.474 1.00 0.00 C ATOM 1367 CD LYS A 87 18.040 1.429 -15.632 1.00 0.00 C ATOM 1368 CE LYS A 87 18.200 2.871 -15.173 1.00 0.00 C ATOM 1369 NZ LYS A 87 19.632 3.274 -15.100 1.00 0.00 N ATOM 0 H LYS A 87 18.420 -2.244 -13.969 1.00 0.00 H new ATOM 0 HA LYS A 87 20.919 -1.191 -13.096 1.00 0.00 H new ATOM 0 HB2 LYS A 87 20.314 0.709 -14.435 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.776 -0.725 -15.288 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.474 -0.356 -14.584 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.956 0.965 -13.539 1.00 0.00 H new ATOM 0 HD2 LYS A 87 18.784 1.205 -16.396 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.061 1.299 -16.092 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.671 3.532 -15.860 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.738 2.994 -14.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 19.699 4.311 -15.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 20.066 2.860 -14.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 20.132 2.933 -15.946 1.00 0.00 H new ATOM 1383 N SER A 88 18.174 -0.136 -11.609 1.00 0.00 N ATOM 1384 CA SER A 88 17.674 0.586 -10.445 1.00 0.00 C ATOM 1385 C SER A 88 18.262 0.017 -9.158 1.00 0.00 C ATOM 1386 O SER A 88 18.947 0.717 -8.412 1.00 0.00 O ATOM 1387 CB SER A 88 16.146 0.519 -10.394 1.00 0.00 C ATOM 1388 OG SER A 88 15.567 1.307 -11.420 1.00 0.00 O ATOM 0 H SER A 88 17.453 -0.605 -12.157 1.00 0.00 H new ATOM 0 HA SER A 88 17.982 1.628 -10.535 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.820 -0.516 -10.498 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.796 0.867 -9.422 1.00 0.00 H new ATOM 0 HG SER A 88 14.590 1.246 -11.367 1.00 0.00 H new ATOM 1394 N TYR A 89 17.990 -1.259 -8.904 1.00 0.00 N ATOM 1395 CA TYR A 89 18.490 -1.923 -7.706 1.00 0.00 C ATOM 1396 C TYR A 89 19.957 -1.583 -7.467 1.00 0.00 C ATOM 1397 O TYR A 89 20.320 -1.057 -6.414 1.00 0.00 O ATOM 1398 CB TYR A 89 18.319 -3.438 -7.830 1.00 0.00 C ATOM 1399 CG TYR A 89 18.476 -4.174 -6.518 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.384 -4.392 -5.687 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.716 -4.651 -6.110 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.523 -5.063 -4.487 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.863 -5.325 -4.913 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.764 -5.528 -4.105 1.00 0.00 C ATOM 1405 OH TYR A 89 18.907 -6.197 -2.911 1.00 0.00 O ATOM 0 H TYR A 89 17.426 -1.853 -9.512 1.00 0.00 H new ATOM 0 HA TYR A 89 17.911 -1.567 -6.854 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.332 -3.652 -8.241 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.050 -3.821 -8.542 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.410 -4.031 -5.984 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.579 -4.492 -6.739 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.664 -5.222 -3.852 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.833 -5.691 -4.612 1.00 0.00 H new ATOM 0 HH TYR A 89 18.468 -5.690 -2.197 1.00 0.00 H new ATOM 1415 N ASP A 90 20.796 -1.887 -8.451 1.00 0.00 N ATOM 1416 CA ASP A 90 22.225 -1.612 -8.349 1.00 0.00 C ATOM 1417 C ASP A 90 22.473 -0.248 -7.713 1.00 0.00 C ATOM 1418 O ASP A 90 23.140 -0.143 -6.684 1.00 0.00 O ATOM 1419 CB ASP A 90 22.877 -1.670 -9.732 1.00 0.00 C ATOM 1420 CG ASP A 90 24.391 -1.656 -9.660 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.943 -2.207 -8.685 1.00 0.00 O ATOM 1422 OD2 ASP A 90 25.024 -1.092 -10.577 1.00 0.00 O ATOM 0 H ASP A 90 20.512 -2.324 -9.328 1.00 0.00 H new ATOM 0 HA ASP A 90 22.672 -2.376 -7.712 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.549 -2.573 -10.247 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.537 -0.822 -10.327 1.00 0.00 H new ATOM 1427 N LYS A 91 21.931 0.795 -8.333 1.00 0.00 N ATOM 1428 CA LYS A 91 22.092 2.153 -7.828 1.00 0.00 C ATOM 1429 C LYS A 91 21.795 2.217 -6.334 1.00 0.00 C ATOM 1430 O LYS A 91 22.579 2.765 -5.557 1.00 0.00 O ATOM 1431 CB LYS A 91 21.169 3.113 -8.584 1.00 0.00 C ATOM 1432 CG LYS A 91 21.300 4.559 -8.140 1.00 0.00 C ATOM 1433 CD LYS A 91 22.397 5.280 -8.905 1.00 0.00 C ATOM 1434 CE LYS A 91 23.757 5.078 -8.253 1.00 0.00 C ATOM 1435 NZ LYS A 91 24.709 6.167 -8.608 1.00 0.00 N ATOM 0 H LYS A 91 21.376 0.725 -9.186 1.00 0.00 H new ATOM 0 HA LYS A 91 23.128 2.453 -7.988 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.386 3.048 -9.650 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.136 2.792 -8.449 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.351 5.074 -8.291 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.516 4.595 -7.072 1.00 0.00 H new ATOM 0 HD2 LYS A 91 22.427 4.915 -9.932 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.170 6.345 -8.952 1.00 0.00 H new ATOM 0 HE2 LYS A 91 23.638 5.038 -7.170 1.00 0.00 H new ATOM 0 HE3 LYS A 91 24.170 4.119 -8.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 25.624 5.993 -8.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 24.842 6.189 -9.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 24.327 7.080 -8.288 1.00 0.00 H new ATOM 1449 N THR A 92 20.659 1.653 -5.935 1.00 0.00 N ATOM 1450 CA THR A 92 20.260 1.646 -4.534 1.00 0.00 C ATOM 1451 C THR A 92 21.359 1.065 -3.652 1.00 0.00 C ATOM 1452 O THR A 92 21.830 1.716 -2.718 1.00 0.00 O ATOM 1453 CB THR A 92 18.967 0.836 -4.322 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.913 1.378 -5.127 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.553 0.850 -2.859 1.00 0.00 C ATOM 0 H THR A 92 19.999 1.195 -6.564 1.00 0.00 H new ATOM 0 HA THR A 92 20.081 2.684 -4.252 1.00 0.00 H new ATOM 0 HB THR A 92 19.157 -0.195 -4.619 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.292 0.663 -5.378 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.638 0.272 -2.734 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.345 0.411 -2.252 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.379 1.878 -2.540 1.00 0.00 H new ATOM 1463 N THR A 93 21.766 -0.164 -3.953 1.00 0.00 N ATOM 1464 CA THR A 93 22.810 -0.833 -3.187 1.00 0.00 C ATOM 1465 C THR A 93 23.973 0.111 -2.903 1.00 0.00 C ATOM 1466 O THR A 93 24.498 0.147 -1.789 1.00 0.00 O ATOM 1467 CB THR A 93 23.341 -2.075 -3.926 1.00 0.00 C ATOM 1468 OG1 THR A 93 22.246 -2.872 -4.393 1.00 0.00 O ATOM 1469 CG2 THR A 93 24.230 -2.909 -3.015 1.00 0.00 C ATOM 0 H THR A 93 21.388 -0.717 -4.723 1.00 0.00 H new ATOM 0 HA THR A 93 22.360 -1.145 -2.245 1.00 0.00 H new ATOM 0 HB THR A 93 23.934 -1.739 -4.776 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.721 -3.187 -3.628 1.00 0.00 H new ATOM 0 HG21 THR A 93 24.593 -3.781 -3.559 1.00 0.00 H new ATOM 0 HG22 THR A 93 25.078 -2.309 -2.685 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.657 -3.236 -2.147 1.00 0.00 H new ATOM 1477 N HIS A 94 24.372 0.873 -3.916 1.00 0.00 N ATOM 1478 CA HIS A 94 25.473 1.819 -3.774 1.00 0.00 C ATOM 1479 C HIS A 94 25.062 3.007 -2.909 1.00 0.00 C ATOM 1480 O HIS A 94 25.813 3.442 -2.038 1.00 0.00 O ATOM 1481 CB HIS A 94 25.934 2.308 -5.148 1.00 0.00 C ATOM 1482 CG HIS A 94 27.257 3.009 -5.121 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.364 2.503 -4.473 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.648 4.183 -5.670 1.00 0.00 C ATOM 1485 CE1 HIS A 94 29.378 3.336 -4.623 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.970 4.364 -5.345 1.00 0.00 N ATOM 0 H HIS A 94 23.949 0.854 -4.844 1.00 0.00 H new ATOM 0 HA HIS A 94 26.300 1.305 -3.284 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.997 1.456 -5.825 1.00 0.00 H new ATOM 0 HB3 HIS A 94 25.182 2.984 -5.555 1.00 0.00 H new ATOM 0 HD2 HIS A 94 27.035 4.853 -6.255 1.00 0.00 H new ATOM 0 HE1 HIS A 94 30.372 3.200 -4.223 1.00 0.00 H new ATOM 0 HE2 HIS A 94 29.544 5.162 -5.617 1.00 0.00 H new ATOM 1494 N ASN A 95 23.864 3.527 -3.158 1.00 0.00 N ATOM 1495 CA ASN A 95 23.353 4.665 -2.403 1.00 0.00 C ATOM 1496 C ASN A 95 23.309 4.352 -0.910 1.00 0.00 C ATOM 1497 O ASN A 95 23.760 5.146 -0.085 1.00 0.00 O ATOM 1498 CB ASN A 95 21.957 5.046 -2.897 1.00 0.00 C ATOM 1499 CG ASN A 95 21.983 5.672 -4.279 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.051 5.932 -4.834 1.00 0.00 O ATOM 1501 ND2 ASN A 95 20.805 5.917 -4.840 1.00 0.00 N ATOM 0 H ASN A 95 23.230 3.178 -3.877 1.00 0.00 H new ATOM 0 HA ASN A 95 24.028 5.506 -2.560 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.326 4.157 -2.916 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.504 5.744 -2.193 1.00 0.00 H new ATOM 0 HD21 ASN A 95 20.760 6.337 -5.768 1.00 0.00 H new ATOM 0 HD22 ASN A 95 19.945 5.685 -4.343 1.00 0.00 H new ATOM 1508 N VAL A 96 22.761 3.189 -0.571 1.00 0.00 N ATOM 1509 CA VAL A 96 22.659 2.769 0.821 1.00 0.00 C ATOM 1510 C VAL A 96 23.922 3.128 1.597 1.00 0.00 C ATOM 1511 O VAL A 96 23.853 3.636 2.717 1.00 0.00 O ATOM 1512 CB VAL A 96 22.413 1.253 0.934 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.338 0.831 2.393 1.00 0.00 C ATOM 1514 CG2 VAL A 96 21.145 0.863 0.191 1.00 0.00 C ATOM 0 H VAL A 96 22.381 2.521 -1.242 1.00 0.00 H new ATOM 0 HA VAL A 96 21.809 3.300 1.250 1.00 0.00 H new ATOM 0 HB VAL A 96 23.252 0.731 0.473 1.00 0.00 H new ATOM 0 HG11 VAL A 96 22.164 -0.243 2.453 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.277 1.075 2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.520 1.359 2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.986 -0.212 0.281 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.294 1.393 0.620 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.244 1.128 -0.862 1.00 0.00 H new ATOM 1524 N LYS A 97 25.075 2.860 0.995 1.00 0.00 N ATOM 1525 CA LYS A 97 26.356 3.155 1.628 1.00 0.00 C ATOM 1526 C LYS A 97 26.302 4.487 2.369 1.00 0.00 C ATOM 1527 O LYS A 97 26.764 4.595 3.504 1.00 0.00 O ATOM 1528 CB LYS A 97 27.470 3.187 0.580 1.00 0.00 C ATOM 1529 CG LYS A 97 27.605 1.893 -0.204 1.00 0.00 C ATOM 1530 CD LYS A 97 28.517 0.905 0.502 1.00 0.00 C ATOM 1531 CE LYS A 97 28.887 -0.259 -0.405 1.00 0.00 C ATOM 1532 NZ LYS A 97 30.007 0.087 -1.323 1.00 0.00 N ATOM 0 H LYS A 97 25.150 2.439 0.069 1.00 0.00 H new ATOM 0 HA LYS A 97 26.567 2.366 2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.280 4.005 -0.115 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.417 3.403 1.075 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.621 1.446 -0.342 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.000 2.108 -1.197 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.423 1.415 0.829 1.00 0.00 H new ATOM 0 HD3 LYS A 97 28.023 0.527 1.397 1.00 0.00 H new ATOM 0 HE2 LYS A 97 29.169 -1.118 0.204 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.016 -0.555 -0.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 30.229 -0.732 -1.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.729 0.891 -1.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 30.846 0.344 -0.765 1.00 0.00 H new ATOM 1546 N GLU A 98 25.733 5.498 1.720 1.00 0.00 N ATOM 1547 CA GLU A 98 25.619 6.823 2.319 1.00 0.00 C ATOM 1548 C GLU A 98 24.230 7.033 2.914 1.00 0.00 C ATOM 1549 O GLU A 98 23.225 7.088 2.204 1.00 0.00 O ATOM 1550 CB GLU A 98 25.909 7.905 1.277 1.00 0.00 C ATOM 1551 CG GLU A 98 25.079 7.769 0.011 1.00 0.00 C ATOM 1552 CD GLU A 98 25.324 8.898 -0.971 1.00 0.00 C ATOM 1553 OE1 GLU A 98 26.437 8.962 -1.534 1.00 0.00 O ATOM 1554 OE2 GLU A 98 24.404 9.717 -1.177 1.00 0.00 O ATOM 0 H GLU A 98 25.344 5.425 0.780 1.00 0.00 H new ATOM 0 HA GLU A 98 26.354 6.896 3.121 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.723 8.883 1.720 1.00 0.00 H new ATOM 0 HB3 GLU A 98 26.966 7.870 1.014 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.309 6.818 -0.470 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.022 7.745 0.275 1.00 0.00 H new ATOM 1561 N PRO A 99 24.170 7.153 4.248 1.00 0.00 N ATOM 1562 CA PRO A 99 22.910 7.359 4.969 1.00 0.00 C ATOM 1563 C PRO A 99 22.320 8.742 4.720 1.00 0.00 C ATOM 1564 O PRO A 99 22.963 9.758 4.980 1.00 0.00 O ATOM 1565 CB PRO A 99 23.313 7.205 6.438 1.00 0.00 C ATOM 1566 CG PRO A 99 24.761 7.554 6.472 1.00 0.00 C ATOM 1567 CD PRO A 99 25.328 7.097 5.157 1.00 0.00 C ATOM 0 HA PRO A 99 22.138 6.659 4.649 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.731 7.867 7.080 1.00 0.00 H new ATOM 0 HB3 PRO A 99 23.142 6.188 6.791 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.901 8.627 6.606 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.262 7.061 7.305 1.00 0.00 H new ATOM 0 HD2 PRO A 99 26.135 7.747 4.820 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.737 6.089 5.224 1.00 0.00 H new ATOM 1575 N GLY A 100 21.090 8.774 4.215 1.00 0.00 N ATOM 1576 CA GLY A 100 20.433 10.038 3.940 1.00 0.00 C ATOM 1577 C GLY A 100 18.923 9.938 4.026 1.00 0.00 C ATOM 1578 O GLY A 100 18.389 8.997 4.613 1.00 0.00 O ATOM 0 H GLY A 100 20.537 7.946 3.992 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.785 10.788 4.648 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.715 10.381 2.945 1.00 0.00 H new ATOM 1582 N ARG A 101 18.233 10.911 3.441 1.00 0.00 N ATOM 1583 CA ARG A 101 16.775 10.930 3.456 1.00 0.00 C ATOM 1584 C ARG A 101 16.212 10.553 2.089 1.00 0.00 C ATOM 1585 O ARG A 101 15.184 9.883 1.993 1.00 0.00 O ATOM 1586 CB ARG A 101 16.266 12.313 3.866 1.00 0.00 C ATOM 1587 CG ARG A 101 16.838 12.807 5.185 1.00 0.00 C ATOM 1588 CD ARG A 101 16.809 14.325 5.271 1.00 0.00 C ATOM 1589 NE ARG A 101 17.728 14.945 4.320 1.00 0.00 N ATOM 1590 CZ ARG A 101 18.097 16.220 4.380 1.00 0.00 C ATOM 1591 NH1 ARG A 101 17.629 17.005 5.340 1.00 0.00 N ATOM 1592 NH2 ARG A 101 18.937 16.711 3.478 1.00 0.00 N ATOM 0 H ARG A 101 18.660 11.697 2.951 1.00 0.00 H new ATOM 0 HA ARG A 101 16.435 10.195 4.185 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.513 13.029 3.082 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.179 12.283 3.940 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.267 12.384 6.012 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.864 12.455 5.293 1.00 0.00 H new ATOM 0 HD2 ARG A 101 15.796 14.680 5.080 1.00 0.00 H new ATOM 0 HD3 ARG A 101 17.070 14.636 6.283 1.00 0.00 H new ATOM 0 HE ARG A 101 18.107 14.368 3.569 1.00 0.00 H new ATOM 0 HH11 ARG A 101 16.984 16.631 6.036 1.00 0.00 H new ATOM 0 HH12 ARG A 101 17.914 17.983 5.383 1.00 0.00 H new ATOM 0 HH21 ARG A 101 19.300 16.110 2.738 1.00 0.00 H new ATOM 0 HH22 ARG A 101 19.220 17.690 3.524 1.00 0.00 H new ATOM 1606 N TYR A 102 16.892 10.989 1.035 1.00 0.00 N ATOM 1607 CA TYR A 102 16.458 10.700 -0.327 1.00 0.00 C ATOM 1608 C TYR A 102 17.305 9.592 -0.945 1.00 0.00 C ATOM 1609 O TYR A 102 17.314 9.406 -2.163 1.00 0.00 O ATOM 1610 CB TYR A 102 16.540 11.961 -1.189 1.00 0.00 C ATOM 1611 CG TYR A 102 16.117 13.219 -0.464 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.917 13.273 0.233 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.920 14.354 -0.475 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.527 14.420 0.896 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.538 15.505 0.187 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.341 15.533 0.871 1.00 0.00 C ATOM 1617 OH TYR A 102 14.956 16.677 1.531 1.00 0.00 O ATOM 0 H TYR A 102 17.746 11.544 1.097 1.00 0.00 H new ATOM 0 HA TYR A 102 15.423 10.362 -0.287 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.564 12.083 -1.543 1.00 0.00 H new ATOM 0 HB3 TYR A 102 15.911 11.830 -2.070 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.278 12.403 0.257 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.858 14.336 -1.010 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.589 14.445 1.431 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.173 16.378 0.169 1.00 0.00 H new ATOM 0 HH TYR A 102 15.642 17.368 1.416 1.00 0.00 H new ATOM 1627 N THR A 103 18.018 8.858 -0.097 1.00 0.00 N ATOM 1628 CA THR A 103 18.869 7.768 -0.557 1.00 0.00 C ATOM 1629 C THR A 103 18.072 6.753 -1.368 1.00 0.00 C ATOM 1630 O THR A 103 18.576 6.181 -2.334 1.00 0.00 O ATOM 1631 CB THR A 103 19.547 7.048 0.623 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.302 7.984 1.401 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.463 5.939 0.126 1.00 0.00 C ATOM 0 H THR A 103 18.023 8.999 0.913 1.00 0.00 H new ATOM 0 HA THR A 103 19.637 8.212 -1.191 1.00 0.00 H new ATOM 0 HB THR A 103 18.769 6.605 1.244 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.181 7.603 1.609 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.931 5.445 0.977 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.880 5.212 -0.440 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.235 6.365 -0.515 1.00 0.00 H new ATOM 1641 N PHE A 104 16.824 6.532 -0.968 1.00 0.00 N ATOM 1642 CA PHE A 104 15.956 5.585 -1.658 1.00 0.00 C ATOM 1643 C PHE A 104 14.929 6.314 -2.519 1.00 0.00 C ATOM 1644 O PHE A 104 13.922 5.736 -2.925 1.00 0.00 O ATOM 1645 CB PHE A 104 15.243 4.684 -0.647 1.00 0.00 C ATOM 1646 CG PHE A 104 16.182 3.926 0.247 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.707 2.707 -0.152 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.539 4.431 1.487 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.572 2.007 0.668 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.403 3.736 2.311 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.919 2.522 1.902 1.00 0.00 C ATOM 0 H PHE A 104 16.391 6.996 -0.169 1.00 0.00 H new ATOM 0 HA PHE A 104 16.577 4.970 -2.309 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.581 5.294 -0.032 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.614 3.975 -1.185 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.437 2.299 -1.115 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.137 5.379 1.813 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.976 1.059 0.345 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.675 4.142 3.274 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.593 1.976 2.546 1.00 0.00 H new ATOM 1661 N GLU A 105 15.193 7.588 -2.792 1.00 0.00 N ATOM 1662 CA GLU A 105 14.291 8.397 -3.603 1.00 0.00 C ATOM 1663 C GLU A 105 14.019 7.727 -4.947 1.00 0.00 C ATOM 1664 O GLU A 105 12.884 7.704 -5.423 1.00 0.00 O ATOM 1665 CB GLU A 105 14.882 9.791 -3.827 1.00 0.00 C ATOM 1666 CG GLU A 105 13.843 10.843 -4.177 1.00 0.00 C ATOM 1667 CD GLU A 105 14.463 12.117 -4.717 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.438 12.607 -4.111 1.00 0.00 O ATOM 1669 OE2 GLU A 105 13.972 12.624 -5.748 1.00 0.00 O ATOM 0 H GLU A 105 16.023 8.081 -2.464 1.00 0.00 H new ATOM 0 HA GLU A 105 13.347 8.492 -3.066 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.412 10.101 -2.926 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.619 9.740 -4.628 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.154 10.436 -4.917 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.255 11.077 -3.290 1.00 0.00 H new ATOM 1676 N ASP A 106 15.069 7.184 -5.554 1.00 0.00 N ATOM 1677 CA ASP A 106 14.945 6.513 -6.842 1.00 0.00 C ATOM 1678 C ASP A 106 14.062 5.274 -6.727 1.00 0.00 C ATOM 1679 O ASP A 106 12.965 5.227 -7.284 1.00 0.00 O ATOM 1680 CB ASP A 106 16.325 6.122 -7.373 1.00 0.00 C ATOM 1681 CG ASP A 106 17.308 7.275 -7.332 1.00 0.00 C ATOM 1682 OD1 ASP A 106 16.882 8.427 -7.559 1.00 0.00 O ATOM 1683 OD2 ASP A 106 18.505 7.026 -7.073 1.00 0.00 O ATOM 0 H ASP A 106 16.016 7.196 -5.174 1.00 0.00 H new ATOM 0 HA ASP A 106 14.478 7.207 -7.541 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.717 5.293 -6.783 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.229 5.766 -8.399 1.00 0.00 H new ATOM 1688 N ALA A 107 14.547 4.273 -6.001 1.00 0.00 N ATOM 1689 CA ALA A 107 13.802 3.034 -5.812 1.00 0.00 C ATOM 1690 C ALA A 107 12.357 3.318 -5.416 1.00 0.00 C ATOM 1691 O ALA A 107 11.425 2.767 -6.001 1.00 0.00 O ATOM 1692 CB ALA A 107 14.479 2.167 -4.761 1.00 0.00 C ATOM 0 H ALA A 107 15.453 4.295 -5.533 1.00 0.00 H new ATOM 0 HA ALA A 107 13.792 2.496 -6.760 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.912 1.245 -4.630 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.492 1.927 -5.084 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.518 2.706 -3.815 1.00 0.00 H new ATOM 1698 N GLN A 108 12.180 4.180 -4.420 1.00 0.00 N ATOM 1699 CA GLN A 108 10.847 4.535 -3.946 1.00 0.00 C ATOM 1700 C GLN A 108 9.984 5.058 -5.090 1.00 0.00 C ATOM 1701 O GLN A 108 8.784 4.792 -5.144 1.00 0.00 O ATOM 1702 CB GLN A 108 10.940 5.587 -2.839 1.00 0.00 C ATOM 1703 CG GLN A 108 9.586 6.066 -2.341 1.00 0.00 C ATOM 1704 CD GLN A 108 9.669 7.395 -1.616 1.00 0.00 C ATOM 1705 OE1 GLN A 108 10.723 8.030 -1.578 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.553 7.824 -1.036 1.00 0.00 N ATOM 0 H GLN A 108 12.942 4.645 -3.926 1.00 0.00 H new ATOM 0 HA GLN A 108 10.380 3.636 -3.545 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.500 5.172 -2.001 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.506 6.442 -3.208 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.904 6.159 -3.186 1.00 0.00 H new ATOM 0 HG3 GLN A 108 9.163 5.317 -1.672 1.00 0.00 H new ATOM 0 HE21 GLN A 108 7.702 7.265 -1.093 1.00 0.00 H new ATOM 0 HE22 GLN A 108 8.548 8.712 -0.534 1.00 0.00 H new ATOM 1715 N GLU A 109 10.604 5.802 -6.000 1.00 0.00 N ATOM 1716 CA GLU A 109 9.891 6.363 -7.141 1.00 0.00 C ATOM 1717 C GLU A 109 9.471 5.264 -8.114 1.00 0.00 C ATOM 1718 O GLU A 109 8.395 5.325 -8.710 1.00 0.00 O ATOM 1719 CB GLU A 109 10.765 7.391 -7.863 1.00 0.00 C ATOM 1720 CG GLU A 109 10.370 7.616 -9.312 1.00 0.00 C ATOM 1721 CD GLU A 109 10.619 9.040 -9.771 1.00 0.00 C ATOM 1722 OE1 GLU A 109 10.246 9.974 -9.030 1.00 0.00 O ATOM 1723 OE2 GLU A 109 11.185 9.220 -10.869 1.00 0.00 O ATOM 0 H GLU A 109 11.598 6.030 -5.969 1.00 0.00 H new ATOM 0 HA GLU A 109 8.994 6.858 -6.768 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.711 8.340 -7.329 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.804 7.063 -7.825 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.930 6.930 -9.948 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.314 7.377 -9.438 1.00 0.00 H new ATOM 1730 N HIS A 110 10.329 4.261 -8.270 1.00 0.00 N ATOM 1731 CA HIS A 110 10.048 3.148 -9.170 1.00 0.00 C ATOM 1732 C HIS A 110 8.772 2.422 -8.755 1.00 0.00 C ATOM 1733 O HIS A 110 7.842 2.279 -9.549 1.00 0.00 O ATOM 1734 CB HIS A 110 11.223 2.169 -9.186 1.00 0.00 C ATOM 1735 CG HIS A 110 11.297 1.344 -10.434 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.786 1.828 -11.629 1.00 0.00 N ATOM 1737 CD2 HIS A 110 10.943 0.058 -10.668 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.727 0.877 -12.544 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.220 -0.207 -11.986 1.00 0.00 N ATOM 0 H HIS A 110 11.224 4.196 -7.785 1.00 0.00 H new ATOM 0 HA HIS A 110 9.906 3.551 -10.173 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.152 2.727 -9.074 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.144 1.505 -8.325 1.00 0.00 H new ATOM 0 HD2 HIS A 110 10.521 -0.631 -9.951 1.00 0.00 H new ATOM 0 HE1 HIS A 110 12.040 0.970 -13.573 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.060 -1.097 -12.458 1.00 0.00 H new ATOM 1747 N ILE A 111 8.736 1.965 -7.507 1.00 0.00 N ATOM 1748 CA ILE A 111 7.574 1.255 -6.988 1.00 0.00 C ATOM 1749 C ILE A 111 6.299 2.067 -7.187 1.00 0.00 C ATOM 1750 O ILE A 111 5.219 1.508 -7.381 1.00 0.00 O ATOM 1751 CB ILE A 111 7.735 0.931 -5.491 1.00 0.00 C ATOM 1752 CG1 ILE A 111 8.952 0.030 -5.269 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.474 0.270 -4.954 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.917 -1.244 -6.084 1.00 0.00 C ATOM 0 H ILE A 111 9.498 2.074 -6.838 1.00 0.00 H new ATOM 0 HA ILE A 111 7.498 0.322 -7.547 1.00 0.00 H new ATOM 0 HB ILE A 111 7.893 1.863 -4.948 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.856 0.586 -5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.016 -0.226 -4.212 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.603 0.047 -3.895 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.627 0.944 -5.082 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.288 -0.655 -5.500 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.810 -1.833 -5.876 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.031 -1.821 -5.819 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.884 -0.996 -7.145 1.00 0.00 H new ATOM 1766 N TYR A 112 6.432 3.388 -7.140 1.00 0.00 N ATOM 1767 CA TYR A 112 5.291 4.278 -7.314 1.00 0.00 C ATOM 1768 C TYR A 112 4.612 4.036 -8.659 1.00 0.00 C ATOM 1769 O TYR A 112 3.445 3.647 -8.718 1.00 0.00 O ATOM 1770 CB TYR A 112 5.735 5.737 -7.210 1.00 0.00 C ATOM 1771 CG TYR A 112 4.641 6.728 -7.539 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.303 7.009 -8.857 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.944 7.383 -6.530 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.305 7.914 -9.161 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.943 8.288 -6.825 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.628 8.551 -8.142 1.00 0.00 C ATOM 1777 OH TYR A 112 1.632 9.452 -8.441 1.00 0.00 O ATOM 0 H TYR A 112 7.319 3.866 -6.983 1.00 0.00 H new ATOM 0 HA TYR A 112 4.573 4.066 -6.521 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.094 5.928 -6.199 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.577 5.901 -7.883 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.830 6.511 -9.658 1.00 0.00 H new ATOM 0 HD2 TYR A 112 4.189 7.181 -5.498 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.056 8.122 -10.191 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.410 8.787 -6.029 1.00 0.00 H new ATOM 0 HH TYR A 112 1.255 9.810 -7.610 1.00 0.00 H new ATOM 1787 N LYS A 113 5.351 4.268 -9.738 1.00 0.00 N ATOM 1788 CA LYS A 113 4.824 4.074 -11.084 1.00 0.00 C ATOM 1789 C LYS A 113 4.269 2.664 -11.253 1.00 0.00 C ATOM 1790 O LYS A 113 3.538 2.383 -12.204 1.00 0.00 O ATOM 1791 CB LYS A 113 5.917 4.331 -12.123 1.00 0.00 C ATOM 1792 CG LYS A 113 6.662 5.638 -11.913 1.00 0.00 C ATOM 1793 CD LYS A 113 8.017 5.409 -11.263 1.00 0.00 C ATOM 1794 CE LYS A 113 9.106 5.204 -12.304 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.460 5.152 -11.686 1.00 0.00 N ATOM 0 H LYS A 113 6.318 4.591 -9.707 1.00 0.00 H new ATOM 0 HA LYS A 113 4.012 4.785 -11.236 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.631 3.508 -12.098 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.469 4.334 -13.116 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.797 6.139 -12.872 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.065 6.302 -11.288 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.269 6.263 -10.634 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.966 4.537 -10.611 1.00 0.00 H new ATOM 0 HE2 LYS A 113 8.919 4.278 -12.848 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.070 6.014 -13.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 11.054 5.906 -12.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.378 5.285 -10.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.896 4.228 -11.881 1.00 0.00 H new ATOM 1809 N LEU A 114 4.618 1.780 -10.324 1.00 0.00 N ATOM 1810 CA LEU A 114 4.152 0.398 -10.369 1.00 0.00 C ATOM 1811 C LEU A 114 2.836 0.242 -9.615 1.00 0.00 C ATOM 1812 O LEU A 114 1.781 0.051 -10.220 1.00 0.00 O ATOM 1813 CB LEU A 114 5.208 -0.536 -9.775 1.00 0.00 C ATOM 1814 CG LEU A 114 4.710 -1.908 -9.319 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.791 -2.911 -10.458 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.510 -2.394 -8.119 1.00 0.00 C ATOM 0 H LEU A 114 5.222 1.996 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 114 3.985 0.130 -11.412 1.00 0.00 H new ATOM 0 HB2 LEU A 114 5.992 -0.685 -10.518 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.668 -0.037 -8.922 1.00 0.00 H new ATOM 0 HG LEU A 114 3.666 -1.813 -9.020 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.432 -3.881 -10.115 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.173 -2.569 -11.288 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.825 -3.003 -10.789 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.142 -3.372 -7.808 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.563 -2.472 -8.391 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.399 -1.687 -7.297 1.00 0.00 H new ATOM 1828 N MET A 115 2.905 0.326 -8.290 1.00 0.00 N ATOM 1829 CA MET A 115 1.718 0.198 -7.454 1.00 0.00 C ATOM 1830 C MET A 115 0.548 0.977 -8.046 1.00 0.00 C ATOM 1831 O MET A 115 -0.599 0.533 -7.992 1.00 0.00 O ATOM 1832 CB MET A 115 2.010 0.694 -6.036 1.00 0.00 C ATOM 1833 CG MET A 115 3.072 -0.120 -5.315 1.00 0.00 C ATOM 1834 SD MET A 115 3.490 0.561 -3.699 1.00 0.00 S ATOM 1835 CE MET A 115 3.793 2.275 -4.121 1.00 0.00 C ATOM 0 H MET A 115 3.770 0.482 -7.773 1.00 0.00 H new ATOM 0 HA MET A 115 1.446 -0.857 -7.414 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.331 1.735 -6.083 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.088 0.670 -5.454 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.719 -1.144 -5.193 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.971 -0.164 -5.930 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.703 2.616 -3.627 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.909 2.369 -5.201 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.952 2.885 -3.792 1.00 0.00 H new ATOM 1845 N LYS A 116 0.845 2.142 -8.613 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.181 2.983 -9.217 1.00 0.00 C ATOM 1847 C LYS A 116 -0.989 2.201 -10.247 1.00 0.00 C ATOM 1848 O LYS A 116 -2.218 2.278 -10.274 1.00 0.00 O ATOM 1849 CB LYS A 116 0.458 4.208 -9.877 1.00 0.00 C ATOM 1850 CG LYS A 116 1.175 3.892 -11.178 1.00 0.00 C ATOM 1851 CD LYS A 116 1.644 5.157 -11.877 1.00 0.00 C ATOM 1852 CE LYS A 116 0.529 5.786 -12.699 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.368 5.117 -14.019 1.00 0.00 N ATOM 0 H LYS A 116 1.789 2.525 -8.667 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.856 3.314 -8.427 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.315 4.952 -10.069 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.166 4.657 -9.181 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.031 3.248 -10.976 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.507 3.337 -11.837 1.00 0.00 H new ATOM 0 HD2 LYS A 116 1.999 5.873 -11.136 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.488 4.924 -12.526 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -0.408 5.727 -12.145 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.743 6.844 -12.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -0.152 5.745 -14.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 1.305 4.908 -14.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.162 4.231 -13.897 1.00 0.00 H new ATOM 1867 N SER A 117 -0.292 1.448 -11.092 1.00 0.00 N ATOM 1868 CA SER A 117 -0.946 0.654 -12.125 1.00 0.00 C ATOM 1869 C SER A 117 -0.679 -0.834 -11.917 1.00 0.00 C ATOM 1870 O SER A 117 -0.915 -1.649 -12.808 1.00 0.00 O ATOM 1871 CB SER A 117 -0.459 1.081 -13.511 1.00 0.00 C ATOM 1872 OG SER A 117 -1.202 2.188 -13.994 1.00 0.00 O ATOM 0 H SER A 117 0.725 1.371 -11.081 1.00 0.00 H new ATOM 0 HA SER A 117 -2.020 0.827 -12.055 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.598 1.341 -13.464 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.551 0.246 -14.206 1.00 0.00 H new ATOM 0 HG SER A 117 -0.871 2.443 -14.880 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.184 -1.179 -10.733 1.00 0.00 N ATOM 1879 CA ASP A 118 0.115 -2.568 -10.405 1.00 0.00 C ATOM 1880 C ASP A 118 -0.958 -3.155 -9.493 1.00 0.00 C ATOM 1881 O ASP A 118 -1.662 -4.092 -9.868 1.00 0.00 O ATOM 1882 CB ASP A 118 1.485 -2.673 -9.734 1.00 0.00 C ATOM 1883 CG ASP A 118 1.951 -4.108 -9.589 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.592 -4.622 -10.529 1.00 0.00 O ATOM 1885 OD2 ASP A 118 1.673 -4.719 -8.535 1.00 0.00 O ATOM 0 H ASP A 118 0.019 -0.516 -9.985 1.00 0.00 H new ATOM 0 HA ASP A 118 0.129 -3.139 -11.333 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.216 -2.114 -10.318 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.441 -2.207 -8.749 1.00 0.00 H new ATOM 1890 N SER A 119 -1.077 -2.596 -8.293 1.00 0.00 N ATOM 1891 CA SER A 119 -2.060 -3.067 -7.324 1.00 0.00 C ATOM 1892 C SER A 119 -3.334 -2.230 -7.394 1.00 0.00 C ATOM 1893 O SER A 119 -4.438 -2.766 -7.494 1.00 0.00 O ATOM 1894 CB SER A 119 -1.480 -3.016 -5.910 1.00 0.00 C ATOM 1895 OG SER A 119 -0.830 -4.231 -5.581 1.00 0.00 O ATOM 0 H SER A 119 -0.505 -1.816 -7.968 1.00 0.00 H new ATOM 0 HA SER A 119 -2.309 -4.100 -7.569 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.773 -2.190 -5.833 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.278 -2.821 -5.193 1.00 0.00 H new ATOM 0 HG SER A 119 -0.332 -4.120 -4.744 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.173 -0.913 -7.340 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.309 0.000 -7.394 1.00 0.00 C ATOM 1903 C TYR A 120 -5.371 -0.510 -8.363 1.00 0.00 C ATOM 1904 O TYR A 120 -6.560 -0.566 -8.048 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.848 1.397 -7.814 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.913 2.195 -8.533 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.835 2.955 -7.825 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -4.995 2.189 -9.920 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.810 3.685 -8.478 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -5.965 2.917 -10.581 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.871 3.663 -9.856 1.00 0.00 C ATOM 1912 OH TYR A 120 -7.839 4.390 -10.510 1.00 0.00 O ATOM 0 H TYR A 120 -2.266 -0.453 -7.259 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.747 0.054 -6.398 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.529 1.947 -6.928 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.976 1.303 -8.462 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -5.789 2.976 -6.746 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.288 1.605 -10.491 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.520 4.270 -7.912 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.014 2.902 -11.660 1.00 0.00 H new ATOM 0 HH TYR A 120 -7.743 4.267 -11.477 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.933 -0.893 -9.572 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.829 -1.407 -10.612 1.00 0.00 C ATOM 1924 C PRO A 121 -6.779 -2.476 -10.083 1.00 0.00 C ATOM 1925 O PRO A 121 -7.997 -2.356 -10.212 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.869 -2.006 -11.643 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.597 -1.254 -11.458 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.530 -0.854 -10.016 1.00 0.00 C ATOM 0 HA PRO A 121 -6.476 -0.627 -11.014 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.725 -3.074 -11.477 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.254 -1.890 -12.656 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.741 -1.873 -11.727 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.571 -0.376 -12.103 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.909 -1.540 -9.440 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.101 0.141 -9.897 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.213 -3.521 -9.488 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.010 -4.612 -8.941 1.00 0.00 C ATOM 1938 C ARG A 122 -7.883 -4.123 -7.789 1.00 0.00 C ATOM 1939 O ARG A 122 -9.062 -4.468 -7.700 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.101 -5.745 -8.460 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.449 -6.524 -9.590 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.714 -7.749 -9.071 1.00 0.00 C ATOM 1943 NE ARG A 122 -4.108 -8.524 -10.151 1.00 0.00 N ATOM 1944 CZ ARG A 122 -4.013 -9.849 -10.141 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -4.481 -10.543 -9.113 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -3.449 -10.482 -11.162 1.00 0.00 N ATOM 0 H ARG A 122 -5.206 -3.635 -9.373 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.659 -4.987 -9.733 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.323 -5.328 -7.821 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.684 -6.431 -7.846 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.210 -6.832 -10.307 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.751 -5.878 -10.123 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -3.939 -7.437 -8.370 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.409 -8.381 -8.517 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.738 -8.020 -10.957 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.915 -10.060 -8.327 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -4.407 -11.560 -9.108 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -3.088 -9.951 -11.955 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -3.376 -11.499 -11.154 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.297 -3.318 -6.909 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.020 -2.782 -5.762 1.00 0.00 C ATOM 1962 C PHE A 123 -9.394 -2.265 -6.179 1.00 0.00 C ATOM 1963 O PHE A 123 -10.378 -2.438 -5.459 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.217 -1.657 -5.106 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.886 -1.071 -3.895 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -7.979 -1.798 -2.719 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.421 0.206 -3.933 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.593 -1.262 -1.603 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -9.035 0.748 -2.819 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.123 0.012 -1.653 1.00 0.00 C ATOM 0 H PHE A 123 -6.323 -3.022 -6.968 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.157 -3.588 -5.042 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.237 -2.039 -4.821 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.050 -0.866 -5.837 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.567 -2.795 -2.674 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.358 0.785 -4.843 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.658 -1.839 -0.692 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.446 1.746 -2.860 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.605 0.432 -0.783 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.452 -1.631 -7.345 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.705 -1.089 -7.858 1.00 0.00 C ATOM 1982 C ILE A 124 -11.695 -2.204 -8.177 1.00 0.00 C ATOM 1983 O ILE A 124 -12.892 -2.077 -7.919 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.475 -0.243 -9.124 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.540 0.928 -8.819 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.802 0.261 -9.672 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -10.086 1.883 -7.780 1.00 0.00 C ATOM 0 H ILE A 124 -8.647 -1.480 -7.952 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.118 -0.452 -7.076 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.005 -0.870 -9.882 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -8.583 0.538 -8.474 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -9.347 1.478 -9.740 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.623 0.857 -10.567 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.438 -0.588 -9.923 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.297 0.875 -8.920 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -9.370 2.688 -7.614 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -11.029 2.302 -8.131 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -10.253 1.347 -6.845 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.188 -3.296 -8.739 1.00 0.00 N ATOM 2000 CA ARG A 125 -12.028 -4.434 -9.093 1.00 0.00 C ATOM 2001 C ARG A 125 -12.571 -5.119 -7.842 1.00 0.00 C ATOM 2002 O ARG A 125 -13.761 -5.419 -7.753 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.237 -5.437 -9.935 1.00 0.00 C ATOM 2004 CG ARG A 125 -11.060 -5.011 -11.383 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.106 -3.834 -11.505 1.00 0.00 C ATOM 2006 NE ARG A 125 -9.663 -3.628 -12.881 1.00 0.00 N ATOM 2007 CZ ARG A 125 -10.220 -2.751 -13.709 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -11.235 -2.002 -13.301 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -9.761 -2.621 -14.947 1.00 0.00 N ATOM 0 H ARG A 125 -10.199 -3.417 -8.959 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.870 -4.064 -9.678 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.255 -5.581 -9.485 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.745 -6.401 -9.908 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -10.681 -5.850 -11.966 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -12.028 -4.741 -11.805 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -10.597 -2.931 -11.143 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.239 -4.003 -10.867 1.00 0.00 H new ATOM 0 HE ARG A 125 -8.883 -4.188 -13.225 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -11.590 -2.098 -12.350 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -11.661 -1.329 -13.939 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -8.980 -3.195 -15.264 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.190 -1.947 -15.582 1.00 0.00 H new ATOM 2023 N SER A 126 -11.689 -5.365 -6.879 1.00 0.00 N ATOM 2024 CA SER A 126 -12.078 -6.019 -5.635 1.00 0.00 C ATOM 2025 C SER A 126 -13.270 -5.312 -4.999 1.00 0.00 C ATOM 2026 O SER A 126 -13.564 -4.159 -5.316 1.00 0.00 O ATOM 2027 CB SER A 126 -10.902 -6.041 -4.656 1.00 0.00 C ATOM 2028 OG SER A 126 -10.680 -4.758 -4.097 1.00 0.00 O ATOM 0 H SER A 126 -10.700 -5.121 -6.936 1.00 0.00 H new ATOM 0 HA SER A 126 -12.367 -7.044 -5.868 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.101 -6.759 -3.860 1.00 0.00 H new ATOM 0 HB3 SER A 126 -10.002 -6.377 -5.171 1.00 0.00 H new ATOM 0 HG SER A 126 -10.606 -4.096 -4.816 1.00 0.00 H new ATOM 2034 N SER A 127 -13.955 -6.011 -4.100 1.00 0.00 N ATOM 2035 CA SER A 127 -15.119 -5.453 -3.421 1.00 0.00 C ATOM 2036 C SER A 127 -14.694 -4.498 -2.311 1.00 0.00 C ATOM 2037 O SER A 127 -15.346 -3.483 -2.066 1.00 0.00 O ATOM 2038 CB SER A 127 -15.984 -6.574 -2.842 1.00 0.00 C ATOM 2039 OG SER A 127 -17.344 -6.182 -2.768 1.00 0.00 O ATOM 0 H SER A 127 -13.724 -6.966 -3.825 1.00 0.00 H new ATOM 0 HA SER A 127 -15.703 -4.895 -4.153 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.892 -7.466 -3.462 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.624 -6.839 -1.848 1.00 0.00 H new ATOM 0 HG SER A 127 -17.876 -6.916 -2.396 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.595 -4.831 -1.641 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.080 -4.002 -0.557 1.00 0.00 C ATOM 2047 C ALA A 128 -13.272 -2.520 -0.861 1.00 0.00 C ATOM 2048 O ALA A 128 -13.536 -1.722 0.038 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.610 -4.308 -0.312 1.00 0.00 C ATOM 0 H ALA A 128 -13.044 -5.669 -1.830 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.643 -4.236 0.346 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.238 -3.682 0.499 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.497 -5.358 -0.042 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.040 -4.103 -1.218 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.135 -2.159 -2.132 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.290 -0.772 -2.553 1.00 0.00 C ATOM 2057 C TYR A 129 -14.764 -0.412 -2.713 1.00 0.00 C ATOM 2058 O TYR A 129 -15.206 0.648 -2.272 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.549 -0.531 -3.870 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.902 0.781 -4.532 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -12.216 1.948 -4.216 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -13.921 0.855 -5.474 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.536 3.149 -4.818 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -14.246 2.052 -6.082 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.551 3.196 -5.750 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.872 4.391 -6.353 1.00 0.00 O ATOM 0 H TYR A 129 -12.917 -2.808 -2.888 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.861 -0.135 -1.780 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.475 -0.557 -3.683 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.772 -1.347 -4.557 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.419 1.915 -3.487 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.468 -0.039 -5.735 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -11.994 4.047 -4.560 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -15.040 2.092 -6.813 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.608 4.251 -6.985 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.519 -1.304 -3.346 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.943 -1.081 -3.565 1.00 0.00 C ATOM 2078 C GLN A 130 -17.687 -0.973 -2.238 1.00 0.00 C ATOM 2079 O GLN A 130 -18.380 0.011 -1.983 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.535 -2.215 -4.404 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.900 -2.350 -5.779 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.592 -1.501 -6.827 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.820 -1.416 -6.862 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.805 -0.867 -7.689 1.00 0.00 N ATOM 0 H GLN A 130 -15.168 -2.187 -3.716 1.00 0.00 H new ATOM 0 HA GLN A 130 -17.059 -0.141 -4.104 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.417 -3.155 -3.865 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.606 -2.048 -4.522 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.850 -2.063 -5.720 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.928 -3.395 -6.087 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.792 -0.966 -7.623 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.214 -0.281 -8.417 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.538 -1.992 -1.397 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.198 -2.011 -0.097 1.00 0.00 C ATOM 2095 C GLU A 131 -18.237 -0.613 0.514 1.00 0.00 C ATOM 2096 O GLU A 131 -19.228 -0.221 1.133 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.478 -2.973 0.851 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.053 -2.555 1.175 1.00 0.00 C ATOM 2099 CD GLU A 131 -15.500 -3.266 2.395 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -16.236 -3.385 3.397 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -14.331 -3.703 2.347 1.00 0.00 O ATOM 0 H GLU A 131 -16.967 -2.814 -1.593 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.222 -2.354 -0.243 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.045 -3.048 1.779 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.464 -3.967 0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.413 -2.762 0.317 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.023 -1.478 1.342 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.154 0.135 0.335 1.00 0.00 N ATOM 2109 CA LEU A 132 -17.064 1.490 0.868 1.00 0.00 C ATOM 2110 C LEU A 132 -18.069 2.412 0.185 1.00 0.00 C ATOM 2111 O LEU A 132 -18.825 3.123 0.848 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.647 2.037 0.686 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.523 1.212 1.312 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.178 1.604 0.719 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -14.512 1.385 2.824 1.00 0.00 C ATOM 0 H LEU A 132 -16.326 -0.174 -0.175 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.299 1.452 1.932 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.450 2.131 -0.382 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.610 3.042 1.107 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.703 0.161 1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.390 1.006 1.177 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.189 1.427 -0.356 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -12.990 2.660 0.911 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -13.705 0.790 3.252 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.358 2.436 3.069 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.465 1.053 3.235 1.00 0.00 H new ATOM 2127 N LEU A 133 -18.074 2.393 -1.143 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.988 3.226 -1.917 1.00 0.00 C ATOM 2129 C LEU A 133 -20.436 2.967 -1.511 1.00 0.00 C ATOM 2130 O LEU A 133 -21.124 3.863 -1.023 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.810 2.959 -3.412 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.648 3.686 -4.090 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.298 3.018 -5.410 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.990 5.153 -4.307 1.00 0.00 C ATOM 0 H LEU A 133 -17.455 1.810 -1.707 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.753 4.270 -1.710 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.675 1.887 -3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.733 3.235 -3.922 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.778 3.629 -3.436 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.469 3.549 -5.878 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -17.009 1.983 -5.229 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -18.164 3.043 -6.071 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.152 5.654 -4.790 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.874 5.231 -4.941 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.190 5.626 -3.346 1.00 0.00 H new ATOM 2146 N SER A 134 -20.891 1.735 -1.715 1.00 0.00 N ATOM 2147 CA SER A 134 -22.257 1.358 -1.371 1.00 0.00 C ATOM 2148 C SER A 134 -22.573 1.721 0.076 1.00 0.00 C ATOM 2149 O SER A 134 -23.610 2.318 0.366 1.00 0.00 O ATOM 2150 CB SER A 134 -22.465 -0.142 -1.590 1.00 0.00 C ATOM 2151 OG SER A 134 -23.782 -0.530 -1.242 1.00 0.00 O ATOM 0 H SER A 134 -20.334 0.981 -2.117 1.00 0.00 H new ATOM 0 HA SER A 134 -22.935 1.910 -2.022 1.00 0.00 H new ATOM 0 HB2 SER A 134 -22.273 -0.390 -2.634 1.00 0.00 H new ATOM 0 HB3 SER A 134 -21.747 -0.703 -0.992 1.00 0.00 H new ATOM 0 HG SER A 134 -23.890 -1.492 -1.392 1.00 0.00 H new ATOM 2157 N GLY A 135 -21.671 1.356 0.982 1.00 0.00 N ATOM 2158 CA GLY A 135 -21.872 1.651 2.389 1.00 0.00 C ATOM 2159 C GLY A 135 -22.834 0.686 3.052 1.00 0.00 C ATOM 2160 O GLY A 135 -24.051 0.862 3.009 1.00 0.00 O ATOM 0 H GLY A 135 -20.805 0.862 0.767 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -20.913 1.615 2.905 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -22.252 2.667 2.493 1.00 0.00 H new ATOM 2164 N PRO A 136 -22.285 -0.364 3.683 1.00 0.00 N ATOM 2165 CA PRO A 136 -23.085 -1.382 4.369 1.00 0.00 C ATOM 2166 C PRO A 136 -23.747 -0.844 5.633 1.00 0.00 C ATOM 2167 O PRO A 136 -24.407 -1.584 6.362 1.00 0.00 O ATOM 2168 CB PRO A 136 -22.059 -2.462 4.721 1.00 0.00 C ATOM 2169 CG PRO A 136 -20.758 -1.739 4.793 1.00 0.00 C ATOM 2170 CD PRO A 136 -20.841 -0.636 3.774 1.00 0.00 C ATOM 0 HA PRO A 136 -23.906 -1.741 3.749 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -22.299 -2.941 5.670 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -22.035 -3.247 3.965 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.590 -1.336 5.792 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.926 -2.409 4.576 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -20.285 0.246 4.091 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -20.429 -0.945 2.813 1.00 0.00 H new ATOM 2178 N SER A 137 -23.567 0.448 5.886 1.00 0.00 N ATOM 2179 CA SER A 137 -24.144 1.084 7.065 1.00 0.00 C ATOM 2180 C SER A 137 -25.656 0.885 7.104 1.00 0.00 C ATOM 2181 O SER A 137 -26.304 0.763 6.064 1.00 0.00 O ATOM 2182 CB SER A 137 -23.815 2.578 7.077 1.00 0.00 C ATOM 2183 OG SER A 137 -23.871 3.102 8.392 1.00 0.00 O ATOM 0 H SER A 137 -23.026 1.075 5.291 1.00 0.00 H new ATOM 0 HA SER A 137 -23.710 0.616 7.949 1.00 0.00 H new ATOM 0 HB2 SER A 137 -22.820 2.738 6.661 1.00 0.00 H new ATOM 0 HB3 SER A 137 -24.518 3.113 6.439 1.00 0.00 H new ATOM 0 HG SER A 137 -23.655 4.058 8.373 1.00 0.00 H new ATOM 2189 N SER A 138 -26.211 0.853 8.311 1.00 0.00 N ATOM 2190 CA SER A 138 -27.647 0.664 8.487 1.00 0.00 C ATOM 2191 C SER A 138 -28.434 1.646 7.623 1.00 0.00 C ATOM 2192 O SER A 138 -29.368 1.261 6.922 1.00 0.00 O ATOM 2193 CB SER A 138 -28.029 0.842 9.958 1.00 0.00 C ATOM 2194 OG SER A 138 -27.909 -0.379 10.667 1.00 0.00 O ATOM 0 H SER A 138 -25.689 0.955 9.181 1.00 0.00 H new ATOM 0 HA SER A 138 -27.897 -0.350 8.174 1.00 0.00 H new ATOM 0 HB2 SER A 138 -27.388 1.596 10.415 1.00 0.00 H new ATOM 0 HB3 SER A 138 -29.053 1.209 10.029 1.00 0.00 H new ATOM 0 HG SER A 138 -28.157 -0.239 11.605 1.00 0.00 H new ATOM 2200 N GLY A 139 -28.047 2.917 7.681 1.00 0.00 N ATOM 2201 CA GLY A 139 -28.726 3.934 6.900 1.00 0.00 C ATOM 2202 C GLY A 139 -27.826 4.557 5.851 1.00 0.00 C ATOM 2203 O GLY A 139 -27.689 4.027 4.748 1.00 0.00 O ATOM 0 H GLY A 139 -27.276 3.260 8.254 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -29.596 3.493 6.413 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -29.095 4.713 7.567 1.00 0.00 H new TER 2207 GLY A 139