USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 985 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 42 MET CE :methyl -143:sc= -0.615 (180deg=-0.0353) USER MOD Set 1.2: A 56 ASN : amide:sc= -2.53 K(o=-3.1,f=-0.18) USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 82 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 13 GLN : amide:sc= 0.291 K(o=0.29,f=-4.4!) USER MOD Set 3.2: A 115 THR OG1 : rot 180:sc= 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 34:sc= 0.13 USER MOD Single : A 10 GLN : amide:sc= -2.8 K(o=-2.8,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 165:sc= -0.0106 (180deg=-0.16) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 23:sc= 0.146 USER MOD Single : A 32 MET CE :methyl -151:sc= -1.13 (180deg=-2.19!) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.35 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -2.48 K(o=-2.5,f=-1.7) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-1.5) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 42:sc= 0.105 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.797 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.5!) USER MOD Single : A 76 ASN : amide:sc= -2.72! C(o=-2.7!,f=-2.3!) USER MOD Single : A 80 SER OG : rot 180:sc= -0.125 USER MOD Single : A 84 SER OG : rot 180:sc= -0.203 USER MOD Single : A 85 ASN : amide:sc= -1.33! C(o=-1.3!,f=-2!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -36:sc= 0.045 USER MOD Single : A 94 TYR OH : rot -54:sc= 0.785 USER MOD Single : A 95 TYR OH : rot 180:sc= -0.0532 USER MOD Single : A 98 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.974) USER MOD Single : A 101 LYS NZ :NH3+ 165:sc= -0.0744 (180deg=-0.329) USER MOD Single : A 103 SER OG : rot 180:sc= -0.285 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 76:sc= 1.19 USER MOD Single : A 122 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0047) USER MOD Single : A 124 SER OG : rot 18:sc= 0.342 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.619 33.549 0.068 1.00 0.00 N ATOM 2 CA GLY A 1 3.975 33.515 -0.450 1.00 0.00 C ATOM 3 C GLY A 1 4.111 34.254 -1.766 1.00 0.00 C ATOM 4 O GLY A 1 3.476 33.893 -2.757 1.00 0.00 O ATOM 0 H1 GLY A 1 2.578 33.030 0.968 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.332 34.536 0.224 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.975 33.105 -0.617 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.652 33.956 0.282 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.283 32.478 -0.585 1.00 0.00 H new ATOM 8 N SER A 2 4.940 35.293 -1.777 1.00 0.00 N ATOM 9 CA SER A 2 5.153 36.089 -2.980 1.00 0.00 C ATOM 10 C SER A 2 6.054 35.352 -3.966 1.00 0.00 C ATOM 11 O SER A 2 6.622 34.308 -3.644 1.00 0.00 O ATOM 12 CB SER A 2 5.770 37.441 -2.620 1.00 0.00 C ATOM 13 OG SER A 2 7.103 37.288 -2.163 1.00 0.00 O ATOM 0 H SER A 2 5.475 35.603 -0.966 1.00 0.00 H new ATOM 0 HA SER A 2 4.185 36.254 -3.453 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.754 38.095 -3.492 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.171 37.924 -1.848 1.00 0.00 H new ATOM 0 HG SER A 2 7.476 38.167 -1.941 1.00 0.00 H new ATOM 19 N SER A 3 6.180 35.903 -5.169 1.00 0.00 N ATOM 20 CA SER A 3 7.009 35.297 -6.205 1.00 0.00 C ATOM 21 C SER A 3 6.467 33.928 -6.603 1.00 0.00 C ATOM 22 O SER A 3 7.197 32.938 -6.617 1.00 0.00 O ATOM 23 CB SER A 3 8.454 35.164 -5.718 1.00 0.00 C ATOM 24 OG SER A 3 9.196 36.339 -5.995 1.00 0.00 O ATOM 0 H SER A 3 5.719 36.768 -5.451 1.00 0.00 H new ATOM 0 HA SER A 3 6.986 35.946 -7.080 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.463 34.969 -4.646 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.927 34.309 -6.202 1.00 0.00 H new ATOM 0 HG SER A 3 10.115 36.229 -5.673 1.00 0.00 H new ATOM 30 N GLY A 4 5.178 33.880 -6.926 1.00 0.00 N ATOM 31 CA GLY A 4 4.558 32.629 -7.320 1.00 0.00 C ATOM 32 C GLY A 4 3.048 32.663 -7.187 1.00 0.00 C ATOM 33 O GLY A 4 2.485 33.629 -6.674 1.00 0.00 O ATOM 0 H GLY A 4 4.552 34.686 -6.922 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.824 32.405 -8.353 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.956 31.821 -6.706 1.00 0.00 H new ATOM 37 N SER A 5 2.391 31.605 -7.652 1.00 0.00 N ATOM 38 CA SER A 5 0.936 31.520 -7.588 1.00 0.00 C ATOM 39 C SER A 5 0.498 30.250 -6.865 1.00 0.00 C ATOM 40 O SER A 5 1.161 29.216 -6.945 1.00 0.00 O ATOM 41 CB SER A 5 0.340 31.551 -8.997 1.00 0.00 C ATOM 42 OG SER A 5 0.597 32.791 -9.632 1.00 0.00 O ATOM 0 H SER A 5 2.843 30.795 -8.077 1.00 0.00 H new ATOM 0 HA SER A 5 0.570 32.380 -7.028 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.761 30.740 -9.591 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.736 31.382 -8.944 1.00 0.00 H new ATOM 0 HG SER A 5 0.208 32.785 -10.531 1.00 0.00 H new ATOM 48 N SER A 6 -0.625 30.336 -6.160 1.00 0.00 N ATOM 49 CA SER A 6 -1.152 29.196 -5.419 1.00 0.00 C ATOM 50 C SER A 6 -2.676 29.241 -5.364 1.00 0.00 C ATOM 51 O SER A 6 -3.266 30.259 -5.004 1.00 0.00 O ATOM 52 CB SER A 6 -0.579 29.174 -4.000 1.00 0.00 C ATOM 53 OG SER A 6 -0.918 30.355 -3.295 1.00 0.00 O ATOM 0 H SER A 6 -1.188 31.183 -6.086 1.00 0.00 H new ATOM 0 HA SER A 6 -0.852 28.286 -5.939 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.960 28.305 -3.464 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.505 29.071 -4.044 1.00 0.00 H new ATOM 0 HG SER A 6 -1.805 30.661 -3.577 1.00 0.00 H new ATOM 59 N GLY A 7 -3.308 28.128 -5.724 1.00 0.00 N ATOM 60 CA GLY A 7 -4.758 28.060 -5.709 1.00 0.00 C ATOM 61 C GLY A 7 -5.289 27.272 -4.528 1.00 0.00 C ATOM 62 O GLY A 7 -4.667 27.238 -3.466 1.00 0.00 O ATOM 0 H GLY A 7 -2.842 27.272 -6.026 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.166 29.070 -5.681 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.107 27.601 -6.634 1.00 0.00 H new ATOM 66 N GLU A 8 -6.444 26.639 -4.712 1.00 0.00 N ATOM 67 CA GLU A 8 -7.059 25.851 -3.651 1.00 0.00 C ATOM 68 C GLU A 8 -6.482 24.438 -3.618 1.00 0.00 C ATOM 69 O GLU A 8 -6.529 23.713 -4.612 1.00 0.00 O ATOM 70 CB GLU A 8 -8.576 25.789 -3.845 1.00 0.00 C ATOM 71 CG GLU A 8 -9.289 24.944 -2.803 1.00 0.00 C ATOM 72 CD GLU A 8 -9.513 25.690 -1.502 1.00 0.00 C ATOM 73 OE1 GLU A 8 -8.587 25.710 -0.664 1.00 0.00 O ATOM 74 OE2 GLU A 8 -10.613 26.252 -1.321 1.00 0.00 O ATOM 0 H GLU A 8 -6.972 26.657 -5.585 1.00 0.00 H new ATOM 0 HA GLU A 8 -6.841 26.337 -2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.979 26.801 -3.817 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -8.791 25.387 -4.835 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -10.250 24.618 -3.201 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -8.704 24.046 -2.606 1.00 0.00 H new ATOM 81 N LEU A 9 -5.936 24.055 -2.469 1.00 0.00 N ATOM 82 CA LEU A 9 -5.349 22.730 -2.305 1.00 0.00 C ATOM 83 C LEU A 9 -6.217 21.664 -2.965 1.00 0.00 C ATOM 84 O LEU A 9 -7.402 21.882 -3.214 1.00 0.00 O ATOM 85 CB LEU A 9 -5.170 22.410 -0.820 1.00 0.00 C ATOM 86 CG LEU A 9 -4.741 20.981 -0.488 1.00 0.00 C ATOM 87 CD1 LEU A 9 -4.047 20.931 0.864 1.00 0.00 C ATOM 88 CD2 LEU A 9 -5.942 20.046 -0.507 1.00 0.00 C ATOM 0 H LEU A 9 -5.888 24.643 -1.637 1.00 0.00 H new ATOM 0 HA LEU A 9 -4.373 22.730 -2.791 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -4.429 23.095 -0.408 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -6.111 22.613 -0.309 1.00 0.00 H new ATOM 0 HG LEU A 9 -4.034 20.649 -1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -3.749 19.905 1.082 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -3.163 21.569 0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.730 21.283 1.637 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -5.618 19.033 -0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.672 20.377 0.231 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -6.397 20.058 -1.498 1.00 0.00 H new ATOM 100 N GLN A 10 -5.618 20.511 -3.244 1.00 0.00 N ATOM 101 CA GLN A 10 -6.338 19.410 -3.875 1.00 0.00 C ATOM 102 C GLN A 10 -5.540 18.114 -3.782 1.00 0.00 C ATOM 103 O GLN A 10 -4.397 18.043 -4.235 1.00 0.00 O ATOM 104 CB GLN A 10 -6.633 19.738 -5.339 1.00 0.00 C ATOM 105 CG GLN A 10 -6.722 18.510 -6.232 1.00 0.00 C ATOM 106 CD GLN A 10 -8.085 17.850 -6.181 1.00 0.00 C ATOM 107 OE1 GLN A 10 -8.706 17.601 -7.215 1.00 0.00 O ATOM 108 NE2 GLN A 10 -8.560 17.562 -4.975 1.00 0.00 N ATOM 0 H GLN A 10 -4.637 20.315 -3.044 1.00 0.00 H new ATOM 0 HA GLN A 10 -7.280 19.274 -3.344 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -7.572 20.288 -5.397 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -5.853 20.398 -5.719 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -6.499 18.796 -7.260 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -5.962 17.790 -5.930 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.012 17.786 -4.144 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -9.473 17.117 -4.879 1.00 0.00 H new ATOM 117 N VAL A 11 -6.149 17.090 -3.192 1.00 0.00 N ATOM 118 CA VAL A 11 -5.495 15.796 -3.041 1.00 0.00 C ATOM 119 C VAL A 11 -5.129 15.203 -4.397 1.00 0.00 C ATOM 120 O VAL A 11 -6.004 14.877 -5.200 1.00 0.00 O ATOM 121 CB VAL A 11 -6.392 14.799 -2.283 1.00 0.00 C ATOM 122 CG1 VAL A 11 -5.759 13.417 -2.264 1.00 0.00 C ATOM 123 CG2 VAL A 11 -6.658 15.292 -0.868 1.00 0.00 C ATOM 0 H VAL A 11 -7.094 17.132 -2.811 1.00 0.00 H new ATOM 0 HA VAL A 11 -4.586 15.967 -2.465 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.346 14.727 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -6.408 12.727 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -5.625 13.064 -3.287 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -4.790 13.467 -1.768 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -7.293 14.576 -0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -5.713 15.394 -0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -7.159 16.259 -0.908 1.00 0.00 H new ATOM 133 N ILE A 12 -3.831 15.066 -4.645 1.00 0.00 N ATOM 134 CA ILE A 12 -3.349 14.510 -5.904 1.00 0.00 C ATOM 135 C ILE A 12 -3.004 13.032 -5.756 1.00 0.00 C ATOM 136 O ILE A 12 -2.098 12.669 -5.006 1.00 0.00 O ATOM 137 CB ILE A 12 -2.109 15.267 -6.415 1.00 0.00 C ATOM 138 CG1 ILE A 12 -2.466 16.722 -6.726 1.00 0.00 C ATOM 139 CG2 ILE A 12 -1.540 14.580 -7.647 1.00 0.00 C ATOM 140 CD1 ILE A 12 -3.496 16.871 -7.824 1.00 0.00 C ATOM 0 H ILE A 12 -3.094 15.332 -3.992 1.00 0.00 H new ATOM 0 HA ILE A 12 -4.156 14.621 -6.628 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.348 15.258 -5.635 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.842 17.197 -5.820 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.560 17.256 -7.014 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -0.664 15.127 -7.996 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.254 13.559 -7.395 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.294 14.561 -8.434 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -3.700 17.929 -7.990 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.115 16.426 -8.743 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.416 16.366 -7.531 1.00 0.00 H new ATOM 152 N GLN A 13 -3.731 12.185 -6.477 1.00 0.00 N ATOM 153 CA GLN A 13 -3.500 10.747 -6.427 1.00 0.00 C ATOM 154 C GLN A 13 -3.158 10.202 -7.810 1.00 0.00 C ATOM 155 O GLN A 13 -4.033 9.824 -8.589 1.00 0.00 O ATOM 156 CB GLN A 13 -4.733 10.030 -5.874 1.00 0.00 C ATOM 157 CG GLN A 13 -4.809 10.034 -4.356 1.00 0.00 C ATOM 158 CD GLN A 13 -5.707 8.939 -3.814 1.00 0.00 C ATOM 159 OE1 GLN A 13 -6.535 8.385 -4.537 1.00 0.00 O ATOM 160 NE2 GLN A 13 -5.548 8.622 -2.534 1.00 0.00 N ATOM 0 H GLN A 13 -4.485 12.470 -7.102 1.00 0.00 H new ATOM 0 HA GLN A 13 -2.654 10.563 -5.765 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -5.629 10.503 -6.276 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -4.732 8.999 -6.227 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.807 9.913 -3.945 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -5.178 11.002 -4.017 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -4.849 9.107 -1.971 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -6.125 7.893 -2.114 1.00 0.00 H new ATOM 169 N PRO A 14 -1.854 10.159 -8.124 1.00 0.00 N ATOM 170 CA PRO A 14 -1.367 9.661 -9.413 1.00 0.00 C ATOM 171 C PRO A 14 -1.552 8.155 -9.562 1.00 0.00 C ATOM 172 O PRO A 14 -1.823 7.659 -10.655 1.00 0.00 O ATOM 173 CB PRO A 14 0.122 10.017 -9.391 1.00 0.00 C ATOM 174 CG PRO A 14 0.473 10.085 -7.944 1.00 0.00 C ATOM 175 CD PRO A 14 -0.756 10.592 -7.243 1.00 0.00 C ATOM 0 HA PRO A 14 -1.912 10.098 -10.250 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.717 9.264 -9.908 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.309 10.968 -9.889 1.00 0.00 H new ATOM 0 HG2 PRO A 14 0.761 9.104 -7.566 1.00 0.00 H new ATOM 0 HG3 PRO A 14 1.319 10.752 -7.779 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -0.852 10.168 -6.243 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -0.736 11.676 -7.129 1.00 0.00 H new ATOM 183 N GLU A 15 -1.405 7.433 -8.455 1.00 0.00 N ATOM 184 CA GLU A 15 -1.557 5.983 -8.463 1.00 0.00 C ATOM 185 C GLU A 15 -2.997 5.585 -8.154 1.00 0.00 C ATOM 186 O GLU A 15 -3.344 5.309 -7.005 1.00 0.00 O ATOM 187 CB GLU A 15 -0.609 5.343 -7.447 1.00 0.00 C ATOM 188 CG GLU A 15 0.841 5.314 -7.900 1.00 0.00 C ATOM 189 CD GLU A 15 1.080 4.326 -9.026 1.00 0.00 C ATOM 190 OE1 GLU A 15 0.528 3.208 -8.963 1.00 0.00 O ATOM 191 OE2 GLU A 15 1.820 4.673 -9.971 1.00 0.00 O ATOM 0 H GLU A 15 -1.181 7.829 -7.542 1.00 0.00 H new ATOM 0 HA GLU A 15 -1.305 5.622 -9.460 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.676 5.890 -6.506 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.939 4.323 -7.247 1.00 0.00 H new ATOM 0 HG2 GLU A 15 1.136 6.311 -8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 15 1.477 5.056 -7.054 1.00 0.00 H new ATOM 198 N LYS A 16 -3.832 5.557 -9.187 1.00 0.00 N ATOM 199 CA LYS A 16 -5.235 5.192 -9.028 1.00 0.00 C ATOM 200 C LYS A 16 -5.380 3.969 -8.129 1.00 0.00 C ATOM 201 O LYS A 16 -6.298 3.893 -7.312 1.00 0.00 O ATOM 202 CB LYS A 16 -5.868 4.913 -10.393 1.00 0.00 C ATOM 203 CG LYS A 16 -7.378 5.076 -10.407 1.00 0.00 C ATOM 204 CD LYS A 16 -7.781 6.526 -10.624 1.00 0.00 C ATOM 205 CE LYS A 16 -7.638 6.931 -12.083 1.00 0.00 C ATOM 206 NZ LYS A 16 -8.680 6.300 -12.939 1.00 0.00 N ATOM 0 H LYS A 16 -3.561 5.783 -10.144 1.00 0.00 H new ATOM 0 HA LYS A 16 -5.752 6.029 -8.559 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -5.431 5.586 -11.131 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.618 3.897 -10.700 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.804 4.457 -11.196 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -7.792 4.720 -9.464 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.813 6.670 -10.305 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.162 7.174 -10.003 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.707 8.016 -12.167 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.650 6.645 -12.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.714 6.784 -13.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.449 5.296 -13.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.606 6.378 -12.473 1.00 0.00 H new ATOM 220 N SER A 17 -4.468 3.014 -8.283 1.00 0.00 N ATOM 221 CA SER A 17 -4.497 1.793 -7.487 1.00 0.00 C ATOM 222 C SER A 17 -3.094 1.214 -7.330 1.00 0.00 C ATOM 223 O SER A 17 -2.214 1.457 -8.155 1.00 0.00 O ATOM 224 CB SER A 17 -5.419 0.758 -8.134 1.00 0.00 C ATOM 225 OG SER A 17 -4.843 0.231 -9.317 1.00 0.00 O ATOM 0 H SER A 17 -3.700 3.063 -8.952 1.00 0.00 H new ATOM 0 HA SER A 17 -4.881 2.043 -6.498 1.00 0.00 H new ATOM 0 HB2 SER A 17 -5.614 -0.050 -7.430 1.00 0.00 H new ATOM 0 HB3 SER A 17 -6.380 1.217 -8.367 1.00 0.00 H new ATOM 0 HG SER A 17 -5.451 -0.429 -9.711 1.00 0.00 H new ATOM 231 N VAL A 18 -2.894 0.446 -6.264 1.00 0.00 N ATOM 232 CA VAL A 18 -1.599 -0.170 -5.998 1.00 0.00 C ATOM 233 C VAL A 18 -1.682 -1.689 -6.097 1.00 0.00 C ATOM 234 O VAL A 18 -2.731 -2.282 -5.843 1.00 0.00 O ATOM 235 CB VAL A 18 -1.071 0.214 -4.603 1.00 0.00 C ATOM 236 CG1 VAL A 18 0.243 -0.497 -4.315 1.00 0.00 C ATOM 237 CG2 VAL A 18 -0.906 1.722 -4.492 1.00 0.00 C ATOM 0 H VAL A 18 -3.612 0.235 -5.571 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.910 0.203 -6.755 1.00 0.00 H new ATOM 0 HB VAL A 18 -1.800 -0.104 -3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.601 -0.213 -3.325 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.088 -1.575 -4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.982 -0.212 -5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.532 1.975 -3.500 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.198 2.067 -5.245 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.870 2.206 -4.651 1.00 0.00 H new ATOM 247 N SER A 19 -0.569 -2.314 -6.468 1.00 0.00 N ATOM 248 CA SER A 19 -0.517 -3.765 -6.605 1.00 0.00 C ATOM 249 C SER A 19 0.654 -4.343 -5.815 1.00 0.00 C ATOM 250 O SER A 19 1.808 -3.976 -6.035 1.00 0.00 O ATOM 251 CB SER A 19 -0.395 -4.156 -8.079 1.00 0.00 C ATOM 252 OG SER A 19 -1.005 -5.410 -8.326 1.00 0.00 O ATOM 0 H SER A 19 0.308 -1.839 -6.679 1.00 0.00 H new ATOM 0 HA SER A 19 -1.443 -4.177 -6.203 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.862 -3.392 -8.701 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.657 -4.198 -8.361 1.00 0.00 H new ATOM 0 HG SER A 19 -0.915 -5.636 -9.275 1.00 0.00 H new ATOM 258 N VAL A 20 0.347 -5.250 -4.893 1.00 0.00 N ATOM 259 CA VAL A 20 1.372 -5.881 -4.070 1.00 0.00 C ATOM 260 C VAL A 20 1.016 -7.331 -3.764 1.00 0.00 C ATOM 261 O VAL A 20 0.020 -7.855 -4.262 1.00 0.00 O ATOM 262 CB VAL A 20 1.574 -5.122 -2.745 1.00 0.00 C ATOM 263 CG1 VAL A 20 2.602 -4.014 -2.915 1.00 0.00 C ATOM 264 CG2 VAL A 20 0.250 -4.560 -2.247 1.00 0.00 C ATOM 0 H VAL A 20 -0.603 -5.564 -4.697 1.00 0.00 H new ATOM 0 HA VAL A 20 2.299 -5.851 -4.642 1.00 0.00 H new ATOM 0 HB VAL A 20 1.950 -5.822 -1.999 1.00 0.00 H new ATOM 0 HG11 VAL A 20 2.731 -3.489 -1.968 1.00 0.00 H new ATOM 0 HG12 VAL A 20 3.554 -4.445 -3.224 1.00 0.00 H new ATOM 0 HG13 VAL A 20 2.258 -3.312 -3.675 1.00 0.00 H new ATOM 0 HG21 VAL A 20 0.410 -4.027 -1.310 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.156 -3.874 -2.990 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.453 -5.376 -2.084 1.00 0.00 H new ATOM 274 N ALA A 21 1.836 -7.974 -2.939 1.00 0.00 N ATOM 275 CA ALA A 21 1.606 -9.364 -2.564 1.00 0.00 C ATOM 276 C ALA A 21 1.644 -9.537 -1.049 1.00 0.00 C ATOM 277 O ALA A 21 2.424 -8.881 -0.359 1.00 0.00 O ATOM 278 CB ALA A 21 2.636 -10.267 -3.226 1.00 0.00 C ATOM 0 H ALA A 21 2.665 -7.555 -2.518 1.00 0.00 H new ATOM 0 HA ALA A 21 0.613 -9.649 -2.912 1.00 0.00 H new ATOM 0 HB1 ALA A 21 2.452 -11.302 -2.937 1.00 0.00 H new ATOM 0 HB2 ALA A 21 2.559 -10.174 -4.309 1.00 0.00 H new ATOM 0 HB3 ALA A 21 3.636 -9.973 -2.907 1.00 0.00 H new ATOM 284 N ALA A 22 0.795 -10.423 -0.538 1.00 0.00 N ATOM 285 CA ALA A 22 0.733 -10.683 0.895 1.00 0.00 C ATOM 286 C ALA A 22 2.131 -10.780 1.496 1.00 0.00 C ATOM 287 O ALA A 22 2.830 -11.774 1.309 1.00 0.00 O ATOM 288 CB ALA A 22 -0.050 -11.958 1.167 1.00 0.00 C ATOM 0 H ALA A 22 0.141 -10.973 -1.095 1.00 0.00 H new ATOM 0 HA ALA A 22 0.219 -9.847 1.369 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -0.088 -12.139 2.241 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -1.064 -11.852 0.781 1.00 0.00 H new ATOM 0 HB3 ALA A 22 0.440 -12.798 0.674 1.00 0.00 H new ATOM 294 N GLY A 23 2.533 -9.739 2.220 1.00 0.00 N ATOM 295 CA GLY A 23 3.846 -9.727 2.837 1.00 0.00 C ATOM 296 C GLY A 23 4.788 -8.739 2.177 1.00 0.00 C ATOM 297 O GLY A 23 5.978 -8.704 2.489 1.00 0.00 O ATOM 0 H GLY A 23 1.972 -8.904 2.390 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.745 -9.478 3.893 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.278 -10.726 2.785 1.00 0.00 H new ATOM 301 N GLU A 24 4.254 -7.936 1.262 1.00 0.00 N ATOM 302 CA GLU A 24 5.057 -6.945 0.555 1.00 0.00 C ATOM 303 C GLU A 24 4.752 -5.537 1.059 1.00 0.00 C ATOM 304 O GLU A 24 3.947 -5.354 1.972 1.00 0.00 O ATOM 305 CB GLU A 24 4.799 -7.027 -0.951 1.00 0.00 C ATOM 306 CG GLU A 24 5.126 -8.384 -1.551 1.00 0.00 C ATOM 307 CD GLU A 24 6.595 -8.738 -1.429 1.00 0.00 C ATOM 308 OE1 GLU A 24 7.441 -7.906 -1.821 1.00 0.00 O ATOM 309 OE2 GLU A 24 6.900 -9.847 -0.942 1.00 0.00 O ATOM 0 H GLU A 24 3.270 -7.952 0.993 1.00 0.00 H new ATOM 0 HA GLU A 24 6.108 -7.161 0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.751 -6.796 -1.145 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.392 -6.264 -1.455 1.00 0.00 H new ATOM 0 HG2 GLU A 24 4.529 -9.150 -1.055 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.841 -8.390 -2.603 1.00 0.00 H new ATOM 316 N SER A 25 5.400 -4.546 0.456 1.00 0.00 N ATOM 317 CA SER A 25 5.202 -3.155 0.846 1.00 0.00 C ATOM 318 C SER A 25 4.343 -2.421 -0.180 1.00 0.00 C ATOM 319 O SER A 25 4.630 -2.444 -1.376 1.00 0.00 O ATOM 320 CB SER A 25 6.550 -2.448 0.998 1.00 0.00 C ATOM 321 OG SER A 25 7.307 -2.531 -0.197 1.00 0.00 O ATOM 0 H SER A 25 6.067 -4.680 -0.304 1.00 0.00 H new ATOM 0 HA SER A 25 4.684 -3.143 1.805 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.388 -1.402 1.258 1.00 0.00 H new ATOM 0 HB3 SER A 25 7.109 -2.897 1.819 1.00 0.00 H new ATOM 0 HG SER A 25 6.705 -2.677 -0.956 1.00 0.00 H new ATOM 327 N ALA A 26 3.288 -1.770 0.299 1.00 0.00 N ATOM 328 CA ALA A 26 2.388 -1.027 -0.575 1.00 0.00 C ATOM 329 C ALA A 26 2.631 0.474 -0.465 1.00 0.00 C ATOM 330 O ALA A 26 2.495 1.059 0.611 1.00 0.00 O ATOM 331 CB ALA A 26 0.940 -1.355 -0.242 1.00 0.00 C ATOM 0 H ALA A 26 3.036 -1.742 1.287 1.00 0.00 H new ATOM 0 HA ALA A 26 2.590 -1.327 -1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.279 -0.793 -0.902 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.768 -2.423 -0.379 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.734 -1.084 0.794 1.00 0.00 H new ATOM 337 N THR A 27 2.991 1.095 -1.584 1.00 0.00 N ATOM 338 CA THR A 27 3.255 2.528 -1.613 1.00 0.00 C ATOM 339 C THR A 27 2.001 3.310 -1.989 1.00 0.00 C ATOM 340 O THR A 27 1.538 3.250 -3.128 1.00 0.00 O ATOM 341 CB THR A 27 4.379 2.872 -2.608 1.00 0.00 C ATOM 342 OG1 THR A 27 5.423 1.896 -2.525 1.00 0.00 O ATOM 343 CG2 THR A 27 4.947 4.255 -2.324 1.00 0.00 C ATOM 0 H THR A 27 3.106 0.627 -2.483 1.00 0.00 H new ATOM 0 HA THR A 27 3.570 2.812 -0.609 1.00 0.00 H new ATOM 0 HB THR A 27 3.958 2.868 -3.614 1.00 0.00 H new ATOM 0 HG1 THR A 27 6.133 2.121 -3.162 1.00 0.00 H new ATOM 0 HG21 THR A 27 5.739 4.477 -3.039 1.00 0.00 H new ATOM 0 HG22 THR A 27 4.156 4.999 -2.417 1.00 0.00 H new ATOM 0 HG23 THR A 27 5.353 4.281 -1.313 1.00 0.00 H new ATOM 351 N LEU A 28 1.457 4.045 -1.025 1.00 0.00 N ATOM 352 CA LEU A 28 0.257 4.841 -1.255 1.00 0.00 C ATOM 353 C LEU A 28 0.617 6.281 -1.607 1.00 0.00 C ATOM 354 O LEU A 28 0.612 7.160 -0.746 1.00 0.00 O ATOM 355 CB LEU A 28 -0.641 4.816 -0.017 1.00 0.00 C ATOM 356 CG LEU A 28 -1.031 3.431 0.501 1.00 0.00 C ATOM 357 CD1 LEU A 28 -1.733 3.543 1.846 1.00 0.00 C ATOM 358 CD2 LEU A 28 -1.916 2.713 -0.507 1.00 0.00 C ATOM 0 H LEU A 28 1.828 4.106 -0.077 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.282 4.405 -2.096 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.135 5.353 0.785 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.554 5.368 -0.243 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.122 2.846 0.636 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.003 2.548 2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.065 4.015 2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.634 4.146 1.737 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.183 1.729 -0.121 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.822 3.295 -0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.378 2.599 -1.448 1.00 0.00 H new ATOM 370 N ARG A 29 0.928 6.514 -2.878 1.00 0.00 N ATOM 371 CA ARG A 29 1.289 7.847 -3.344 1.00 0.00 C ATOM 372 C ARG A 29 0.236 8.872 -2.932 1.00 0.00 C ATOM 373 O ARG A 29 -0.959 8.576 -2.915 1.00 0.00 O ATOM 374 CB ARG A 29 1.454 7.852 -4.865 1.00 0.00 C ATOM 375 CG ARG A 29 2.866 7.528 -5.326 1.00 0.00 C ATOM 376 CD ARG A 29 3.729 8.778 -5.396 1.00 0.00 C ATOM 377 NE ARG A 29 3.621 9.446 -6.691 1.00 0.00 N ATOM 378 CZ ARG A 29 3.999 10.701 -6.904 1.00 0.00 C ATOM 379 NH1 ARG A 29 4.508 11.421 -5.914 1.00 0.00 N ATOM 380 NH2 ARG A 29 3.868 11.239 -8.110 1.00 0.00 N ATOM 0 H ARG A 29 0.937 5.797 -3.603 1.00 0.00 H new ATOM 0 HA ARG A 29 2.237 8.121 -2.882 1.00 0.00 H new ATOM 0 HB2 ARG A 29 0.764 7.128 -5.299 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.171 8.832 -5.249 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.318 6.810 -4.641 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.830 7.054 -6.307 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.432 9.468 -4.606 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.770 8.511 -5.211 1.00 0.00 H new ATOM 0 HE ARG A 29 3.234 8.920 -7.474 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.610 11.011 -4.986 1.00 0.00 H new ATOM 0 HH12 ARG A 29 4.797 12.385 -6.081 1.00 0.00 H new ATOM 0 HH21 ARG A 29 3.477 10.688 -8.874 1.00 0.00 H new ATOM 0 HH22 ARG A 29 4.159 12.203 -8.273 1.00 0.00 H new ATOM 394 N CYS A 30 0.688 10.076 -2.600 1.00 0.00 N ATOM 395 CA CYS A 30 -0.214 11.145 -2.187 1.00 0.00 C ATOM 396 C CYS A 30 0.531 12.471 -2.068 1.00 0.00 C ATOM 397 O CYS A 30 1.652 12.521 -1.563 1.00 0.00 O ATOM 398 CB CYS A 30 -0.873 10.796 -0.851 1.00 0.00 C ATOM 399 SG CYS A 30 -2.016 12.072 -0.230 1.00 0.00 S ATOM 0 H CYS A 30 1.674 10.336 -2.609 1.00 0.00 H new ATOM 0 HA CYS A 30 -0.986 11.250 -2.950 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.417 9.858 -0.961 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -0.094 10.628 -0.107 1.00 0.00 H new ATOM 404 N ALA A 31 -0.100 13.542 -2.537 1.00 0.00 N ATOM 405 CA ALA A 31 0.502 14.868 -2.482 1.00 0.00 C ATOM 406 C ALA A 31 -0.551 15.957 -2.656 1.00 0.00 C ATOM 407 O ALA A 31 -1.538 15.771 -3.367 1.00 0.00 O ATOM 408 CB ALA A 31 1.583 15.002 -3.545 1.00 0.00 C ATOM 0 H ALA A 31 -1.028 13.517 -2.959 1.00 0.00 H new ATOM 0 HA ALA A 31 0.957 14.992 -1.499 1.00 0.00 H new ATOM 0 HB1 ALA A 31 2.024 15.997 -3.492 1.00 0.00 H new ATOM 0 HB2 ALA A 31 2.356 14.253 -3.374 1.00 0.00 H new ATOM 0 HB3 ALA A 31 1.144 14.852 -4.531 1.00 0.00 H new ATOM 414 N MET A 32 -0.335 17.094 -2.002 1.00 0.00 N ATOM 415 CA MET A 32 -1.266 18.212 -2.085 1.00 0.00 C ATOM 416 C MET A 32 -0.714 19.313 -2.985 1.00 0.00 C ATOM 417 O MET A 32 0.494 19.548 -3.028 1.00 0.00 O ATOM 418 CB MET A 32 -1.551 18.772 -0.690 1.00 0.00 C ATOM 419 CG MET A 32 -1.963 17.712 0.318 1.00 0.00 C ATOM 420 SD MET A 32 -3.532 16.929 -0.100 1.00 0.00 S ATOM 421 CE MET A 32 -3.261 15.272 0.523 1.00 0.00 C ATOM 0 H MET A 32 0.477 17.265 -1.409 1.00 0.00 H new ATOM 0 HA MET A 32 -2.197 17.846 -2.518 1.00 0.00 H new ATOM 0 HB2 MET A 32 -0.661 19.283 -0.324 1.00 0.00 H new ATOM 0 HB3 MET A 32 -2.341 19.520 -0.762 1.00 0.00 H new ATOM 0 HG2 MET A 32 -1.186 16.950 0.377 1.00 0.00 H new ATOM 0 HG3 MET A 32 -2.040 18.166 1.306 1.00 0.00 H new ATOM 0 HE1 MET A 32 -3.843 14.562 -0.065 1.00 0.00 H new ATOM 0 HE2 MET A 32 -2.202 15.023 0.447 1.00 0.00 H new ATOM 0 HE3 MET A 32 -3.572 15.220 1.566 1.00 0.00 H new ATOM 431 N THR A 33 -1.607 19.987 -3.704 1.00 0.00 N ATOM 432 CA THR A 33 -1.209 21.062 -4.604 1.00 0.00 C ATOM 433 C THR A 33 -0.785 22.302 -3.826 1.00 0.00 C ATOM 434 O THR A 33 -0.378 23.305 -4.412 1.00 0.00 O ATOM 435 CB THR A 33 -2.350 21.440 -5.567 1.00 0.00 C ATOM 436 OG1 THR A 33 -3.362 22.170 -4.865 1.00 0.00 O ATOM 437 CG2 THR A 33 -2.960 20.197 -6.198 1.00 0.00 C ATOM 0 H THR A 33 -2.611 19.807 -3.680 1.00 0.00 H new ATOM 0 HA THR A 33 -0.362 20.692 -5.183 1.00 0.00 H new ATOM 0 HB THR A 33 -1.936 22.064 -6.359 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.083 22.408 -5.485 1.00 0.00 H new ATOM 0 HG21 THR A 33 -3.764 20.489 -6.874 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.194 19.659 -6.756 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.360 19.551 -5.416 1.00 0.00 H new ATOM 445 N SER A 34 -0.882 22.226 -2.502 1.00 0.00 N ATOM 446 CA SER A 34 -0.510 23.345 -1.643 1.00 0.00 C ATOM 447 C SER A 34 -0.580 22.946 -0.172 1.00 0.00 C ATOM 448 O SER A 34 -1.193 21.938 0.182 1.00 0.00 O ATOM 449 CB SER A 34 -1.428 24.541 -1.903 1.00 0.00 C ATOM 450 OG SER A 34 -0.786 25.758 -1.567 1.00 0.00 O ATOM 0 H SER A 34 -1.215 21.402 -2.001 1.00 0.00 H new ATOM 0 HA SER A 34 0.517 23.626 -1.877 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.720 24.558 -2.953 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.343 24.435 -1.319 1.00 0.00 H new ATOM 0 HG SER A 34 -1.392 26.507 -1.744 1.00 0.00 H new ATOM 456 N LEU A 35 0.053 23.744 0.681 1.00 0.00 N ATOM 457 CA LEU A 35 0.065 23.476 2.115 1.00 0.00 C ATOM 458 C LEU A 35 -1.031 24.264 2.825 1.00 0.00 C ATOM 459 O LEU A 35 -1.278 24.068 4.015 1.00 0.00 O ATOM 460 CB LEU A 35 1.430 23.829 2.708 1.00 0.00 C ATOM 461 CG LEU A 35 2.638 23.142 2.071 1.00 0.00 C ATOM 462 CD1 LEU A 35 3.900 23.956 2.306 1.00 0.00 C ATOM 463 CD2 LEU A 35 2.800 21.732 2.620 1.00 0.00 C ATOM 0 H LEU A 35 0.565 24.582 0.405 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.124 22.413 2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.569 24.907 2.631 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.416 23.584 3.770 1.00 0.00 H new ATOM 0 HG LEU A 35 2.469 23.075 0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.749 23.451 1.846 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.782 24.945 1.864 1.00 0.00 H new ATOM 0 HD13 LEU A 35 4.074 24.056 3.377 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.665 21.258 2.156 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.947 21.776 3.699 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.905 21.150 2.399 1.00 0.00 H new ATOM 475 N ILE A 36 -1.686 25.154 2.086 1.00 0.00 N ATOM 476 CA ILE A 36 -2.757 25.969 2.645 1.00 0.00 C ATOM 477 C ILE A 36 -4.119 25.510 2.135 1.00 0.00 C ATOM 478 O ILE A 36 -4.307 25.238 0.949 1.00 0.00 O ATOM 479 CB ILE A 36 -2.569 27.458 2.303 1.00 0.00 C ATOM 480 CG1 ILE A 36 -1.164 27.921 2.696 1.00 0.00 C ATOM 481 CG2 ILE A 36 -3.625 28.300 3.003 1.00 0.00 C ATOM 482 CD1 ILE A 36 -0.761 27.506 4.094 1.00 0.00 C ATOM 0 H ILE A 36 -1.494 25.328 1.100 1.00 0.00 H new ATOM 0 HA ILE A 36 -2.716 25.846 3.727 1.00 0.00 H new ATOM 0 HB ILE A 36 -2.685 27.586 1.227 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -0.444 27.517 1.984 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.113 29.007 2.619 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.479 29.350 2.751 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.616 27.984 2.678 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.538 28.170 4.082 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.245 27.868 4.305 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.458 27.932 4.815 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.779 26.419 4.170 1.00 0.00 H new ATOM 494 N PRO A 37 -5.095 25.422 3.051 1.00 0.00 N ATOM 495 CA PRO A 37 -4.884 25.742 4.466 1.00 0.00 C ATOM 496 C PRO A 37 -4.000 24.716 5.167 1.00 0.00 C ATOM 497 O PRO A 37 -4.021 23.532 4.831 1.00 0.00 O ATOM 498 CB PRO A 37 -6.299 25.718 5.050 1.00 0.00 C ATOM 499 CG PRO A 37 -7.065 24.814 4.148 1.00 0.00 C ATOM 500 CD PRO A 37 -6.480 25.004 2.776 1.00 0.00 C ATOM 0 HA PRO A 37 -4.371 26.695 4.596 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -6.298 25.347 6.075 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -6.735 26.717 5.073 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -6.977 23.776 4.469 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -8.126 25.062 4.157 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.514 24.083 2.194 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.023 25.760 2.209 1.00 0.00 H new ATOM 508 N VAL A 38 -3.224 25.178 6.142 1.00 0.00 N ATOM 509 CA VAL A 38 -2.334 24.300 6.891 1.00 0.00 C ATOM 510 C VAL A 38 -3.111 23.174 7.564 1.00 0.00 C ATOM 511 O VAL A 38 -4.257 23.354 7.973 1.00 0.00 O ATOM 512 CB VAL A 38 -1.548 25.078 7.963 1.00 0.00 C ATOM 513 CG1 VAL A 38 -2.462 25.473 9.113 1.00 0.00 C ATOM 514 CG2 VAL A 38 -0.372 24.255 8.465 1.00 0.00 C ATOM 0 H VAL A 38 -3.194 26.156 6.432 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.632 23.875 6.173 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.157 25.989 7.511 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -1.889 26.022 9.861 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.267 26.104 8.737 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -2.885 24.576 9.566 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.171 24.821 9.222 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.738 23.325 8.900 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.295 24.028 7.633 1.00 0.00 H new ATOM 524 N GLY A 39 -2.478 22.009 7.675 1.00 0.00 N ATOM 525 CA GLY A 39 -3.125 20.870 8.299 1.00 0.00 C ATOM 526 C GLY A 39 -2.342 19.585 8.113 1.00 0.00 C ATOM 527 O GLY A 39 -1.642 19.398 7.118 1.00 0.00 O ATOM 0 H GLY A 39 -1.529 21.835 7.344 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.249 21.065 9.364 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.123 20.748 7.879 1.00 0.00 H new ATOM 531 N PRO A 40 -2.456 18.672 9.089 1.00 0.00 N ATOM 532 CA PRO A 40 -1.759 17.383 9.052 1.00 0.00 C ATOM 533 C PRO A 40 -2.320 16.452 7.982 1.00 0.00 C ATOM 534 O PRO A 40 -3.101 16.872 7.128 1.00 0.00 O ATOM 535 CB PRO A 40 -2.008 16.805 10.447 1.00 0.00 C ATOM 536 CG PRO A 40 -3.271 17.450 10.905 1.00 0.00 C ATOM 537 CD PRO A 40 -3.273 18.828 10.304 1.00 0.00 C ATOM 0 HA PRO A 40 -0.703 17.497 8.805 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -2.107 15.720 10.414 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -1.182 17.029 11.122 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -4.141 16.880 10.578 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -3.312 17.499 11.993 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -4.283 19.162 10.068 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -2.844 19.564 10.985 1.00 0.00 H new ATOM 545 N ILE A 41 -1.915 15.187 8.034 1.00 0.00 N ATOM 546 CA ILE A 41 -2.379 14.197 7.070 1.00 0.00 C ATOM 547 C ILE A 41 -2.783 12.901 7.764 1.00 0.00 C ATOM 548 O ILE A 41 -2.080 12.414 8.648 1.00 0.00 O ATOM 549 CB ILE A 41 -1.298 13.888 6.017 1.00 0.00 C ATOM 550 CG1 ILE A 41 -0.866 15.171 5.305 1.00 0.00 C ATOM 551 CG2 ILE A 41 -1.813 12.866 5.014 1.00 0.00 C ATOM 552 CD1 ILE A 41 -1.910 15.714 4.354 1.00 0.00 C ATOM 0 H ILE A 41 -1.267 14.824 8.733 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.249 14.625 6.571 1.00 0.00 H new ATOM 0 HB ILE A 41 -0.429 13.466 6.523 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.635 15.931 6.051 1.00 0.00 H new ATOM 0 HG13 ILE A 41 0.053 14.978 4.752 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.038 12.658 4.276 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -2.075 11.945 5.535 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -2.695 13.262 4.511 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -1.536 16.624 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.124 14.971 3.586 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -2.823 15.939 4.906 1.00 0.00 H new ATOM 564 N MET A 42 -3.920 12.347 7.356 1.00 0.00 N ATOM 565 CA MET A 42 -4.416 11.105 7.936 1.00 0.00 C ATOM 566 C MET A 42 -4.993 10.193 6.858 1.00 0.00 C ATOM 567 O MET A 42 -5.825 10.615 6.056 1.00 0.00 O ATOM 568 CB MET A 42 -5.482 11.402 8.993 1.00 0.00 C ATOM 569 CG MET A 42 -4.942 12.128 10.214 1.00 0.00 C ATOM 570 SD MET A 42 -6.187 12.347 11.500 1.00 0.00 S ATOM 571 CE MET A 42 -5.574 13.817 12.319 1.00 0.00 C ATOM 0 H MET A 42 -4.515 12.739 6.626 1.00 0.00 H new ATOM 0 HA MET A 42 -3.577 10.593 8.408 1.00 0.00 H new ATOM 0 HB2 MET A 42 -6.271 12.004 8.542 1.00 0.00 H new ATOM 0 HB3 MET A 42 -5.938 10.464 9.310 1.00 0.00 H new ATOM 0 HG2 MET A 42 -4.099 11.569 10.621 1.00 0.00 H new ATOM 0 HG3 MET A 42 -4.561 13.104 9.913 1.00 0.00 H new ATOM 0 HE1 MET A 42 -5.747 13.735 13.392 1.00 0.00 H new ATOM 0 HE2 MET A 42 -4.505 13.920 12.130 1.00 0.00 H new ATOM 0 HE3 MET A 42 -6.096 14.693 11.934 1.00 0.00 H new ATOM 581 N TRP A 43 -4.544 8.943 6.846 1.00 0.00 N ATOM 582 CA TRP A 43 -5.015 7.972 5.865 1.00 0.00 C ATOM 583 C TRP A 43 -6.173 7.152 6.424 1.00 0.00 C ATOM 584 O TRP A 43 -6.217 6.856 7.619 1.00 0.00 O ATOM 585 CB TRP A 43 -3.873 7.045 5.445 1.00 0.00 C ATOM 586 CG TRP A 43 -2.931 7.671 4.462 1.00 0.00 C ATOM 587 CD1 TRP A 43 -1.830 8.426 4.748 1.00 0.00 C ATOM 588 CD2 TRP A 43 -3.009 7.597 3.034 1.00 0.00 C ATOM 589 NE1 TRP A 43 -1.219 8.826 3.585 1.00 0.00 N ATOM 590 CE2 TRP A 43 -1.922 8.330 2.519 1.00 0.00 C ATOM 591 CE3 TRP A 43 -3.890 6.982 2.141 1.00 0.00 C ATOM 592 CZ2 TRP A 43 -1.696 8.464 1.152 1.00 0.00 C ATOM 593 CZ3 TRP A 43 -3.664 7.116 0.784 1.00 0.00 C ATOM 594 CH2 TRP A 43 -2.574 7.851 0.300 1.00 0.00 C ATOM 0 H TRP A 43 -3.855 8.578 7.504 1.00 0.00 H new ATOM 0 HA TRP A 43 -5.370 8.518 4.991 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -3.315 6.744 6.331 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -4.292 6.138 5.009 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -1.490 8.672 5.743 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -0.378 9.400 3.525 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -4.732 6.412 2.504 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -0.857 9.032 0.777 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -4.339 6.646 0.085 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -2.424 7.935 -0.766 1.00 0.00 H new ATOM 605 N PHE A 44 -7.108 6.787 5.554 1.00 0.00 N ATOM 606 CA PHE A 44 -8.267 6.001 5.962 1.00 0.00 C ATOM 607 C PHE A 44 -8.774 5.140 4.808 1.00 0.00 C ATOM 608 O PHE A 44 -9.009 5.636 3.706 1.00 0.00 O ATOM 609 CB PHE A 44 -9.385 6.921 6.456 1.00 0.00 C ATOM 610 CG PHE A 44 -9.028 7.683 7.700 1.00 0.00 C ATOM 611 CD1 PHE A 44 -9.198 7.112 8.951 1.00 0.00 C ATOM 612 CD2 PHE A 44 -8.523 8.971 7.618 1.00 0.00 C ATOM 613 CE1 PHE A 44 -8.870 7.811 10.098 1.00 0.00 C ATOM 614 CE2 PHE A 44 -8.193 9.674 8.761 1.00 0.00 C ATOM 615 CZ PHE A 44 -8.368 9.094 10.003 1.00 0.00 C ATOM 0 H PHE A 44 -7.086 7.023 4.562 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.961 5.343 6.776 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.638 7.628 5.666 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.277 6.325 6.648 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -9.591 6.109 9.031 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.386 9.430 6.650 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.006 7.354 11.067 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -7.798 10.676 8.684 1.00 0.00 H new ATOM 0 HZ PHE A 44 -8.113 9.643 10.897 1.00 0.00 H new ATOM 625 N ARG A 45 -8.939 3.848 5.070 1.00 0.00 N ATOM 626 CA ARG A 45 -9.416 2.917 4.054 1.00 0.00 C ATOM 627 C ARG A 45 -10.907 2.642 4.226 1.00 0.00 C ATOM 628 O ARG A 45 -11.325 2.015 5.199 1.00 0.00 O ATOM 629 CB ARG A 45 -8.632 1.605 4.127 1.00 0.00 C ATOM 630 CG ARG A 45 -8.904 0.669 2.960 1.00 0.00 C ATOM 631 CD ARG A 45 -8.765 -0.789 3.372 1.00 0.00 C ATOM 632 NE ARG A 45 -9.584 -1.108 4.538 1.00 0.00 N ATOM 633 CZ ARG A 45 -9.635 -2.315 5.092 1.00 0.00 C ATOM 634 NH1 ARG A 45 -8.918 -3.310 4.588 1.00 0.00 N ATOM 635 NH2 ARG A 45 -10.404 -2.527 6.152 1.00 0.00 N ATOM 0 H ARG A 45 -8.750 3.422 5.977 1.00 0.00 H new ATOM 0 HA ARG A 45 -9.259 3.372 3.076 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -7.566 1.830 4.161 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -8.880 1.094 5.057 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -9.909 0.846 2.577 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.210 0.887 2.148 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -9.054 -1.430 2.539 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -7.720 -1.005 3.593 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.148 -0.364 4.950 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -8.326 -3.150 3.773 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -8.959 -4.235 5.015 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.956 -1.763 6.542 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -10.443 -3.454 6.577 1.00 0.00 H new ATOM 649 N GLY A 46 -11.704 3.116 3.274 1.00 0.00 N ATOM 650 CA GLY A 46 -13.140 2.911 3.339 1.00 0.00 C ATOM 651 C GLY A 46 -13.883 4.156 3.781 1.00 0.00 C ATOM 652 O GLY A 46 -14.764 4.090 4.638 1.00 0.00 O ATOM 0 H GLY A 46 -11.382 3.638 2.459 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -13.505 2.602 2.359 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -13.357 2.097 4.031 1.00 0.00 H new ATOM 656 N ALA A 47 -13.526 5.295 3.197 1.00 0.00 N ATOM 657 CA ALA A 47 -14.166 6.561 3.536 1.00 0.00 C ATOM 658 C ALA A 47 -15.648 6.363 3.837 1.00 0.00 C ATOM 659 O ALA A 47 -16.311 5.531 3.220 1.00 0.00 O ATOM 660 CB ALA A 47 -13.985 7.563 2.405 1.00 0.00 C ATOM 0 H ALA A 47 -12.797 5.367 2.487 1.00 0.00 H new ATOM 0 HA ALA A 47 -13.688 6.953 4.434 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -14.468 8.503 2.671 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -12.922 7.735 2.238 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -14.436 7.169 1.494 1.00 0.00 H new ATOM 666 N GLY A 48 -16.161 7.134 4.792 1.00 0.00 N ATOM 667 CA GLY A 48 -17.561 7.027 5.159 1.00 0.00 C ATOM 668 C GLY A 48 -17.751 6.662 6.618 1.00 0.00 C ATOM 669 O GLY A 48 -17.128 7.254 7.499 1.00 0.00 O ATOM 0 H GLY A 48 -15.632 7.830 5.317 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -18.060 7.975 4.957 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -18.041 6.274 4.534 1.00 0.00 H new ATOM 673 N ALA A 49 -18.616 5.686 6.874 1.00 0.00 N ATOM 674 CA ALA A 49 -18.886 5.243 8.236 1.00 0.00 C ATOM 675 C ALA A 49 -18.328 3.845 8.480 1.00 0.00 C ATOM 676 O ALA A 49 -19.070 2.865 8.502 1.00 0.00 O ATOM 677 CB ALA A 49 -20.382 5.272 8.513 1.00 0.00 C ATOM 0 H ALA A 49 -19.142 5.187 6.156 1.00 0.00 H new ATOM 0 HA ALA A 49 -18.387 5.929 8.920 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -20.570 4.939 9.534 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -20.755 6.288 8.389 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -20.894 4.610 7.815 1.00 0.00 H new ATOM 683 N GLY A 50 -17.013 3.761 8.663 1.00 0.00 N ATOM 684 CA GLY A 50 -16.378 2.479 8.902 1.00 0.00 C ATOM 685 C GLY A 50 -14.887 2.510 8.629 1.00 0.00 C ATOM 686 O GLY A 50 -14.131 1.711 9.181 1.00 0.00 O ATOM 0 H GLY A 50 -16.377 4.558 8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -16.549 2.180 9.936 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -16.844 1.723 8.270 1.00 0.00 H new ATOM 690 N ARG A 51 -14.463 3.436 7.775 1.00 0.00 N ATOM 691 CA ARG A 51 -13.053 3.566 7.428 1.00 0.00 C ATOM 692 C ARG A 51 -12.167 3.289 8.639 1.00 0.00 C ATOM 693 O ARG A 51 -12.518 3.631 9.767 1.00 0.00 O ATOM 694 CB ARG A 51 -12.767 4.967 6.883 1.00 0.00 C ATOM 695 CG ARG A 51 -12.918 6.066 7.922 1.00 0.00 C ATOM 696 CD ARG A 51 -12.989 7.440 7.274 1.00 0.00 C ATOM 697 NE ARG A 51 -13.602 8.430 8.155 1.00 0.00 N ATOM 698 CZ ARG A 51 -13.787 9.701 7.816 1.00 0.00 C ATOM 699 NH1 ARG A 51 -13.410 10.134 6.621 1.00 0.00 N ATOM 700 NH2 ARG A 51 -14.352 10.542 8.673 1.00 0.00 N ATOM 0 H ARG A 51 -15.075 4.107 7.311 1.00 0.00 H new ATOM 0 HA ARG A 51 -12.825 2.830 6.657 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -11.753 4.993 6.484 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -13.442 5.169 6.051 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -13.820 5.892 8.508 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -12.077 6.032 8.614 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -11.984 7.766 7.006 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -13.561 7.375 6.348 1.00 0.00 H new ATOM 0 HE ARG A 51 -13.905 8.129 9.081 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.977 9.491 5.959 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -13.553 11.111 6.364 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -14.645 10.213 9.593 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -14.494 11.518 8.412 1.00 0.00 H new ATOM 714 N GLU A 52 -11.018 2.666 8.395 1.00 0.00 N ATOM 715 CA GLU A 52 -10.083 2.342 9.466 1.00 0.00 C ATOM 716 C GLU A 52 -8.801 3.158 9.335 1.00 0.00 C ATOM 717 O GLU A 52 -8.114 3.097 8.314 1.00 0.00 O ATOM 718 CB GLU A 52 -9.754 0.848 9.451 1.00 0.00 C ATOM 719 CG GLU A 52 -8.692 0.449 10.462 1.00 0.00 C ATOM 720 CD GLU A 52 -8.592 -1.054 10.641 1.00 0.00 C ATOM 721 OE1 GLU A 52 -9.335 -1.602 11.482 1.00 0.00 O ATOM 722 OE2 GLU A 52 -7.772 -1.681 9.938 1.00 0.00 O ATOM 0 H GLU A 52 -10.713 2.376 7.466 1.00 0.00 H new ATOM 0 HA GLU A 52 -10.557 2.593 10.415 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.664 0.282 9.650 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -9.417 0.569 8.453 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.726 0.838 10.141 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.918 0.911 11.423 1.00 0.00 H new ATOM 729 N LEU A 53 -8.484 3.922 10.374 1.00 0.00 N ATOM 730 CA LEU A 53 -7.284 4.752 10.376 1.00 0.00 C ATOM 731 C LEU A 53 -6.065 3.948 9.936 1.00 0.00 C ATOM 732 O LEU A 53 -5.709 2.949 10.562 1.00 0.00 O ATOM 733 CB LEU A 53 -7.047 5.338 11.769 1.00 0.00 C ATOM 734 CG LEU A 53 -5.782 6.180 11.937 1.00 0.00 C ATOM 735 CD1 LEU A 53 -5.805 7.371 10.991 1.00 0.00 C ATOM 736 CD2 LEU A 53 -5.638 6.645 13.379 1.00 0.00 C ATOM 0 H LEU A 53 -9.041 3.984 11.226 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.434 5.566 9.667 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -7.907 5.954 12.033 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.011 4.517 12.485 1.00 0.00 H new ATOM 0 HG LEU A 53 -4.920 5.560 11.688 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.897 7.959 11.124 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -5.860 7.017 9.962 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -6.674 7.992 11.208 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.732 7.243 13.480 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.503 7.248 13.655 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.575 5.778 14.036 1.00 0.00 H new ATOM 748 N ILE A 54 -5.429 4.390 8.856 1.00 0.00 N ATOM 749 CA ILE A 54 -4.248 3.713 8.335 1.00 0.00 C ATOM 750 C ILE A 54 -2.969 4.348 8.871 1.00 0.00 C ATOM 751 O ILE A 54 -2.050 3.649 9.302 1.00 0.00 O ATOM 752 CB ILE A 54 -4.215 3.743 6.796 1.00 0.00 C ATOM 753 CG1 ILE A 54 -5.433 3.014 6.224 1.00 0.00 C ATOM 754 CG2 ILE A 54 -2.927 3.118 6.281 1.00 0.00 C ATOM 755 CD1 ILE A 54 -5.497 1.552 6.607 1.00 0.00 C ATOM 0 H ILE A 54 -5.712 5.214 8.325 1.00 0.00 H new ATOM 0 HA ILE A 54 -4.305 2.677 8.669 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.249 4.782 6.467 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.339 3.512 6.569 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -5.418 3.096 5.137 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -2.919 3.147 5.191 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -2.073 3.676 6.665 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -2.865 2.083 6.617 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -6.385 1.099 6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -4.608 1.040 6.238 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -5.544 1.462 7.692 1.00 0.00 H new ATOM 767 N TYR A 55 -2.917 5.675 8.845 1.00 0.00 N ATOM 768 CA TYR A 55 -1.750 6.404 9.328 1.00 0.00 C ATOM 769 C TYR A 55 -2.150 7.772 9.871 1.00 0.00 C ATOM 770 O TYR A 55 -3.061 8.416 9.354 1.00 0.00 O ATOM 771 CB TYR A 55 -0.725 6.568 8.205 1.00 0.00 C ATOM 772 CG TYR A 55 0.520 7.317 8.626 1.00 0.00 C ATOM 773 CD1 TYR A 55 1.507 6.693 9.380 1.00 0.00 C ATOM 774 CD2 TYR A 55 0.708 8.647 8.272 1.00 0.00 C ATOM 775 CE1 TYR A 55 2.645 7.373 9.768 1.00 0.00 C ATOM 776 CE2 TYR A 55 1.844 9.334 8.654 1.00 0.00 C ATOM 777 CZ TYR A 55 2.809 8.693 9.402 1.00 0.00 C ATOM 778 OH TYR A 55 3.942 9.374 9.786 1.00 0.00 O ATOM 0 H TYR A 55 -3.669 6.268 8.495 1.00 0.00 H new ATOM 0 HA TYR A 55 -1.302 5.828 10.138 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -0.439 5.582 7.838 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -1.192 7.095 7.373 1.00 0.00 H new ATOM 0 HD1 TYR A 55 1.382 5.659 9.667 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -0.047 9.153 7.688 1.00 0.00 H new ATOM 0 HE1 TYR A 55 3.402 6.874 10.355 1.00 0.00 H new ATOM 0 HE2 TYR A 55 1.976 10.367 8.368 1.00 0.00 H new ATOM 0 HH TYR A 55 3.903 10.292 9.446 1.00 0.00 H new ATOM 788 N ASN A 56 -1.460 8.209 10.920 1.00 0.00 N ATOM 789 CA ASN A 56 -1.741 9.501 11.535 1.00 0.00 C ATOM 790 C ASN A 56 -0.458 10.306 11.722 1.00 0.00 C ATOM 791 O ASN A 56 0.468 9.865 12.403 1.00 0.00 O ATOM 792 CB ASN A 56 -2.436 9.306 12.884 1.00 0.00 C ATOM 793 CG ASN A 56 -3.361 10.457 13.230 1.00 0.00 C ATOM 794 OD1 ASN A 56 -4.500 10.248 13.647 1.00 0.00 O ATOM 795 ND2 ASN A 56 -2.874 11.680 13.056 1.00 0.00 N ATOM 0 H ASN A 56 -0.703 7.687 11.361 1.00 0.00 H new ATOM 0 HA ASN A 56 -2.402 10.056 10.870 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.007 8.378 12.864 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -1.683 9.201 13.665 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -3.450 12.494 13.271 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -1.924 11.806 12.708 1.00 0.00 H new ATOM 802 N GLN A 57 -0.413 11.487 11.115 1.00 0.00 N ATOM 803 CA GLN A 57 0.756 12.353 11.215 1.00 0.00 C ATOM 804 C GLN A 57 0.820 13.026 12.582 1.00 0.00 C ATOM 805 O GLN A 57 1.844 12.976 13.264 1.00 0.00 O ATOM 806 CB GLN A 57 0.728 13.412 10.113 1.00 0.00 C ATOM 807 CG GLN A 57 1.972 14.285 10.076 1.00 0.00 C ATOM 808 CD GLN A 57 2.027 15.171 8.847 1.00 0.00 C ATOM 809 OE1 GLN A 57 1.067 15.873 8.530 1.00 0.00 O ATOM 810 NE2 GLN A 57 3.156 15.144 8.147 1.00 0.00 N ATOM 0 H GLN A 57 -1.172 11.866 10.549 1.00 0.00 H new ATOM 0 HA GLN A 57 1.646 11.735 11.093 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.612 12.918 9.148 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.147 14.047 10.253 1.00 0.00 H new ATOM 0 HG2 GLN A 57 2.001 14.908 10.970 1.00 0.00 H new ATOM 0 HG3 GLN A 57 2.858 13.650 10.101 1.00 0.00 H new ATOM 0 HE21 GLN A 57 3.927 14.547 8.446 1.00 0.00 H new ATOM 0 HE22 GLN A 57 3.251 15.720 7.311 1.00 0.00 H new ATOM 819 N LYS A 58 -0.282 13.655 12.978 1.00 0.00 N ATOM 820 CA LYS A 58 -0.353 14.338 14.264 1.00 0.00 C ATOM 821 C LYS A 58 0.417 13.568 15.333 1.00 0.00 C ATOM 822 O LYS A 58 1.351 14.094 15.937 1.00 0.00 O ATOM 823 CB LYS A 58 -1.812 14.507 14.695 1.00 0.00 C ATOM 824 CG LYS A 58 -1.971 15.020 16.116 1.00 0.00 C ATOM 825 CD LYS A 58 -1.995 16.539 16.161 1.00 0.00 C ATOM 826 CE LYS A 58 -0.597 17.115 16.320 1.00 0.00 C ATOM 827 NZ LYS A 58 -0.620 18.596 16.468 1.00 0.00 N ATOM 0 H LYS A 58 -1.138 13.706 12.426 1.00 0.00 H new ATOM 0 HA LYS A 58 0.103 15.322 14.150 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.307 15.197 14.011 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.322 13.548 14.605 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.893 14.628 16.544 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.151 14.650 16.731 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.446 16.924 15.246 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.622 16.869 16.989 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -0.118 16.670 17.193 1.00 0.00 H new ATOM 0 HE3 LYS A 58 0.007 16.846 15.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 0.352 18.949 16.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.054 19.022 15.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -1.175 18.852 17.309 1.00 0.00 H new ATOM 841 N GLU A 59 0.020 12.319 15.558 1.00 0.00 N ATOM 842 CA GLU A 59 0.675 11.478 16.553 1.00 0.00 C ATOM 843 C GLU A 59 0.444 10.000 16.253 1.00 0.00 C ATOM 844 O GLU A 59 -0.379 9.648 15.409 1.00 0.00 O ATOM 845 CB GLU A 59 0.159 11.812 17.955 1.00 0.00 C ATOM 846 CG GLU A 59 -1.350 11.699 18.091 1.00 0.00 C ATOM 847 CD GLU A 59 -1.799 11.594 19.535 1.00 0.00 C ATOM 848 OE1 GLU A 59 -1.149 12.209 20.406 1.00 0.00 O ATOM 849 OE2 GLU A 59 -2.802 10.896 19.795 1.00 0.00 O ATOM 0 H GLU A 59 -0.751 11.868 15.065 1.00 0.00 H new ATOM 0 HA GLU A 59 1.746 11.676 16.511 1.00 0.00 H new ATOM 0 HB2 GLU A 59 0.631 11.144 18.675 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.464 12.826 18.213 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.819 12.569 17.631 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -1.696 10.823 17.542 1.00 0.00 H new ATOM 856 N GLY A 60 1.177 9.138 16.951 1.00 0.00 N ATOM 857 CA GLY A 60 1.038 7.709 16.745 1.00 0.00 C ATOM 858 C GLY A 60 2.283 7.086 16.146 1.00 0.00 C ATOM 859 O GLY A 60 2.803 7.566 15.137 1.00 0.00 O ATOM 0 H GLY A 60 1.865 9.404 17.656 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.817 7.228 17.698 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.189 7.521 16.088 1.00 0.00 H new ATOM 863 N HIS A 61 2.766 6.014 16.768 1.00 0.00 N ATOM 864 CA HIS A 61 3.959 5.325 16.290 1.00 0.00 C ATOM 865 C HIS A 61 3.589 4.203 15.324 1.00 0.00 C ATOM 866 O HIS A 61 2.922 3.240 15.703 1.00 0.00 O ATOM 867 CB HIS A 61 4.753 4.759 17.467 1.00 0.00 C ATOM 868 CG HIS A 61 5.608 3.585 17.104 1.00 0.00 C ATOM 869 ND1 HIS A 61 6.730 3.688 16.308 1.00 0.00 N ATOM 870 CD2 HIS A 61 5.502 2.277 17.433 1.00 0.00 C ATOM 871 CE1 HIS A 61 7.275 2.494 16.163 1.00 0.00 C ATOM 872 NE2 HIS A 61 6.550 1.620 16.836 1.00 0.00 N ATOM 0 H HIS A 61 2.349 5.604 17.604 1.00 0.00 H new ATOM 0 HA HIS A 61 4.577 6.048 15.759 1.00 0.00 H new ATOM 0 HB2 HIS A 61 5.386 5.545 17.879 1.00 0.00 H new ATOM 0 HB3 HIS A 61 4.059 4.463 18.254 1.00 0.00 H new ATOM 0 HD2 HIS A 61 4.736 1.832 18.050 1.00 0.00 H new ATOM 0 HE1 HIS A 61 8.163 2.270 15.591 1.00 0.00 H new ATOM 0 HE2 HIS A 61 6.738 0.620 16.902 1.00 0.00 H new ATOM 881 N PHE A 62 4.025 4.335 14.076 1.00 0.00 N ATOM 882 CA PHE A 62 3.737 3.333 13.056 1.00 0.00 C ATOM 883 C PHE A 62 5.027 2.718 12.520 1.00 0.00 C ATOM 884 O PHE A 62 5.668 3.250 11.613 1.00 0.00 O ATOM 885 CB PHE A 62 2.941 3.957 11.908 1.00 0.00 C ATOM 886 CG PHE A 62 1.513 4.257 12.263 1.00 0.00 C ATOM 887 CD1 PHE A 62 1.206 5.265 13.164 1.00 0.00 C ATOM 888 CD2 PHE A 62 0.477 3.531 11.698 1.00 0.00 C ATOM 889 CE1 PHE A 62 -0.108 5.544 13.492 1.00 0.00 C ATOM 890 CE2 PHE A 62 -0.838 3.806 12.022 1.00 0.00 C ATOM 891 CZ PHE A 62 -1.131 4.812 12.922 1.00 0.00 C ATOM 0 H PHE A 62 4.579 5.126 13.746 1.00 0.00 H new ATOM 0 HA PHE A 62 3.141 2.544 13.515 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.431 4.879 11.596 1.00 0.00 H new ATOM 0 HB3 PHE A 62 2.960 3.281 11.053 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.002 5.839 13.615 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.700 2.741 10.996 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.334 6.334 14.193 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -1.636 3.235 11.572 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.158 5.026 13.179 1.00 0.00 H new ATOM 901 N PRO A 63 5.417 1.570 13.093 1.00 0.00 N ATOM 902 CA PRO A 63 6.632 0.857 12.690 1.00 0.00 C ATOM 903 C PRO A 63 6.506 0.235 11.303 1.00 0.00 C ATOM 904 O PRO A 63 7.468 0.209 10.534 1.00 0.00 O ATOM 905 CB PRO A 63 6.773 -0.234 13.754 1.00 0.00 C ATOM 906 CG PRO A 63 5.388 -0.456 14.255 1.00 0.00 C ATOM 907 CD PRO A 63 4.702 0.880 14.180 1.00 0.00 C ATOM 0 HA PRO A 63 7.493 1.523 12.626 1.00 0.00 H new ATOM 0 HB2 PRO A 63 7.192 -1.147 13.331 1.00 0.00 H new ATOM 0 HB3 PRO A 63 7.439 0.080 14.558 1.00 0.00 H new ATOM 0 HG2 PRO A 63 4.867 -1.197 13.648 1.00 0.00 H new ATOM 0 HG3 PRO A 63 5.399 -0.833 15.278 1.00 0.00 H new ATOM 0 HD2 PRO A 63 3.640 0.775 13.959 1.00 0.00 H new ATOM 0 HD3 PRO A 63 4.779 1.425 15.121 1.00 0.00 H new ATOM 915 N ARG A 64 5.315 -0.264 10.990 1.00 0.00 N ATOM 916 CA ARG A 64 5.064 -0.887 9.695 1.00 0.00 C ATOM 917 C ARG A 64 5.086 0.153 8.579 1.00 0.00 C ATOM 918 O ARG A 64 5.597 -0.102 7.488 1.00 0.00 O ATOM 919 CB ARG A 64 3.717 -1.611 9.707 1.00 0.00 C ATOM 920 CG ARG A 64 3.666 -2.789 10.665 1.00 0.00 C ATOM 921 CD ARG A 64 2.237 -3.127 11.058 1.00 0.00 C ATOM 922 NE ARG A 64 1.399 -3.397 9.893 1.00 0.00 N ATOM 923 CZ ARG A 64 0.232 -4.030 9.957 1.00 0.00 C ATOM 924 NH1 ARG A 64 -0.231 -4.456 11.124 1.00 0.00 N ATOM 925 NH2 ARG A 64 -0.473 -4.239 8.853 1.00 0.00 N ATOM 0 H ARG A 64 4.509 -0.249 11.615 1.00 0.00 H new ATOM 0 HA ARG A 64 5.856 -1.612 9.508 1.00 0.00 H new ATOM 0 HB2 ARG A 64 2.935 -0.901 9.976 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.495 -1.963 8.700 1.00 0.00 H new ATOM 0 HG2 ARG A 64 4.132 -3.658 10.200 1.00 0.00 H new ATOM 0 HG3 ARG A 64 4.245 -2.557 11.559 1.00 0.00 H new ATOM 0 HD2 ARG A 64 2.238 -3.998 11.714 1.00 0.00 H new ATOM 0 HD3 ARG A 64 1.812 -2.300 11.627 1.00 0.00 H new ATOM 0 HE ARG A 64 1.727 -3.083 8.980 1.00 0.00 H new ATOM 0 HH11 ARG A 64 0.309 -4.298 11.975 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -1.127 -4.942 11.171 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.120 -3.914 7.953 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -1.368 -4.725 8.904 1.00 0.00 H new ATOM 939 N VAL A 65 4.527 1.326 8.859 1.00 0.00 N ATOM 940 CA VAL A 65 4.482 2.405 7.879 1.00 0.00 C ATOM 941 C VAL A 65 5.815 3.142 7.812 1.00 0.00 C ATOM 942 O VAL A 65 6.353 3.571 8.834 1.00 0.00 O ATOM 943 CB VAL A 65 3.365 3.414 8.206 1.00 0.00 C ATOM 944 CG1 VAL A 65 3.366 4.557 7.201 1.00 0.00 C ATOM 945 CG2 VAL A 65 2.012 2.720 8.235 1.00 0.00 C ATOM 0 H VAL A 65 4.099 1.553 9.756 1.00 0.00 H new ATOM 0 HA VAL A 65 4.275 1.946 6.912 1.00 0.00 H new ATOM 0 HB VAL A 65 3.555 3.831 9.195 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.570 5.260 7.448 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.327 5.070 7.235 1.00 0.00 H new ATOM 0 HG13 VAL A 65 3.202 4.161 6.199 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.235 3.448 8.468 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.811 2.273 7.261 1.00 0.00 H new ATOM 0 HG23 VAL A 65 2.019 1.941 8.997 1.00 0.00 H new ATOM 955 N THR A 66 6.344 3.288 6.601 1.00 0.00 N ATOM 956 CA THR A 66 7.614 3.973 6.400 1.00 0.00 C ATOM 957 C THR A 66 7.458 5.154 5.449 1.00 0.00 C ATOM 958 O THR A 66 7.420 4.983 4.230 1.00 0.00 O ATOM 959 CB THR A 66 8.686 3.017 5.842 1.00 0.00 C ATOM 960 OG1 THR A 66 8.758 1.837 6.650 1.00 0.00 O ATOM 961 CG2 THR A 66 10.047 3.695 5.802 1.00 0.00 C ATOM 0 H THR A 66 5.912 2.941 5.745 1.00 0.00 H new ATOM 0 HA THR A 66 7.934 4.337 7.376 1.00 0.00 H new ATOM 0 HB THR A 66 8.404 2.744 4.825 1.00 0.00 H new ATOM 0 HG1 THR A 66 9.440 1.234 6.288 1.00 0.00 H new ATOM 0 HG21 THR A 66 10.788 3.001 5.405 1.00 0.00 H new ATOM 0 HG22 THR A 66 9.996 4.576 5.163 1.00 0.00 H new ATOM 0 HG23 THR A 66 10.334 3.994 6.810 1.00 0.00 H new ATOM 969 N THR A 67 7.368 6.355 6.013 1.00 0.00 N ATOM 970 CA THR A 67 7.215 7.564 5.215 1.00 0.00 C ATOM 971 C THR A 67 8.272 7.637 4.119 1.00 0.00 C ATOM 972 O THR A 67 9.469 7.544 4.389 1.00 0.00 O ATOM 973 CB THR A 67 7.310 8.829 6.088 1.00 0.00 C ATOM 974 OG1 THR A 67 8.478 8.768 6.914 1.00 0.00 O ATOM 975 CG2 THR A 67 6.073 8.978 6.961 1.00 0.00 C ATOM 0 H THR A 67 7.399 6.515 7.020 1.00 0.00 H new ATOM 0 HA THR A 67 6.226 7.519 4.760 1.00 0.00 H new ATOM 0 HB THR A 67 7.377 9.694 5.429 1.00 0.00 H new ATOM 0 HG1 THR A 67 9.229 8.416 6.393 1.00 0.00 H new ATOM 0 HG21 THR A 67 6.163 9.878 7.569 1.00 0.00 H new ATOM 0 HG22 THR A 67 5.188 9.054 6.329 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.980 8.109 7.612 1.00 0.00 H new ATOM 983 N VAL A 68 7.822 7.805 2.879 1.00 0.00 N ATOM 984 CA VAL A 68 8.730 7.893 1.741 1.00 0.00 C ATOM 985 C VAL A 68 9.601 9.141 1.828 1.00 0.00 C ATOM 986 O VAL A 68 10.826 9.062 1.743 1.00 0.00 O ATOM 987 CB VAL A 68 7.959 7.909 0.408 1.00 0.00 C ATOM 988 CG1 VAL A 68 8.893 8.246 -0.745 1.00 0.00 C ATOM 989 CG2 VAL A 68 7.270 6.573 0.175 1.00 0.00 C ATOM 0 H VAL A 68 6.834 7.883 2.637 1.00 0.00 H new ATOM 0 HA VAL A 68 9.365 7.008 1.774 1.00 0.00 H new ATOM 0 HB VAL A 68 7.192 8.682 0.461 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.331 8.253 -1.679 1.00 0.00 H new ATOM 0 HG12 VAL A 68 9.335 9.229 -0.580 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.684 7.498 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 68 6.730 6.602 -0.771 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.017 5.779 0.142 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.569 6.379 0.987 1.00 0.00 H new ATOM 999 N SER A 69 8.960 10.293 1.998 1.00 0.00 N ATOM 1000 CA SER A 69 9.675 11.559 2.093 1.00 0.00 C ATOM 1001 C SER A 69 9.597 12.123 3.509 1.00 0.00 C ATOM 1002 O SER A 69 8.694 11.785 4.273 1.00 0.00 O ATOM 1003 CB SER A 69 9.102 12.569 1.097 1.00 0.00 C ATOM 1004 OG SER A 69 9.536 12.288 -0.222 1.00 0.00 O ATOM 0 H SER A 69 7.946 10.375 2.073 1.00 0.00 H new ATOM 0 HA SER A 69 10.722 11.375 1.851 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.013 12.546 1.137 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.410 13.576 1.378 1.00 0.00 H new ATOM 0 HG SER A 69 9.155 12.947 -0.839 1.00 0.00 H new ATOM 1010 N GLU A 70 10.550 12.984 3.850 1.00 0.00 N ATOM 1011 CA GLU A 70 10.590 13.594 5.174 1.00 0.00 C ATOM 1012 C GLU A 70 9.425 14.562 5.362 1.00 0.00 C ATOM 1013 O GLU A 70 9.263 15.514 4.597 1.00 0.00 O ATOM 1014 CB GLU A 70 11.916 14.329 5.382 1.00 0.00 C ATOM 1015 CG GLU A 70 12.022 15.024 6.729 1.00 0.00 C ATOM 1016 CD GLU A 70 12.258 14.053 7.869 1.00 0.00 C ATOM 1017 OE1 GLU A 70 11.390 13.184 8.098 1.00 0.00 O ATOM 1018 OE2 GLU A 70 13.311 14.160 8.533 1.00 0.00 O ATOM 0 H GLU A 70 11.304 13.275 3.228 1.00 0.00 H new ATOM 0 HA GLU A 70 10.503 12.799 5.915 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.736 13.617 5.285 1.00 0.00 H new ATOM 0 HB3 GLU A 70 12.040 15.068 4.591 1.00 0.00 H new ATOM 0 HG2 GLU A 70 12.837 15.747 6.698 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.106 15.584 6.918 1.00 0.00 H new ATOM 1025 N LEU A 71 8.615 14.312 6.384 1.00 0.00 N ATOM 1026 CA LEU A 71 7.464 15.159 6.674 1.00 0.00 C ATOM 1027 C LEU A 71 7.883 16.395 7.464 1.00 0.00 C ATOM 1028 O LEU A 71 7.502 17.518 7.130 1.00 0.00 O ATOM 1029 CB LEU A 71 6.410 14.373 7.457 1.00 0.00 C ATOM 1030 CG LEU A 71 5.998 13.027 6.860 1.00 0.00 C ATOM 1031 CD1 LEU A 71 5.114 12.261 7.833 1.00 0.00 C ATOM 1032 CD2 LEU A 71 5.283 13.228 5.532 1.00 0.00 C ATOM 0 H LEU A 71 8.734 13.529 7.026 1.00 0.00 H new ATOM 0 HA LEU A 71 7.036 15.484 5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.788 14.201 8.465 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.519 14.994 7.553 1.00 0.00 H new ATOM 0 HG LEU A 71 6.899 12.440 6.679 1.00 0.00 H new ATOM 0 HD11 LEU A 71 4.830 11.306 7.392 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.660 12.085 8.760 1.00 0.00 H new ATOM 0 HD13 LEU A 71 4.217 12.843 8.046 1.00 0.00 H new ATOM 0 HD21 LEU A 71 4.997 12.259 5.122 1.00 0.00 H new ATOM 0 HD22 LEU A 71 4.390 13.834 5.687 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.949 13.735 4.834 1.00 0.00 H new ATOM 1044 N THR A 72 8.671 16.182 8.513 1.00 0.00 N ATOM 1045 CA THR A 72 9.143 17.278 9.350 1.00 0.00 C ATOM 1046 C THR A 72 9.478 18.506 8.510 1.00 0.00 C ATOM 1047 O THR A 72 9.183 19.636 8.899 1.00 0.00 O ATOM 1048 CB THR A 72 10.387 16.870 10.161 1.00 0.00 C ATOM 1049 OG1 THR A 72 11.416 16.405 9.280 1.00 0.00 O ATOM 1050 CG2 THR A 72 10.044 15.781 11.167 1.00 0.00 C ATOM 0 H THR A 72 8.996 15.260 8.803 1.00 0.00 H new ATOM 0 HA THR A 72 8.334 17.521 10.038 1.00 0.00 H new ATOM 0 HB THR A 72 10.742 17.746 10.704 1.00 0.00 H new ATOM 0 HG1 THR A 72 12.204 16.149 9.804 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.938 15.509 11.728 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.282 16.148 11.855 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.666 14.905 10.640 1.00 0.00 H new ATOM 1058 N LYS A 73 10.095 18.277 7.356 1.00 0.00 N ATOM 1059 CA LYS A 73 10.469 19.364 6.459 1.00 0.00 C ATOM 1060 C LYS A 73 9.368 20.418 6.394 1.00 0.00 C ATOM 1061 O LYS A 73 8.214 20.107 6.097 1.00 0.00 O ATOM 1062 CB LYS A 73 10.753 18.821 5.057 1.00 0.00 C ATOM 1063 CG LYS A 73 12.170 18.302 4.882 1.00 0.00 C ATOM 1064 CD LYS A 73 12.284 17.390 3.672 1.00 0.00 C ATOM 1065 CE LYS A 73 12.453 18.186 2.387 1.00 0.00 C ATOM 1066 NZ LYS A 73 12.860 17.319 1.247 1.00 0.00 N ATOM 0 H LYS A 73 10.347 17.348 7.020 1.00 0.00 H new ATOM 0 HA LYS A 73 11.373 19.831 6.851 1.00 0.00 H new ATOM 0 HB2 LYS A 73 10.051 18.017 4.839 1.00 0.00 H new ATOM 0 HB3 LYS A 73 10.571 19.610 4.327 1.00 0.00 H new ATOM 0 HG2 LYS A 73 12.855 19.142 4.771 1.00 0.00 H new ATOM 0 HG3 LYS A 73 12.473 17.760 5.778 1.00 0.00 H new ATOM 0 HD2 LYS A 73 13.133 16.719 3.800 1.00 0.00 H new ATOM 0 HD3 LYS A 73 11.393 16.766 3.600 1.00 0.00 H new ATOM 0 HE2 LYS A 73 11.516 18.688 2.145 1.00 0.00 H new ATOM 0 HE3 LYS A 73 13.202 18.964 2.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 12.965 17.899 0.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 13.767 16.859 1.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 12.133 16.592 1.087 1.00 0.00 H new ATOM 1080 N ARG A 74 9.733 21.666 6.671 1.00 0.00 N ATOM 1081 CA ARG A 74 8.776 22.766 6.644 1.00 0.00 C ATOM 1082 C ARG A 74 7.882 22.677 5.410 1.00 0.00 C ATOM 1083 O ARG A 74 6.658 22.621 5.522 1.00 0.00 O ATOM 1084 CB ARG A 74 9.509 24.108 6.660 1.00 0.00 C ATOM 1085 CG ARG A 74 8.713 25.229 7.308 1.00 0.00 C ATOM 1086 CD ARG A 74 9.259 26.595 6.922 1.00 0.00 C ATOM 1087 NE ARG A 74 10.439 26.954 7.705 1.00 0.00 N ATOM 1088 CZ ARG A 74 10.381 27.443 8.938 1.00 0.00 C ATOM 1089 NH1 ARG A 74 9.208 27.631 9.526 1.00 0.00 N ATOM 1090 NH2 ARG A 74 11.499 27.746 9.586 1.00 0.00 N ATOM 0 H ARG A 74 10.684 21.940 6.917 1.00 0.00 H new ATOM 0 HA ARG A 74 8.149 22.692 7.533 1.00 0.00 H new ATOM 0 HB2 ARG A 74 10.453 23.990 7.191 1.00 0.00 H new ATOM 0 HB3 ARG A 74 9.753 24.392 5.636 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.668 25.155 7.007 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.742 25.118 8.392 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.513 26.598 5.862 1.00 0.00 H new ATOM 0 HD3 ARG A 74 8.485 27.349 7.066 1.00 0.00 H new ATOM 0 HE ARG A 74 11.357 26.822 7.281 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.347 27.400 9.031 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.167 28.007 10.473 1.00 0.00 H new ATOM 0 HH21 ARG A 74 12.404 27.603 9.137 1.00 0.00 H new ATOM 0 HH22 ARG A 74 11.454 28.122 10.533 1.00 0.00 H new ATOM 1104 N ASN A 75 8.503 22.666 4.235 1.00 0.00 N ATOM 1105 CA ASN A 75 7.763 22.586 2.981 1.00 0.00 C ATOM 1106 C ASN A 75 7.810 21.171 2.411 1.00 0.00 C ATOM 1107 O ASN A 75 8.719 20.825 1.657 1.00 0.00 O ATOM 1108 CB ASN A 75 8.333 23.577 1.964 1.00 0.00 C ATOM 1109 CG ASN A 75 7.907 23.258 0.544 1.00 0.00 C ATOM 1110 OD1 ASN A 75 8.531 22.443 -0.135 1.00 0.00 O ATOM 1111 ND2 ASN A 75 6.838 23.901 0.089 1.00 0.00 N ATOM 0 H ASN A 75 9.516 22.711 4.125 1.00 0.00 H new ATOM 0 HA ASN A 75 6.723 22.842 3.184 1.00 0.00 H new ATOM 0 HB2 ASN A 75 8.006 24.585 2.221 1.00 0.00 H new ATOM 0 HB3 ASN A 75 9.421 23.570 2.024 1.00 0.00 H new ATOM 0 HD21 ASN A 75 6.503 23.727 -0.859 1.00 0.00 H new ATOM 0 HD22 ASN A 75 6.351 24.569 0.687 1.00 0.00 H new ATOM 1118 N ASN A 76 6.825 20.358 2.777 1.00 0.00 N ATOM 1119 CA ASN A 76 6.754 18.981 2.302 1.00 0.00 C ATOM 1120 C ASN A 76 5.337 18.632 1.855 1.00 0.00 C ATOM 1121 O ASN A 76 4.474 18.319 2.676 1.00 0.00 O ATOM 1122 CB ASN A 76 7.205 18.017 3.401 1.00 0.00 C ATOM 1123 CG ASN A 76 7.658 16.680 2.847 1.00 0.00 C ATOM 1124 OD1 ASN A 76 8.640 16.603 2.109 1.00 0.00 O ATOM 1125 ND2 ASN A 76 6.943 15.620 3.202 1.00 0.00 N ATOM 0 H ASN A 76 6.065 20.629 3.401 1.00 0.00 H new ATOM 0 HA ASN A 76 7.421 18.884 1.445 1.00 0.00 H new ATOM 0 HB2 ASN A 76 8.021 18.469 3.965 1.00 0.00 H new ATOM 0 HB3 ASN A 76 6.384 17.858 4.100 1.00 0.00 H new ATOM 0 HD21 ASN A 76 7.200 14.694 2.861 1.00 0.00 H new ATOM 0 HD22 ASN A 76 6.136 15.731 3.816 1.00 0.00 H new ATOM 1132 N LEU A 77 5.105 18.689 0.548 1.00 0.00 N ATOM 1133 CA LEU A 77 3.793 18.378 -0.010 1.00 0.00 C ATOM 1134 C LEU A 77 3.624 16.874 -0.199 1.00 0.00 C ATOM 1135 O LEU A 77 2.537 16.332 0.000 1.00 0.00 O ATOM 1136 CB LEU A 77 3.603 19.097 -1.347 1.00 0.00 C ATOM 1137 CG LEU A 77 3.200 20.570 -1.266 1.00 0.00 C ATOM 1138 CD1 LEU A 77 3.373 21.245 -2.617 1.00 0.00 C ATOM 1139 CD2 LEU A 77 1.764 20.704 -0.780 1.00 0.00 C ATOM 0 H LEU A 77 5.808 18.947 -0.145 1.00 0.00 H new ATOM 0 HA LEU A 77 3.035 18.724 0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.534 19.026 -1.910 1.00 0.00 H new ATOM 0 HB3 LEU A 77 2.843 18.564 -1.918 1.00 0.00 H new ATOM 0 HG LEU A 77 3.853 21.067 -0.548 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.081 22.292 -2.540 1.00 0.00 H new ATOM 0 HD12 LEU A 77 4.417 21.180 -2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 77 2.745 20.747 -3.356 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.494 21.759 -0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.096 20.192 -1.473 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.672 20.257 0.210 1.00 0.00 H new ATOM 1151 N ASP A 78 4.707 16.206 -0.583 1.00 0.00 N ATOM 1152 CA ASP A 78 4.679 14.764 -0.795 1.00 0.00 C ATOM 1153 C ASP A 78 4.295 14.032 0.487 1.00 0.00 C ATOM 1154 O ASP A 78 5.090 13.937 1.422 1.00 0.00 O ATOM 1155 CB ASP A 78 6.042 14.274 -1.288 1.00 0.00 C ATOM 1156 CG ASP A 78 5.995 12.846 -1.794 1.00 0.00 C ATOM 1157 OD1 ASP A 78 6.002 11.919 -0.958 1.00 0.00 O ATOM 1158 OD2 ASP A 78 5.953 12.655 -3.028 1.00 0.00 O ATOM 0 H ASP A 78 5.614 16.640 -0.754 1.00 0.00 H new ATOM 0 HA ASP A 78 3.927 14.548 -1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 78 6.393 14.928 -2.086 1.00 0.00 H new ATOM 0 HB3 ASP A 78 6.766 14.345 -0.476 1.00 0.00 H new ATOM 1163 N PHE A 79 3.070 13.519 0.524 1.00 0.00 N ATOM 1164 CA PHE A 79 2.578 12.797 1.692 1.00 0.00 C ATOM 1165 C PHE A 79 2.368 11.321 1.371 1.00 0.00 C ATOM 1166 O PHE A 79 1.352 10.732 1.741 1.00 0.00 O ATOM 1167 CB PHE A 79 1.268 13.415 2.186 1.00 0.00 C ATOM 1168 CG PHE A 79 1.438 14.784 2.780 1.00 0.00 C ATOM 1169 CD1 PHE A 79 2.234 14.975 3.898 1.00 0.00 C ATOM 1170 CD2 PHE A 79 0.802 15.881 2.220 1.00 0.00 C ATOM 1171 CE1 PHE A 79 2.390 16.233 4.448 1.00 0.00 C ATOM 1172 CE2 PHE A 79 0.955 17.142 2.765 1.00 0.00 C ATOM 1173 CZ PHE A 79 1.752 17.318 3.880 1.00 0.00 C ATOM 0 H PHE A 79 2.399 13.590 -0.241 1.00 0.00 H new ATOM 0 HA PHE A 79 3.328 12.876 2.479 1.00 0.00 H new ATOM 0 HB2 PHE A 79 0.566 13.473 1.354 1.00 0.00 H new ATOM 0 HB3 PHE A 79 0.823 12.756 2.932 1.00 0.00 H new ATOM 0 HD1 PHE A 79 2.738 14.131 4.345 1.00 0.00 H new ATOM 0 HD2 PHE A 79 0.179 15.749 1.347 1.00 0.00 H new ATOM 0 HE1 PHE A 79 3.011 16.368 5.322 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.453 17.988 2.320 1.00 0.00 H new ATOM 0 HZ PHE A 79 1.876 18.302 4.307 1.00 0.00 H new ATOM 1183 N SER A 80 3.336 10.728 0.680 1.00 0.00 N ATOM 1184 CA SER A 80 3.256 9.321 0.304 1.00 0.00 C ATOM 1185 C SER A 80 3.865 8.434 1.386 1.00 0.00 C ATOM 1186 O SER A 80 4.880 8.783 1.990 1.00 0.00 O ATOM 1187 CB SER A 80 3.971 9.085 -1.028 1.00 0.00 C ATOM 1188 OG SER A 80 4.075 7.701 -1.313 1.00 0.00 O ATOM 0 H SER A 80 4.185 11.200 0.369 1.00 0.00 H new ATOM 0 HA SER A 80 2.204 9.059 0.194 1.00 0.00 H new ATOM 0 HB2 SER A 80 3.427 9.585 -1.830 1.00 0.00 H new ATOM 0 HB3 SER A 80 4.966 9.528 -0.994 1.00 0.00 H new ATOM 0 HG SER A 80 4.534 7.577 -2.170 1.00 0.00 H new ATOM 1194 N ILE A 81 3.238 7.288 1.624 1.00 0.00 N ATOM 1195 CA ILE A 81 3.719 6.350 2.632 1.00 0.00 C ATOM 1196 C ILE A 81 3.795 4.934 2.073 1.00 0.00 C ATOM 1197 O ILE A 81 3.299 4.659 0.980 1.00 0.00 O ATOM 1198 CB ILE A 81 2.813 6.350 3.878 1.00 0.00 C ATOM 1199 CG1 ILE A 81 1.376 5.995 3.491 1.00 0.00 C ATOM 1200 CG2 ILE A 81 2.863 7.705 4.569 1.00 0.00 C ATOM 1201 CD1 ILE A 81 0.609 5.296 4.591 1.00 0.00 C ATOM 0 H ILE A 81 2.396 6.986 1.133 1.00 0.00 H new ATOM 0 HA ILE A 81 4.718 6.679 2.919 1.00 0.00 H new ATOM 0 HB ILE A 81 3.178 5.595 4.575 1.00 0.00 H new ATOM 0 HG12 ILE A 81 0.847 6.907 3.213 1.00 0.00 H new ATOM 0 HG13 ILE A 81 1.393 5.356 2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 81 2.218 7.689 5.447 1.00 0.00 H new ATOM 0 HG22 ILE A 81 3.887 7.920 4.875 1.00 0.00 H new ATOM 0 HG23 ILE A 81 2.520 8.477 3.881 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -0.401 5.075 4.246 1.00 0.00 H new ATOM 0 HD12 ILE A 81 1.115 4.367 4.853 1.00 0.00 H new ATOM 0 HD13 ILE A 81 0.560 5.942 5.468 1.00 0.00 H new ATOM 1213 N SER A 82 4.419 4.037 2.830 1.00 0.00 N ATOM 1214 CA SER A 82 4.563 2.648 2.410 1.00 0.00 C ATOM 1215 C SER A 82 4.269 1.697 3.567 1.00 0.00 C ATOM 1216 O SER A 82 4.913 1.759 4.614 1.00 0.00 O ATOM 1217 CB SER A 82 5.974 2.398 1.875 1.00 0.00 C ATOM 1218 OG SER A 82 5.976 1.368 0.903 1.00 0.00 O ATOM 0 H SER A 82 4.833 4.248 3.738 1.00 0.00 H new ATOM 0 HA SER A 82 3.842 2.458 1.615 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.368 3.315 1.438 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.635 2.127 2.698 1.00 0.00 H new ATOM 0 HG SER A 82 6.889 1.229 0.576 1.00 0.00 H new ATOM 1224 N ILE A 83 3.292 0.819 3.368 1.00 0.00 N ATOM 1225 CA ILE A 83 2.913 -0.146 4.393 1.00 0.00 C ATOM 1226 C ILE A 83 3.545 -1.508 4.127 1.00 0.00 C ATOM 1227 O ILE A 83 3.143 -2.221 3.208 1.00 0.00 O ATOM 1228 CB ILE A 83 1.384 -0.309 4.475 1.00 0.00 C ATOM 1229 CG1 ILE A 83 0.707 1.060 4.561 1.00 0.00 C ATOM 1230 CG2 ILE A 83 1.006 -1.169 5.672 1.00 0.00 C ATOM 1231 CD1 ILE A 83 -0.781 1.017 4.290 1.00 0.00 C ATOM 0 H ILE A 83 2.749 0.756 2.507 1.00 0.00 H new ATOM 0 HA ILE A 83 3.280 0.243 5.343 1.00 0.00 H new ATOM 0 HB ILE A 83 1.038 -0.808 3.570 1.00 0.00 H new ATOM 0 HG12 ILE A 83 0.875 1.478 5.554 1.00 0.00 H new ATOM 0 HG13 ILE A 83 1.179 1.735 3.847 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -0.078 -1.275 5.716 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.463 -2.153 5.571 1.00 0.00 H new ATOM 0 HG23 ILE A 83 1.362 -0.696 6.587 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -1.194 2.023 4.368 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -0.957 0.629 3.287 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -1.265 0.368 5.020 1.00 0.00 H new ATOM 1243 N SER A 84 4.537 -1.863 4.938 1.00 0.00 N ATOM 1244 CA SER A 84 5.226 -3.139 4.789 1.00 0.00 C ATOM 1245 C SER A 84 4.416 -4.270 5.415 1.00 0.00 C ATOM 1246 O SER A 84 3.548 -4.036 6.254 1.00 0.00 O ATOM 1247 CB SER A 84 6.612 -3.072 5.433 1.00 0.00 C ATOM 1248 OG SER A 84 7.153 -4.369 5.617 1.00 0.00 O ATOM 0 H SER A 84 4.881 -1.285 5.705 1.00 0.00 H new ATOM 0 HA SER A 84 5.337 -3.342 3.724 1.00 0.00 H new ATOM 0 HB2 SER A 84 7.280 -2.482 4.805 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.545 -2.563 6.394 1.00 0.00 H new ATOM 0 HG SER A 84 8.040 -4.298 6.028 1.00 0.00 H new ATOM 1254 N ASN A 85 4.708 -5.499 4.999 1.00 0.00 N ATOM 1255 CA ASN A 85 4.007 -6.668 5.518 1.00 0.00 C ATOM 1256 C ASN A 85 2.517 -6.594 5.199 1.00 0.00 C ATOM 1257 O ASN A 85 1.675 -6.862 6.057 1.00 0.00 O ATOM 1258 CB ASN A 85 4.212 -6.782 7.030 1.00 0.00 C ATOM 1259 CG ASN A 85 3.473 -7.965 7.625 1.00 0.00 C ATOM 1260 OD1 ASN A 85 2.402 -7.810 8.213 1.00 0.00 O ATOM 1261 ND2 ASN A 85 4.043 -9.155 7.476 1.00 0.00 N ATOM 0 H ASN A 85 5.425 -5.711 4.305 1.00 0.00 H new ATOM 0 HA ASN A 85 4.420 -7.553 5.035 1.00 0.00 H new ATOM 0 HB2 ASN A 85 5.277 -6.877 7.244 1.00 0.00 H new ATOM 0 HB3 ASN A 85 3.871 -5.865 7.510 1.00 0.00 H new ATOM 0 HD21 ASN A 85 3.593 -9.987 7.856 1.00 0.00 H new ATOM 0 HD22 ASN A 85 4.931 -9.237 6.981 1.00 0.00 H new ATOM 1268 N ILE A 86 2.199 -6.229 3.962 1.00 0.00 N ATOM 1269 CA ILE A 86 0.811 -6.122 3.530 1.00 0.00 C ATOM 1270 C ILE A 86 0.051 -7.417 3.797 1.00 0.00 C ATOM 1271 O ILE A 86 0.627 -8.505 3.772 1.00 0.00 O ATOM 1272 CB ILE A 86 0.713 -5.782 2.031 1.00 0.00 C ATOM 1273 CG1 ILE A 86 1.138 -4.333 1.786 1.00 0.00 C ATOM 1274 CG2 ILE A 86 -0.703 -6.017 1.527 1.00 0.00 C ATOM 1275 CD1 ILE A 86 0.144 -3.316 2.302 1.00 0.00 C ATOM 0 H ILE A 86 2.884 -6.002 3.241 1.00 0.00 H new ATOM 0 HA ILE A 86 0.362 -5.314 4.108 1.00 0.00 H new ATOM 0 HB ILE A 86 1.388 -6.437 1.479 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.103 -4.160 2.263 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.279 -4.180 0.716 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.757 -5.772 0.466 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.972 -7.063 1.672 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.396 -5.384 2.081 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.511 -2.311 2.094 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.816 -3.462 1.807 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.020 -3.442 3.378 1.00 0.00 H new ATOM 1287 N THR A 87 -1.248 -7.292 4.051 1.00 0.00 N ATOM 1288 CA THR A 87 -2.088 -8.452 4.322 1.00 0.00 C ATOM 1289 C THR A 87 -3.327 -8.453 3.433 1.00 0.00 C ATOM 1290 O THR A 87 -3.804 -7.408 2.991 1.00 0.00 O ATOM 1291 CB THR A 87 -2.529 -8.494 5.798 1.00 0.00 C ATOM 1292 OG1 THR A 87 -3.104 -7.237 6.173 1.00 0.00 O ATOM 1293 CG2 THR A 87 -1.350 -8.809 6.706 1.00 0.00 C ATOM 0 H THR A 87 -1.741 -6.399 4.075 1.00 0.00 H new ATOM 0 HA THR A 87 -1.487 -9.335 4.105 1.00 0.00 H new ATOM 0 HB THR A 87 -3.274 -9.282 5.910 1.00 0.00 H new ATOM 0 HG1 THR A 87 -3.383 -7.272 7.112 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.686 -8.833 7.743 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.933 -9.779 6.437 1.00 0.00 H new ATOM 0 HG23 THR A 87 -0.586 -8.040 6.590 1.00 0.00 H new ATOM 1301 N PRO A 88 -3.862 -9.653 3.165 1.00 0.00 N ATOM 1302 CA PRO A 88 -5.053 -9.819 2.327 1.00 0.00 C ATOM 1303 C PRO A 88 -6.316 -9.298 3.005 1.00 0.00 C ATOM 1304 O PRO A 88 -7.409 -9.374 2.445 1.00 0.00 O ATOM 1305 CB PRO A 88 -5.139 -11.334 2.128 1.00 0.00 C ATOM 1306 CG PRO A 88 -4.440 -11.912 3.309 1.00 0.00 C ATOM 1307 CD PRO A 88 -3.346 -10.941 3.658 1.00 0.00 C ATOM 0 HA PRO A 88 -4.978 -9.257 1.396 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.175 -11.668 2.079 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -4.661 -11.639 1.197 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -5.128 -12.042 4.145 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -4.030 -12.895 3.077 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.160 -10.915 4.732 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -2.404 -11.207 3.178 1.00 0.00 H new ATOM 1315 N ALA A 89 -6.158 -8.770 4.215 1.00 0.00 N ATOM 1316 CA ALA A 89 -7.285 -8.235 4.968 1.00 0.00 C ATOM 1317 C ALA A 89 -7.228 -6.713 5.035 1.00 0.00 C ATOM 1318 O ALA A 89 -8.187 -6.064 5.451 1.00 0.00 O ATOM 1319 CB ALA A 89 -7.311 -8.827 6.370 1.00 0.00 C ATOM 0 H ALA A 89 -5.260 -8.702 4.694 1.00 0.00 H new ATOM 0 HA ALA A 89 -8.202 -8.515 4.450 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.158 -8.419 6.922 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -7.408 -9.911 6.306 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -6.385 -8.576 6.888 1.00 0.00 H new ATOM 1325 N ASP A 90 -6.097 -6.150 4.623 1.00 0.00 N ATOM 1326 CA ASP A 90 -5.915 -4.703 4.636 1.00 0.00 C ATOM 1327 C ASP A 90 -6.326 -4.092 3.301 1.00 0.00 C ATOM 1328 O ASP A 90 -6.527 -2.882 3.196 1.00 0.00 O ATOM 1329 CB ASP A 90 -4.458 -4.354 4.944 1.00 0.00 C ATOM 1330 CG ASP A 90 -4.191 -4.244 6.432 1.00 0.00 C ATOM 1331 OD1 ASP A 90 -4.887 -4.928 7.211 1.00 0.00 O ATOM 1332 OD2 ASP A 90 -3.286 -3.475 6.818 1.00 0.00 O ATOM 0 H ASP A 90 -5.293 -6.673 4.276 1.00 0.00 H new ATOM 0 HA ASP A 90 -6.553 -4.288 5.417 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -3.807 -5.116 4.516 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -4.204 -3.410 4.461 1.00 0.00 H new ATOM 1337 N ALA A 91 -6.449 -4.936 2.282 1.00 0.00 N ATOM 1338 CA ALA A 91 -6.837 -4.479 0.953 1.00 0.00 C ATOM 1339 C ALA A 91 -8.118 -3.653 1.009 1.00 0.00 C ATOM 1340 O ALA A 91 -8.775 -3.578 2.047 1.00 0.00 O ATOM 1341 CB ALA A 91 -7.013 -5.666 0.017 1.00 0.00 C ATOM 0 H ALA A 91 -6.285 -5.940 2.351 1.00 0.00 H new ATOM 0 HA ALA A 91 -6.041 -3.842 0.568 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.303 -5.310 -0.972 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.074 -6.214 -0.056 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.789 -6.325 0.407 1.00 0.00 H new ATOM 1347 N GLY A 92 -8.466 -3.033 -0.114 1.00 0.00 N ATOM 1348 CA GLY A 92 -9.667 -2.219 -0.170 1.00 0.00 C ATOM 1349 C GLY A 92 -9.469 -0.949 -0.974 1.00 0.00 C ATOM 1350 O GLY A 92 -9.341 -0.993 -2.198 1.00 0.00 O ATOM 0 H GLY A 92 -7.938 -3.079 -0.986 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.477 -2.801 -0.610 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.974 -1.960 0.843 1.00 0.00 H new ATOM 1354 N THR A 93 -9.446 0.188 -0.285 1.00 0.00 N ATOM 1355 CA THR A 93 -9.266 1.476 -0.943 1.00 0.00 C ATOM 1356 C THR A 93 -8.828 2.545 0.053 1.00 0.00 C ATOM 1357 O THR A 93 -9.594 2.939 0.932 1.00 0.00 O ATOM 1358 CB THR A 93 -10.560 1.938 -1.638 1.00 0.00 C ATOM 1359 OG1 THR A 93 -11.188 0.829 -2.291 1.00 0.00 O ATOM 1360 CG2 THR A 93 -10.268 3.032 -2.654 1.00 0.00 C ATOM 0 H THR A 93 -9.550 0.243 0.728 1.00 0.00 H new ATOM 0 HA THR A 93 -8.488 1.341 -1.694 1.00 0.00 H new ATOM 0 HB THR A 93 -11.231 2.339 -0.878 1.00 0.00 H new ATOM 0 HG1 THR A 93 -10.501 0.233 -2.656 1.00 0.00 H new ATOM 0 HG21 THR A 93 -11.197 3.342 -3.132 1.00 0.00 H new ATOM 0 HG22 THR A 93 -9.817 3.886 -2.149 1.00 0.00 H new ATOM 0 HG23 THR A 93 -9.580 2.653 -3.410 1.00 0.00 H new ATOM 1368 N TYR A 94 -7.592 3.009 -0.092 1.00 0.00 N ATOM 1369 CA TYR A 94 -7.051 4.032 0.796 1.00 0.00 C ATOM 1370 C TYR A 94 -7.325 5.429 0.249 1.00 0.00 C ATOM 1371 O TYR A 94 -6.909 5.767 -0.860 1.00 0.00 O ATOM 1372 CB TYR A 94 -5.546 3.831 0.983 1.00 0.00 C ATOM 1373 CG TYR A 94 -5.185 2.494 1.590 1.00 0.00 C ATOM 1374 CD1 TYR A 94 -5.408 1.311 0.896 1.00 0.00 C ATOM 1375 CD2 TYR A 94 -4.620 2.414 2.857 1.00 0.00 C ATOM 1376 CE1 TYR A 94 -5.080 0.087 1.446 1.00 0.00 C ATOM 1377 CE2 TYR A 94 -4.288 1.194 3.414 1.00 0.00 C ATOM 1378 CZ TYR A 94 -4.519 0.034 2.705 1.00 0.00 C ATOM 1379 OH TYR A 94 -4.191 -1.182 3.258 1.00 0.00 O ATOM 0 H TYR A 94 -6.946 2.694 -0.815 1.00 0.00 H new ATOM 0 HA TYR A 94 -7.546 3.937 1.762 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -5.052 3.927 0.016 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -5.158 4.626 1.619 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -5.845 1.349 -0.091 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -4.437 3.320 3.415 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -5.262 -0.823 0.894 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -3.850 1.149 4.400 1.00 0.00 H new ATOM 0 HH TYR A 94 -4.975 -1.770 3.244 1.00 0.00 H new ATOM 1389 N TYR A 95 -8.028 6.238 1.034 1.00 0.00 N ATOM 1390 CA TYR A 95 -8.360 7.598 0.629 1.00 0.00 C ATOM 1391 C TYR A 95 -7.547 8.617 1.423 1.00 0.00 C ATOM 1392 O TYR A 95 -7.777 8.818 2.616 1.00 0.00 O ATOM 1393 CB TYR A 95 -9.854 7.860 0.822 1.00 0.00 C ATOM 1394 CG TYR A 95 -10.740 6.855 0.120 1.00 0.00 C ATOM 1395 CD1 TYR A 95 -11.092 5.660 0.736 1.00 0.00 C ATOM 1396 CD2 TYR A 95 -11.226 7.102 -1.158 1.00 0.00 C ATOM 1397 CE1 TYR A 95 -11.901 4.740 0.098 1.00 0.00 C ATOM 1398 CE2 TYR A 95 -12.037 6.187 -1.803 1.00 0.00 C ATOM 1399 CZ TYR A 95 -12.370 5.007 -1.171 1.00 0.00 C ATOM 1400 OH TYR A 95 -13.177 4.093 -1.809 1.00 0.00 O ATOM 0 H TYR A 95 -8.379 5.975 1.955 1.00 0.00 H new ATOM 0 HA TYR A 95 -8.112 7.706 -0.427 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -10.081 7.850 1.888 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -10.090 8.859 0.455 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -10.727 5.447 1.730 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -10.966 8.024 -1.656 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -12.165 3.816 0.591 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -12.408 6.395 -2.796 1.00 0.00 H new ATOM 0 HH TYR A 95 -13.421 4.434 -2.695 1.00 0.00 H new ATOM 1410 N CYS A 96 -6.596 9.257 0.752 1.00 0.00 N ATOM 1411 CA CYS A 96 -5.748 10.256 1.392 1.00 0.00 C ATOM 1412 C CYS A 96 -6.569 11.464 1.834 1.00 0.00 C ATOM 1413 O CYS A 96 -6.956 12.298 1.016 1.00 0.00 O ATOM 1414 CB CYS A 96 -4.639 10.701 0.437 1.00 0.00 C ATOM 1415 SG CYS A 96 -3.100 11.208 1.270 1.00 0.00 S ATOM 0 H CYS A 96 -6.393 9.102 -0.235 1.00 0.00 H new ATOM 0 HA CYS A 96 -5.298 9.802 2.275 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -4.416 9.884 -0.250 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -5.005 11.533 -0.165 1.00 0.00 H new ATOM 1420 N VAL A 97 -6.830 11.551 3.135 1.00 0.00 N ATOM 1421 CA VAL A 97 -7.603 12.657 3.687 1.00 0.00 C ATOM 1422 C VAL A 97 -6.692 13.790 4.143 1.00 0.00 C ATOM 1423 O VAL A 97 -5.763 13.579 4.923 1.00 0.00 O ATOM 1424 CB VAL A 97 -8.469 12.198 4.875 1.00 0.00 C ATOM 1425 CG1 VAL A 97 -9.218 13.377 5.477 1.00 0.00 C ATOM 1426 CG2 VAL A 97 -9.436 11.107 4.440 1.00 0.00 C ATOM 0 H VAL A 97 -6.517 10.869 3.826 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.254 13.017 2.891 1.00 0.00 H new ATOM 0 HB VAL A 97 -7.813 11.785 5.642 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -9.824 13.033 6.315 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.503 14.121 5.828 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -9.864 13.822 4.720 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -10.040 10.795 5.292 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -10.088 11.490 3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.875 10.253 4.061 1.00 0.00 H new ATOM 1436 N LYS A 98 -6.964 14.995 3.653 1.00 0.00 N ATOM 1437 CA LYS A 98 -6.171 16.165 4.011 1.00 0.00 C ATOM 1438 C LYS A 98 -6.850 16.965 5.118 1.00 0.00 C ATOM 1439 O LYS A 98 -7.672 17.841 4.850 1.00 0.00 O ATOM 1440 CB LYS A 98 -5.953 17.054 2.785 1.00 0.00 C ATOM 1441 CG LYS A 98 -5.423 18.437 3.122 1.00 0.00 C ATOM 1442 CD LYS A 98 -4.101 18.361 3.867 1.00 0.00 C ATOM 1443 CE LYS A 98 -3.909 19.556 4.787 1.00 0.00 C ATOM 1444 NZ LYS A 98 -3.342 20.728 4.064 1.00 0.00 N ATOM 0 H LYS A 98 -7.729 15.187 3.006 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.205 15.819 4.378 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.254 16.561 2.109 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.896 17.157 2.249 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.292 19.011 2.205 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -6.154 18.970 3.730 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -4.064 17.441 4.451 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -3.281 18.317 3.151 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -4.866 19.831 5.230 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.246 19.280 5.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.744 21.279 4.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.770 20.397 3.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -4.116 21.327 3.714 1.00 0.00 H new ATOM 1458 N PHE A 99 -6.499 16.659 6.363 1.00 0.00 N ATOM 1459 CA PHE A 99 -7.075 17.350 7.511 1.00 0.00 C ATOM 1460 C PHE A 99 -6.513 18.764 7.632 1.00 0.00 C ATOM 1461 O PHE A 99 -5.316 18.985 7.452 1.00 0.00 O ATOM 1462 CB PHE A 99 -6.798 16.567 8.796 1.00 0.00 C ATOM 1463 CG PHE A 99 -7.873 15.575 9.137 1.00 0.00 C ATOM 1464 CD1 PHE A 99 -7.849 14.297 8.602 1.00 0.00 C ATOM 1465 CD2 PHE A 99 -8.907 15.920 9.991 1.00 0.00 C ATOM 1466 CE1 PHE A 99 -8.837 13.381 8.913 1.00 0.00 C ATOM 1467 CE2 PHE A 99 -9.897 15.008 10.307 1.00 0.00 C ATOM 1468 CZ PHE A 99 -9.863 13.738 9.766 1.00 0.00 C ATOM 0 H PHE A 99 -5.819 15.938 6.602 1.00 0.00 H new ATOM 0 HA PHE A 99 -8.152 17.418 7.360 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.849 16.041 8.694 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -6.687 17.269 9.623 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.049 14.013 7.934 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -8.941 16.913 10.415 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -8.806 12.388 8.490 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.696 15.289 10.977 1.00 0.00 H new ATOM 0 HZ PHE A 99 -10.637 13.025 10.009 1.00 0.00 H new ATOM 1478 N ARG A 100 -7.387 19.717 7.938 1.00 0.00 N ATOM 1479 CA ARG A 100 -6.980 21.109 8.082 1.00 0.00 C ATOM 1480 C ARG A 100 -6.882 21.498 9.554 1.00 0.00 C ATOM 1481 O ARG A 100 -7.754 21.160 10.356 1.00 0.00 O ATOM 1482 CB ARG A 100 -7.970 22.029 7.365 1.00 0.00 C ATOM 1483 CG ARG A 100 -9.284 22.206 8.108 1.00 0.00 C ATOM 1484 CD ARG A 100 -10.130 23.308 7.489 1.00 0.00 C ATOM 1485 NE ARG A 100 -11.087 23.863 8.442 1.00 0.00 N ATOM 1486 CZ ARG A 100 -12.075 24.683 8.099 1.00 0.00 C ATOM 1487 NH1 ARG A 100 -12.233 25.041 6.832 1.00 0.00 N ATOM 1488 NH2 ARG A 100 -12.906 25.146 9.024 1.00 0.00 N ATOM 0 H ARG A 100 -8.382 19.550 8.091 1.00 0.00 H new ATOM 0 HA ARG A 100 -5.995 21.222 7.628 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -7.508 23.006 7.223 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -8.175 21.626 6.373 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -9.840 21.268 8.095 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -9.083 22.443 9.153 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -9.479 24.103 7.124 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -10.666 22.913 6.626 1.00 0.00 H new ATOM 0 HE ARG A 100 -10.992 23.607 9.425 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -11.596 24.687 6.119 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -12.992 25.670 6.571 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -12.787 24.873 9.999 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -13.664 25.775 8.760 1.00 0.00 H new ATOM 1502 N LYS A 101 -5.816 22.209 9.904 1.00 0.00 N ATOM 1503 CA LYS A 101 -5.603 22.645 11.279 1.00 0.00 C ATOM 1504 C LYS A 101 -6.809 23.423 11.795 1.00 0.00 C ATOM 1505 O LYS A 101 -7.126 24.501 11.294 1.00 0.00 O ATOM 1506 CB LYS A 101 -4.346 23.513 11.372 1.00 0.00 C ATOM 1507 CG LYS A 101 -3.740 23.559 12.764 1.00 0.00 C ATOM 1508 CD LYS A 101 -2.637 24.600 12.858 1.00 0.00 C ATOM 1509 CE LYS A 101 -2.039 24.652 14.255 1.00 0.00 C ATOM 1510 NZ LYS A 101 -1.514 23.326 14.684 1.00 0.00 N ATOM 0 H LYS A 101 -5.085 22.496 9.253 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.471 21.758 11.899 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.601 23.134 10.673 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -4.591 24.528 11.058 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.518 23.785 13.493 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.339 22.578 13.020 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.855 24.370 12.134 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.036 25.580 12.595 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.234 25.386 14.278 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.797 24.988 14.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.898 23.448 15.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.308 22.702 14.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.969 22.901 13.907 1.00 0.00 H new ATOM 1524 N GLY A 102 -7.478 22.869 12.803 1.00 0.00 N ATOM 1525 CA GLY A 102 -8.640 23.526 13.371 1.00 0.00 C ATOM 1526 C GLY A 102 -8.684 23.422 14.883 1.00 0.00 C ATOM 1527 O GLY A 102 -7.670 23.140 15.522 1.00 0.00 O ATOM 0 H GLY A 102 -7.235 21.978 13.235 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -8.637 24.577 13.082 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -9.544 23.084 12.953 1.00 0.00 H new ATOM 1531 N SER A 103 -9.860 23.651 15.457 1.00 0.00 N ATOM 1532 CA SER A 103 -10.030 23.587 16.904 1.00 0.00 C ATOM 1533 C SER A 103 -11.426 23.087 17.265 1.00 0.00 C ATOM 1534 O SER A 103 -12.409 23.362 16.577 1.00 0.00 O ATOM 1535 CB SER A 103 -9.792 24.963 17.528 1.00 0.00 C ATOM 1536 OG SER A 103 -10.444 25.075 18.781 1.00 0.00 O ATOM 0 H SER A 103 -10.710 23.883 14.942 1.00 0.00 H new ATOM 0 HA SER A 103 -9.297 22.884 17.301 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.722 25.128 17.655 1.00 0.00 H new ATOM 0 HB3 SER A 103 -10.156 25.739 16.855 1.00 0.00 H new ATOM 0 HG SER A 103 -10.275 25.963 19.160 1.00 0.00 H new ATOM 1542 N PRO A 104 -11.515 22.334 18.371 1.00 0.00 N ATOM 1543 CA PRO A 104 -10.351 21.999 19.198 1.00 0.00 C ATOM 1544 C PRO A 104 -9.402 21.033 18.498 1.00 0.00 C ATOM 1545 O PRO A 104 -8.384 20.630 19.061 1.00 0.00 O ATOM 1546 CB PRO A 104 -10.971 21.340 20.433 1.00 0.00 C ATOM 1547 CG PRO A 104 -12.275 20.798 19.959 1.00 0.00 C ATOM 1548 CD PRO A 104 -12.759 21.750 18.900 1.00 0.00 C ATOM 0 HA PRO A 104 -9.746 22.877 19.425 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -10.331 20.548 20.822 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.111 22.061 21.238 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -12.156 19.793 19.555 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -12.990 20.730 20.779 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -13.323 21.234 18.123 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -13.416 22.514 19.316 1.00 0.00 H new ATOM 1556 N ASP A 105 -9.742 20.664 17.268 1.00 0.00 N ATOM 1557 CA ASP A 105 -8.918 19.745 16.490 1.00 0.00 C ATOM 1558 C ASP A 105 -9.063 20.018 14.996 1.00 0.00 C ATOM 1559 O ASP A 105 -9.844 20.876 14.584 1.00 0.00 O ATOM 1560 CB ASP A 105 -9.304 18.297 16.797 1.00 0.00 C ATOM 1561 CG ASP A 105 -8.518 17.723 17.959 1.00 0.00 C ATOM 1562 OD1 ASP A 105 -8.709 18.201 19.097 1.00 0.00 O ATOM 1563 OD2 ASP A 105 -7.713 16.796 17.731 1.00 0.00 O ATOM 0 H ASP A 105 -10.582 20.987 16.788 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.876 19.902 16.770 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.369 18.248 17.023 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.138 17.684 15.911 1.00 0.00 H new ATOM 1568 N ASP A 106 -8.304 19.283 14.190 1.00 0.00 N ATOM 1569 CA ASP A 106 -8.348 19.445 12.741 1.00 0.00 C ATOM 1570 C ASP A 106 -9.748 19.164 12.205 1.00 0.00 C ATOM 1571 O ASP A 106 -10.649 18.792 12.956 1.00 0.00 O ATOM 1572 CB ASP A 106 -7.335 18.515 12.072 1.00 0.00 C ATOM 1573 CG ASP A 106 -7.246 17.166 12.759 1.00 0.00 C ATOM 1574 OD1 ASP A 106 -8.307 16.555 13.006 1.00 0.00 O ATOM 1575 OD2 ASP A 106 -6.116 16.721 13.048 1.00 0.00 O ATOM 0 H ASP A 106 -7.651 18.570 14.515 1.00 0.00 H new ATOM 0 HA ASP A 106 -8.090 20.478 12.507 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -7.613 18.370 11.028 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.353 18.988 12.078 1.00 0.00 H new ATOM 1580 N VAL A 107 -9.923 19.346 10.900 1.00 0.00 N ATOM 1581 CA VAL A 107 -11.213 19.112 10.262 1.00 0.00 C ATOM 1582 C VAL A 107 -11.037 18.597 8.838 1.00 0.00 C ATOM 1583 O VAL A 107 -10.148 19.042 8.112 1.00 0.00 O ATOM 1584 CB VAL A 107 -12.065 20.395 10.231 1.00 0.00 C ATOM 1585 CG1 VAL A 107 -13.291 20.201 9.352 1.00 0.00 C ATOM 1586 CG2 VAL A 107 -12.467 20.801 11.640 1.00 0.00 C ATOM 0 H VAL A 107 -9.188 19.655 10.264 1.00 0.00 H new ATOM 0 HA VAL A 107 -11.728 18.357 10.857 1.00 0.00 H new ATOM 0 HB VAL A 107 -11.465 21.199 9.803 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -13.881 21.118 9.342 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -12.976 19.961 8.336 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -13.896 19.385 9.746 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -13.068 21.709 11.599 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -13.049 20.001 12.097 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -11.572 20.985 12.235 1.00 0.00 H new ATOM 1596 N GLU A 108 -11.890 17.657 8.444 1.00 0.00 N ATOM 1597 CA GLU A 108 -11.828 17.082 7.105 1.00 0.00 C ATOM 1598 C GLU A 108 -11.990 18.163 6.041 1.00 0.00 C ATOM 1599 O GLU A 108 -13.066 18.742 5.887 1.00 0.00 O ATOM 1600 CB GLU A 108 -12.911 16.015 6.934 1.00 0.00 C ATOM 1601 CG GLU A 108 -13.014 15.474 5.518 1.00 0.00 C ATOM 1602 CD GLU A 108 -14.103 14.429 5.370 1.00 0.00 C ATOM 1603 OE1 GLU A 108 -15.291 14.812 5.326 1.00 0.00 O ATOM 1604 OE2 GLU A 108 -13.767 13.229 5.298 1.00 0.00 O ATOM 0 H GLU A 108 -12.632 17.277 9.032 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.849 16.619 6.981 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -12.706 15.189 7.615 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -13.874 16.437 7.224 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.211 16.298 4.832 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -12.057 15.040 5.229 1.00 0.00 H new ATOM 1611 N PHE A 109 -10.914 18.429 5.308 1.00 0.00 N ATOM 1612 CA PHE A 109 -10.936 19.441 4.258 1.00 0.00 C ATOM 1613 C PHE A 109 -11.089 18.796 2.883 1.00 0.00 C ATOM 1614 O PHE A 109 -12.058 19.052 2.169 1.00 0.00 O ATOM 1615 CB PHE A 109 -9.656 20.278 4.301 1.00 0.00 C ATOM 1616 CG PHE A 109 -9.584 21.320 3.221 1.00 0.00 C ATOM 1617 CD1 PHE A 109 -10.276 22.514 3.344 1.00 0.00 C ATOM 1618 CD2 PHE A 109 -8.824 21.105 2.083 1.00 0.00 C ATOM 1619 CE1 PHE A 109 -10.212 23.473 2.351 1.00 0.00 C ATOM 1620 CE2 PHE A 109 -8.756 22.061 1.087 1.00 0.00 C ATOM 1621 CZ PHE A 109 -9.450 23.247 1.222 1.00 0.00 C ATOM 0 H PHE A 109 -10.016 17.958 5.422 1.00 0.00 H new ATOM 0 HA PHE A 109 -11.794 20.091 4.432 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -9.584 20.767 5.272 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -8.795 19.615 4.213 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -10.872 22.697 4.226 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -8.278 20.180 1.973 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -10.758 24.399 2.458 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -8.161 21.880 0.204 1.00 0.00 H new ATOM 0 HZ PHE A 109 -9.397 23.996 0.446 1.00 0.00 H new ATOM 1631 N LYS A 110 -10.124 17.958 2.520 1.00 0.00 N ATOM 1632 CA LYS A 110 -10.149 17.274 1.232 1.00 0.00 C ATOM 1633 C LYS A 110 -10.013 15.766 1.414 1.00 0.00 C ATOM 1634 O LYS A 110 -9.531 15.297 2.445 1.00 0.00 O ATOM 1635 CB LYS A 110 -9.025 17.794 0.333 1.00 0.00 C ATOM 1636 CG LYS A 110 -9.353 17.734 -1.148 1.00 0.00 C ATOM 1637 CD LYS A 110 -10.304 18.848 -1.554 1.00 0.00 C ATOM 1638 CE LYS A 110 -9.614 20.203 -1.537 1.00 0.00 C ATOM 1639 NZ LYS A 110 -10.522 21.293 -1.989 1.00 0.00 N ATOM 0 H LYS A 110 -9.315 17.736 3.100 1.00 0.00 H new ATOM 0 HA LYS A 110 -11.109 17.480 0.758 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -8.801 18.825 0.605 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -8.123 17.212 0.520 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -8.434 17.810 -1.729 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -9.800 16.768 -1.384 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -10.694 18.649 -2.552 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -11.157 18.864 -0.876 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.262 20.419 -0.528 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.735 20.171 -2.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.015 22.201 -1.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -10.838 21.101 -2.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -11.348 21.340 -1.359 1.00 0.00 H new ATOM 1653 N SER A 111 -10.440 15.012 0.406 1.00 0.00 N ATOM 1654 CA SER A 111 -10.368 13.556 0.456 1.00 0.00 C ATOM 1655 C SER A 111 -9.841 12.993 -0.860 1.00 0.00 C ATOM 1656 O SER A 111 -10.245 13.424 -1.939 1.00 0.00 O ATOM 1657 CB SER A 111 -11.746 12.966 0.762 1.00 0.00 C ATOM 1658 OG SER A 111 -11.687 11.553 0.854 1.00 0.00 O ATOM 0 H SER A 111 -10.839 15.385 -0.455 1.00 0.00 H new ATOM 0 HA SER A 111 -9.677 13.278 1.252 1.00 0.00 H new ATOM 0 HB2 SER A 111 -12.122 13.379 1.698 1.00 0.00 H new ATOM 0 HB3 SER A 111 -12.450 13.254 -0.019 1.00 0.00 H new ATOM 0 HG SER A 111 -12.580 11.201 1.052 1.00 0.00 H new ATOM 1664 N GLY A 112 -8.935 12.024 -0.762 1.00 0.00 N ATOM 1665 CA GLY A 112 -8.367 11.417 -1.951 1.00 0.00 C ATOM 1666 C GLY A 112 -9.392 10.638 -2.750 1.00 0.00 C ATOM 1667 O GLY A 112 -10.385 10.160 -2.202 1.00 0.00 O ATOM 0 H GLY A 112 -8.585 11.649 0.120 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -7.934 12.194 -2.581 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -7.554 10.751 -1.662 1.00 0.00 H new ATOM 1671 N ALA A 113 -9.153 10.510 -4.051 1.00 0.00 N ATOM 1672 CA ALA A 113 -10.063 9.784 -4.928 1.00 0.00 C ATOM 1673 C ALA A 113 -10.332 8.380 -4.397 1.00 0.00 C ATOM 1674 O ALA A 113 -11.472 7.916 -4.390 1.00 0.00 O ATOM 1675 CB ALA A 113 -9.497 9.718 -6.339 1.00 0.00 C ATOM 0 H ALA A 113 -8.336 10.900 -4.521 1.00 0.00 H new ATOM 0 HA ALA A 113 -11.010 10.322 -4.954 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -10.187 9.173 -6.983 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -9.362 10.729 -6.725 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -8.535 9.205 -6.322 1.00 0.00 H new ATOM 1681 N GLY A 114 -9.275 7.706 -3.954 1.00 0.00 N ATOM 1682 CA GLY A 114 -9.418 6.361 -3.429 1.00 0.00 C ATOM 1683 C GLY A 114 -8.462 5.380 -4.078 1.00 0.00 C ATOM 1684 O GLY A 114 -8.773 4.789 -5.112 1.00 0.00 O ATOM 0 H GLY A 114 -8.321 8.068 -3.949 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.245 6.374 -2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -10.442 6.021 -3.583 1.00 0.00 H new ATOM 1688 N THR A 115 -7.292 5.207 -3.470 1.00 0.00 N ATOM 1689 CA THR A 115 -6.286 4.293 -3.996 1.00 0.00 C ATOM 1690 C THR A 115 -6.619 2.848 -3.646 1.00 0.00 C ATOM 1691 O THR A 115 -6.433 2.416 -2.509 1.00 0.00 O ATOM 1692 CB THR A 115 -4.884 4.630 -3.455 1.00 0.00 C ATOM 1693 OG1 THR A 115 -4.522 5.965 -3.827 1.00 0.00 O ATOM 1694 CG2 THR A 115 -3.848 3.652 -3.988 1.00 0.00 C ATOM 0 H THR A 115 -7.018 5.688 -2.613 1.00 0.00 H new ATOM 0 HA THR A 115 -6.288 4.411 -5.080 1.00 0.00 H new ATOM 0 HB THR A 115 -4.911 4.551 -2.368 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.630 6.172 -3.477 1.00 0.00 H new ATOM 0 HG21 THR A 115 -2.866 3.911 -3.592 1.00 0.00 H new ATOM 0 HG22 THR A 115 -4.109 2.640 -3.678 1.00 0.00 H new ATOM 0 HG23 THR A 115 -3.825 3.703 -5.077 1.00 0.00 H new ATOM 1702 N GLU A 116 -7.112 2.104 -4.632 1.00 0.00 N ATOM 1703 CA GLU A 116 -7.471 0.705 -4.426 1.00 0.00 C ATOM 1704 C GLU A 116 -6.224 -0.170 -4.343 1.00 0.00 C ATOM 1705 O GLU A 116 -5.334 -0.085 -5.190 1.00 0.00 O ATOM 1706 CB GLU A 116 -8.376 0.216 -5.559 1.00 0.00 C ATOM 1707 CG GLU A 116 -8.620 -1.283 -5.538 1.00 0.00 C ATOM 1708 CD GLU A 116 -9.263 -1.787 -6.816 1.00 0.00 C ATOM 1709 OE1 GLU A 116 -10.510 -1.798 -6.888 1.00 0.00 O ATOM 1710 OE2 GLU A 116 -8.520 -2.171 -7.743 1.00 0.00 O ATOM 0 H GLU A 116 -7.272 2.446 -5.580 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.010 0.630 -3.482 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.334 0.733 -5.496 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -7.928 0.489 -6.514 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -7.673 -1.800 -5.384 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -9.260 -1.531 -4.691 1.00 0.00 H new ATOM 1717 N LEU A 117 -6.166 -1.011 -3.316 1.00 0.00 N ATOM 1718 CA LEU A 117 -5.028 -1.902 -3.120 1.00 0.00 C ATOM 1719 C LEU A 117 -5.332 -3.298 -3.655 1.00 0.00 C ATOM 1720 O LEU A 117 -6.437 -3.813 -3.482 1.00 0.00 O ATOM 1721 CB LEU A 117 -4.665 -1.980 -1.636 1.00 0.00 C ATOM 1722 CG LEU A 117 -3.430 -2.811 -1.290 1.00 0.00 C ATOM 1723 CD1 LEU A 117 -2.164 -2.097 -1.736 1.00 0.00 C ATOM 1724 CD2 LEU A 117 -3.383 -3.100 0.204 1.00 0.00 C ATOM 0 H LEU A 117 -6.894 -1.094 -2.606 1.00 0.00 H new ATOM 0 HA LEU A 117 -4.181 -1.497 -3.674 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -4.511 -0.966 -1.266 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -5.518 -2.391 -1.095 1.00 0.00 H new ATOM 0 HG LEU A 117 -3.494 -3.760 -1.822 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -1.295 -2.704 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.195 -1.942 -2.814 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.093 -1.133 -1.232 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.497 -3.693 0.432 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.343 -2.161 0.755 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -4.275 -3.654 0.496 1.00 0.00 H new ATOM 1736 N SER A 118 -4.343 -3.906 -4.303 1.00 0.00 N ATOM 1737 CA SER A 118 -4.505 -5.242 -4.864 1.00 0.00 C ATOM 1738 C SER A 118 -3.571 -6.236 -4.180 1.00 0.00 C ATOM 1739 O SER A 118 -2.484 -6.529 -4.680 1.00 0.00 O ATOM 1740 CB SER A 118 -4.234 -5.222 -6.370 1.00 0.00 C ATOM 1741 OG SER A 118 -4.555 -3.961 -6.929 1.00 0.00 O ATOM 0 H SER A 118 -3.422 -3.495 -4.452 1.00 0.00 H new ATOM 0 HA SER A 118 -5.533 -5.559 -4.691 1.00 0.00 H new ATOM 0 HB2 SER A 118 -3.185 -5.450 -6.557 1.00 0.00 H new ATOM 0 HB3 SER A 118 -4.821 -6.000 -6.859 1.00 0.00 H new ATOM 0 HG SER A 118 -3.855 -3.314 -6.700 1.00 0.00 H new ATOM 1747 N VAL A 119 -4.002 -6.751 -3.033 1.00 0.00 N ATOM 1748 CA VAL A 119 -3.206 -7.712 -2.280 1.00 0.00 C ATOM 1749 C VAL A 119 -3.189 -9.072 -2.970 1.00 0.00 C ATOM 1750 O VAL A 119 -4.197 -9.778 -2.998 1.00 0.00 O ATOM 1751 CB VAL A 119 -3.741 -7.883 -0.846 1.00 0.00 C ATOM 1752 CG1 VAL A 119 -2.955 -8.955 -0.107 1.00 0.00 C ATOM 1753 CG2 VAL A 119 -3.689 -6.560 -0.097 1.00 0.00 C ATOM 0 H VAL A 119 -4.898 -6.519 -2.605 1.00 0.00 H new ATOM 0 HA VAL A 119 -2.191 -7.317 -2.236 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.782 -8.203 -0.901 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.347 -9.062 0.904 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.049 -9.904 -0.635 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.904 -8.669 -0.060 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.071 -6.699 0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.658 -6.208 -0.051 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.301 -5.823 -0.617 1.00 0.00 H new ATOM 1763 N ARG A 120 -2.036 -9.433 -3.525 1.00 0.00 N ATOM 1764 CA ARG A 120 -1.888 -10.708 -4.216 1.00 0.00 C ATOM 1765 C ARG A 120 -1.353 -11.780 -3.271 1.00 0.00 C ATOM 1766 O ARG A 120 -0.261 -11.645 -2.719 1.00 0.00 O ATOM 1767 CB ARG A 120 -0.950 -10.557 -5.415 1.00 0.00 C ATOM 1768 CG ARG A 120 -1.578 -9.824 -6.590 1.00 0.00 C ATOM 1769 CD ARG A 120 -0.694 -9.894 -7.826 1.00 0.00 C ATOM 1770 NE ARG A 120 -1.339 -9.300 -8.994 1.00 0.00 N ATOM 1771 CZ ARG A 120 -0.672 -8.830 -10.042 1.00 0.00 C ATOM 1772 NH1 ARG A 120 0.653 -8.885 -10.069 1.00 0.00 N ATOM 1773 NH2 ARG A 120 -1.330 -8.305 -11.068 1.00 0.00 N ATOM 0 H ARG A 120 -1.192 -8.861 -3.509 1.00 0.00 H new ATOM 0 HA ARG A 120 -2.872 -11.017 -4.569 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -0.054 -10.021 -5.100 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -0.631 -11.546 -5.743 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -2.552 -10.259 -6.813 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -1.748 -8.781 -6.321 1.00 0.00 H new ATOM 0 HD2 ARG A 120 0.246 -9.378 -7.629 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -0.448 -10.935 -8.038 1.00 0.00 H new ATOM 0 HE ARG A 120 -2.357 -9.243 -9.006 1.00 0.00 H new ATOM 0 HH11 ARG A 120 1.163 -9.289 -9.283 1.00 0.00 H new ATOM 0 HH12 ARG A 120 1.162 -8.523 -10.875 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -2.349 -8.262 -11.052 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -0.817 -7.944 -11.872 1.00 0.00 H new ATOM 1787 N ALA A 121 -2.130 -12.842 -3.088 1.00 0.00 N ATOM 1788 CA ALA A 121 -1.733 -13.937 -2.211 1.00 0.00 C ATOM 1789 C ALA A 121 -0.292 -14.358 -2.475 1.00 0.00 C ATOM 1790 O ALA A 121 0.230 -14.169 -3.575 1.00 0.00 O ATOM 1791 CB ALA A 121 -2.672 -15.121 -2.388 1.00 0.00 C ATOM 0 H ALA A 121 -3.038 -12.968 -3.535 1.00 0.00 H new ATOM 0 HA ALA A 121 -1.798 -13.586 -1.181 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -2.364 -15.931 -1.727 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.690 -14.818 -2.141 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -2.636 -15.463 -3.422 1.00 0.00 H new ATOM 1797 N LYS A 122 0.349 -14.928 -1.460 1.00 0.00 N ATOM 1798 CA LYS A 122 1.731 -15.376 -1.582 1.00 0.00 C ATOM 1799 C LYS A 122 1.998 -15.943 -2.973 1.00 0.00 C ATOM 1800 O LYS A 122 1.121 -16.525 -3.612 1.00 0.00 O ATOM 1801 CB LYS A 122 2.041 -16.434 -0.521 1.00 0.00 C ATOM 1802 CG LYS A 122 1.434 -17.794 -0.821 1.00 0.00 C ATOM 1803 CD LYS A 122 1.625 -18.758 0.338 1.00 0.00 C ATOM 1804 CE LYS A 122 0.682 -19.946 0.235 1.00 0.00 C ATOM 1805 NZ LYS A 122 0.977 -20.788 -0.958 1.00 0.00 N ATOM 0 H LYS A 122 -0.067 -15.091 -0.543 1.00 0.00 H new ATOM 0 HA LYS A 122 2.381 -14.515 -1.429 1.00 0.00 H new ATOM 0 HB2 LYS A 122 3.122 -16.540 -0.431 1.00 0.00 H new ATOM 0 HB3 LYS A 122 1.673 -16.087 0.445 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.370 -17.681 -1.030 1.00 0.00 H new ATOM 0 HG3 LYS A 122 1.892 -18.208 -1.719 1.00 0.00 H new ATOM 0 HD2 LYS A 122 2.656 -19.111 0.353 1.00 0.00 H new ATOM 0 HD3 LYS A 122 1.453 -18.236 1.279 1.00 0.00 H new ATOM 0 HE2 LYS A 122 0.763 -20.553 1.137 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -0.347 -19.589 0.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 0.334 -21.606 -0.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 0.842 -20.225 -1.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 1.961 -21.122 -0.913 1.00 0.00 H new ATOM 1819 N PRO A 123 3.238 -15.772 -3.454 1.00 0.00 N ATOM 1820 CA PRO A 123 3.650 -16.262 -4.773 1.00 0.00 C ATOM 1821 C PRO A 123 3.734 -17.783 -4.827 1.00 0.00 C ATOM 1822 O PRO A 123 4.681 -18.381 -4.316 1.00 0.00 O ATOM 1823 CB PRO A 123 5.037 -15.643 -4.964 1.00 0.00 C ATOM 1824 CG PRO A 123 5.543 -15.413 -3.582 1.00 0.00 C ATOM 1825 CD PRO A 123 4.335 -15.088 -2.747 1.00 0.00 C ATOM 0 HA PRO A 123 2.935 -15.990 -5.550 1.00 0.00 H new ATOM 0 HB2 PRO A 123 5.695 -16.310 -5.521 1.00 0.00 H new ATOM 0 HB3 PRO A 123 4.980 -14.710 -5.525 1.00 0.00 H new ATOM 0 HG2 PRO A 123 6.054 -16.297 -3.201 1.00 0.00 H new ATOM 0 HG3 PRO A 123 6.263 -14.595 -3.561 1.00 0.00 H new ATOM 0 HD2 PRO A 123 4.443 -15.452 -1.725 1.00 0.00 H new ATOM 0 HD3 PRO A 123 4.166 -14.013 -2.686 1.00 0.00 H new ATOM 1833 N SER A 124 2.737 -18.404 -5.449 1.00 0.00 N ATOM 1834 CA SER A 124 2.696 -19.857 -5.567 1.00 0.00 C ATOM 1835 C SER A 124 3.842 -20.364 -6.438 1.00 0.00 C ATOM 1836 O SER A 124 4.057 -19.873 -7.546 1.00 0.00 O ATOM 1837 CB SER A 124 1.357 -20.305 -6.154 1.00 0.00 C ATOM 1838 OG SER A 124 1.274 -19.991 -7.533 1.00 0.00 O ATOM 0 H SER A 124 1.947 -17.924 -5.879 1.00 0.00 H new ATOM 0 HA SER A 124 2.806 -20.281 -4.569 1.00 0.00 H new ATOM 0 HB2 SER A 124 1.237 -21.379 -6.015 1.00 0.00 H new ATOM 0 HB3 SER A 124 0.541 -19.821 -5.618 1.00 0.00 H new ATOM 0 HG SER A 124 2.173 -19.822 -7.885 1.00 0.00 H new ATOM 1844 N ALA A 125 4.573 -21.350 -5.929 1.00 0.00 N ATOM 1845 CA ALA A 125 5.695 -21.926 -6.660 1.00 0.00 C ATOM 1846 C ALA A 125 5.305 -22.248 -8.098 1.00 0.00 C ATOM 1847 O ALA A 125 4.174 -22.639 -8.388 1.00 0.00 O ATOM 1848 CB ALA A 125 6.198 -23.176 -5.955 1.00 0.00 C ATOM 0 H ALA A 125 4.408 -21.767 -5.013 1.00 0.00 H new ATOM 0 HA ALA A 125 6.498 -21.189 -6.685 1.00 0.00 H new ATOM 0 HB1 ALA A 125 7.036 -23.596 -6.512 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.524 -22.919 -4.947 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.395 -23.911 -5.900 1.00 0.00 H new ATOM 1854 N PRO A 126 6.262 -22.080 -9.023 1.00 0.00 N ATOM 1855 CA PRO A 126 6.041 -22.348 -10.448 1.00 0.00 C ATOM 1856 C PRO A 126 5.883 -23.836 -10.740 1.00 0.00 C ATOM 1857 O PRO A 126 5.980 -24.669 -9.840 1.00 0.00 O ATOM 1858 CB PRO A 126 7.310 -21.804 -11.111 1.00 0.00 C ATOM 1859 CG PRO A 126 8.350 -21.868 -10.047 1.00 0.00 C ATOM 1860 CD PRO A 126 7.632 -21.617 -8.750 1.00 0.00 C ATOM 0 HA PRO A 126 5.122 -21.888 -10.812 1.00 0.00 H new ATOM 0 HB2 PRO A 126 7.592 -22.403 -11.977 1.00 0.00 H new ATOM 0 HB3 PRO A 126 7.166 -20.783 -11.463 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.841 -22.841 -10.039 1.00 0.00 H new ATOM 0 HG3 PRO A 126 9.126 -21.121 -10.214 1.00 0.00 H new ATOM 0 HD2 PRO A 126 8.086 -22.168 -7.926 1.00 0.00 H new ATOM 0 HD3 PRO A 126 7.653 -20.562 -8.477 1.00 0.00 H new ATOM 1868 N VAL A 127 5.639 -24.163 -12.005 1.00 0.00 N ATOM 1869 CA VAL A 127 5.468 -25.551 -12.417 1.00 0.00 C ATOM 1870 C VAL A 127 6.687 -26.050 -13.184 1.00 0.00 C ATOM 1871 O VAL A 127 6.774 -25.897 -14.402 1.00 0.00 O ATOM 1872 CB VAL A 127 4.216 -25.726 -13.296 1.00 0.00 C ATOM 1873 CG1 VAL A 127 4.070 -27.175 -13.735 1.00 0.00 C ATOM 1874 CG2 VAL A 127 2.974 -25.258 -12.552 1.00 0.00 C ATOM 0 H VAL A 127 5.555 -23.485 -12.763 1.00 0.00 H new ATOM 0 HA VAL A 127 5.348 -26.139 -11.507 1.00 0.00 H new ATOM 0 HB VAL A 127 4.331 -25.111 -14.189 1.00 0.00 H new ATOM 0 HG11 VAL A 127 3.180 -27.279 -14.355 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.948 -27.472 -14.308 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.977 -27.814 -12.857 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.098 -25.389 -13.188 1.00 0.00 H new ATOM 0 HG22 VAL A 127 2.852 -25.845 -11.642 1.00 0.00 H new ATOM 0 HG23 VAL A 127 3.080 -24.205 -12.293 1.00 0.00 H new ATOM 1884 N VAL A 128 7.629 -26.650 -12.462 1.00 0.00 N ATOM 1885 CA VAL A 128 8.844 -27.175 -13.075 1.00 0.00 C ATOM 1886 C VAL A 128 8.567 -27.708 -14.476 1.00 0.00 C ATOM 1887 O VAL A 128 7.493 -28.245 -14.746 1.00 0.00 O ATOM 1888 CB VAL A 128 9.461 -28.299 -12.222 1.00 0.00 C ATOM 1889 CG1 VAL A 128 8.663 -29.585 -12.374 1.00 0.00 C ATOM 1890 CG2 VAL A 128 10.918 -28.518 -12.604 1.00 0.00 C ATOM 0 H VAL A 128 7.574 -26.784 -11.452 1.00 0.00 H new ATOM 0 HA VAL A 128 9.550 -26.347 -13.138 1.00 0.00 H new ATOM 0 HB VAL A 128 9.424 -27.999 -11.175 1.00 0.00 H new ATOM 0 HG11 VAL A 128 9.114 -30.367 -11.764 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.637 -29.417 -12.048 1.00 0.00 H new ATOM 0 HG13 VAL A 128 8.665 -29.893 -13.419 1.00 0.00 H new ATOM 0 HG21 VAL A 128 11.339 -29.316 -11.992 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.980 -28.797 -13.656 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.480 -27.599 -12.438 1.00 0.00 H new ATOM 1900 N SER A 129 9.544 -27.556 -15.364 1.00 0.00 N ATOM 1901 CA SER A 129 9.404 -28.019 -16.740 1.00 0.00 C ATOM 1902 C SER A 129 8.040 -27.638 -17.306 1.00 0.00 C ATOM 1903 O SER A 129 7.395 -28.431 -17.990 1.00 0.00 O ATOM 1904 CB SER A 129 9.593 -29.535 -16.812 1.00 0.00 C ATOM 1905 OG SER A 129 10.967 -29.875 -16.885 1.00 0.00 O ATOM 0 H SER A 129 10.440 -27.116 -15.156 1.00 0.00 H new ATOM 0 HA SER A 129 10.175 -27.535 -17.340 1.00 0.00 H new ATOM 0 HB2 SER A 129 9.146 -30.002 -15.935 1.00 0.00 H new ATOM 0 HB3 SER A 129 9.071 -29.929 -17.684 1.00 0.00 H new ATOM 0 HG SER A 129 11.061 -30.850 -16.928 1.00 0.00 H new ATOM 1911 N GLY A 130 7.606 -26.415 -17.015 1.00 0.00 N ATOM 1912 CA GLY A 130 6.321 -25.948 -17.502 1.00 0.00 C ATOM 1913 C GLY A 130 6.394 -25.425 -18.922 1.00 0.00 C ATOM 1914 O GLY A 130 5.887 -26.055 -19.851 1.00 0.00 O ATOM 0 H GLY A 130 8.121 -25.740 -16.451 1.00 0.00 H new ATOM 0 HA2 GLY A 130 5.600 -26.764 -17.455 1.00 0.00 H new ATOM 0 HA3 GLY A 130 5.952 -25.159 -16.846 1.00 0.00 H new ATOM 1918 N SER A 131 7.026 -24.268 -19.093 1.00 0.00 N ATOM 1919 CA SER A 131 7.159 -23.656 -20.410 1.00 0.00 C ATOM 1920 C SER A 131 8.118 -24.457 -21.286 1.00 0.00 C ATOM 1921 O SER A 131 9.282 -24.650 -20.936 1.00 0.00 O ATOM 1922 CB SER A 131 7.653 -22.214 -20.279 1.00 0.00 C ATOM 1923 OG SER A 131 6.798 -21.457 -19.441 1.00 0.00 O ATOM 0 H SER A 131 7.454 -23.736 -18.336 1.00 0.00 H new ATOM 0 HA SER A 131 6.177 -23.654 -20.883 1.00 0.00 H new ATOM 0 HB2 SER A 131 8.664 -22.208 -19.873 1.00 0.00 H new ATOM 0 HB3 SER A 131 7.703 -21.752 -21.265 1.00 0.00 H new ATOM 0 HG SER A 131 7.136 -20.540 -19.372 1.00 0.00 H new ATOM 1929 N GLY A 132 7.620 -24.921 -22.428 1.00 0.00 N ATOM 1930 CA GLY A 132 8.444 -25.695 -23.337 1.00 0.00 C ATOM 1931 C GLY A 132 8.448 -25.128 -24.742 1.00 0.00 C ATOM 1932 O GLY A 132 7.607 -24.305 -25.105 1.00 0.00 O ATOM 0 H GLY A 132 6.660 -24.774 -22.740 1.00 0.00 H new ATOM 0 HA2 GLY A 132 9.466 -25.727 -22.959 1.00 0.00 H new ATOM 0 HA3 GLY A 132 8.082 -26.723 -23.364 1.00 0.00 H new ATOM 1936 N PRO A 133 9.416 -25.569 -25.560 1.00 0.00 N ATOM 1937 CA PRO A 133 9.550 -25.112 -26.946 1.00 0.00 C ATOM 1938 C PRO A 133 8.426 -25.627 -27.838 1.00 0.00 C ATOM 1939 O PRO A 133 8.317 -26.828 -28.085 1.00 0.00 O ATOM 1940 CB PRO A 133 10.893 -25.700 -27.386 1.00 0.00 C ATOM 1941 CG PRO A 133 11.087 -26.892 -26.514 1.00 0.00 C ATOM 1942 CD PRO A 133 10.452 -26.549 -25.195 1.00 0.00 C ATOM 0 HA PRO A 133 9.499 -24.026 -27.023 1.00 0.00 H new ATOM 0 HB2 PRO A 133 10.877 -25.978 -28.440 1.00 0.00 H new ATOM 0 HB3 PRO A 133 11.701 -24.980 -27.258 1.00 0.00 H new ATOM 0 HG2 PRO A 133 10.623 -27.776 -26.952 1.00 0.00 H new ATOM 0 HG3 PRO A 133 12.146 -27.117 -26.390 1.00 0.00 H new ATOM 0 HD2 PRO A 133 10.022 -27.428 -24.715 1.00 0.00 H new ATOM 0 HD3 PRO A 133 11.176 -26.127 -24.498 1.00 0.00 H new ATOM 1950 N SER A 134 7.591 -24.711 -28.320 1.00 0.00 N ATOM 1951 CA SER A 134 6.473 -25.073 -29.182 1.00 0.00 C ATOM 1952 C SER A 134 6.832 -24.872 -30.651 1.00 0.00 C ATOM 1953 O SER A 134 7.819 -24.213 -30.975 1.00 0.00 O ATOM 1954 CB SER A 134 5.238 -24.242 -28.828 1.00 0.00 C ATOM 1955 OG SER A 134 4.697 -24.638 -27.580 1.00 0.00 O ATOM 0 H SER A 134 7.668 -23.712 -28.127 1.00 0.00 H new ATOM 0 HA SER A 134 6.250 -26.128 -29.022 1.00 0.00 H new ATOM 0 HB2 SER A 134 5.504 -23.186 -28.794 1.00 0.00 H new ATOM 0 HB3 SER A 134 4.484 -24.355 -29.607 1.00 0.00 H new ATOM 0 HG SER A 134 3.910 -24.091 -27.376 1.00 0.00 H new ATOM 1961 N SER A 135 6.022 -25.445 -31.535 1.00 0.00 N ATOM 1962 CA SER A 135 6.255 -25.333 -32.971 1.00 0.00 C ATOM 1963 C SER A 135 5.048 -24.716 -33.670 1.00 0.00 C ATOM 1964 O SER A 135 3.907 -24.920 -33.259 1.00 0.00 O ATOM 1965 CB SER A 135 6.558 -26.709 -33.568 1.00 0.00 C ATOM 1966 OG SER A 135 7.048 -26.592 -34.893 1.00 0.00 O ATOM 0 H SER A 135 5.199 -25.992 -31.283 1.00 0.00 H new ATOM 0 HA SER A 135 7.115 -24.681 -33.126 1.00 0.00 H new ATOM 0 HB2 SER A 135 7.293 -27.224 -32.949 1.00 0.00 H new ATOM 0 HB3 SER A 135 5.654 -27.318 -33.563 1.00 0.00 H new ATOM 0 HG SER A 135 7.236 -27.484 -35.252 1.00 0.00 H new ATOM 1972 N GLY A 136 5.310 -23.960 -34.733 1.00 0.00 N ATOM 1973 CA GLY A 136 4.236 -23.325 -35.474 1.00 0.00 C ATOM 1974 C GLY A 136 4.608 -23.059 -36.919 1.00 0.00 C ATOM 1975 O GLY A 136 3.866 -23.419 -37.833 1.00 0.00 O ATOM 0 H GLY A 136 6.246 -23.776 -35.093 1.00 0.00 H new ATOM 0 HA2 GLY A 136 3.351 -23.960 -35.441 1.00 0.00 H new ATOM 0 HA3 GLY A 136 3.972 -22.384 -34.991 1.00 0.00 H new TER 1979 GLY A 136