USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 934 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 64 LYS NZ :NH3+ -130:sc= 0.0103 (180deg=-0.00439) USER MOD Set 1.2: A 75 HIS : no HD1:sc= 0.664 K(o=0.67,f=-10!) USER MOD Single : A 1 GLY N :NH3+ 140:sc= 0.0226 (180deg=0) USER MOD Single : A 2 SER OG : rot 42:sc= 0.936 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 52:sc= 0.05 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.052) USER MOD Single : A 27 GLN : amide:sc= -0.112 K(o=-0.11,f=-1.8) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot -26:sc= -2.01 USER MOD Single : A 48 HIS : no HD1:sc= -3.25! C(o=-3.2!,f=-1.5!) USER MOD Single : A 54 HIS : no HD1:sc= -0.445 K(o=-0.45,f=-1.7) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.788 K(o=-0.79,f=-0.11) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 96:sc= 1.39 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0.649 K(o=0.65,f=-3.9!) USER MOD Single : A 69 ASN : amide:sc= -0.023 X(o=-0.023,f=-0.34) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0945 K(o=-0.095,f=-1.8!) USER MOD Single : A 78 LYS NZ :NH3+ -164:sc= -0.0261 (180deg=-0.259) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0.045) USER MOD Single : A 84 GLN : amide:sc= -0.0317 X(o=-0.032,f=-0.53) USER MOD Single : A 89 SER OG : rot 3:sc= 0.598 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -3.48! C(o=-3.5!,f=-3.9!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc=-0.00683 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 GLN : amide:sc=-0.00245 K(o=-0.0025,f=-0.61) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.977 15.139 1.955 1.00 0.00 N ATOM 2 CA GLY A 1 14.535 13.862 1.548 1.00 0.00 C ATOM 3 C GLY A 1 15.907 13.613 2.141 1.00 0.00 C ATOM 4 O GLY A 1 16.694 14.544 2.316 1.00 0.00 O ATOM 0 H1 GLY A 1 13.493 15.580 1.147 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.296 14.990 2.727 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.741 15.763 2.283 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.861 13.061 1.852 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.601 13.828 0.461 1.00 0.00 H new ATOM 8 N SER A 2 16.196 12.354 2.453 1.00 0.00 N ATOM 9 CA SER A 2 17.481 11.986 3.036 1.00 0.00 C ATOM 10 C SER A 2 18.252 11.054 2.106 1.00 0.00 C ATOM 11 O SER A 2 17.941 9.868 2.001 1.00 0.00 O ATOM 12 CB SER A 2 17.276 11.314 4.395 1.00 0.00 C ATOM 13 OG SER A 2 16.559 10.099 4.259 1.00 0.00 O ATOM 0 H SER A 2 15.557 11.571 2.312 1.00 0.00 H new ATOM 0 HA SER A 2 18.063 12.897 3.174 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.243 11.119 4.858 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.734 11.987 5.059 1.00 0.00 H new ATOM 0 HG SER A 2 16.893 9.608 3.480 1.00 0.00 H new ATOM 19 N SER A 3 19.260 11.600 1.434 1.00 0.00 N ATOM 20 CA SER A 3 20.075 10.820 0.510 1.00 0.00 C ATOM 21 C SER A 3 19.200 9.924 -0.362 1.00 0.00 C ATOM 22 O SER A 3 19.529 8.765 -0.609 1.00 0.00 O ATOM 23 CB SER A 3 21.086 9.969 1.281 1.00 0.00 C ATOM 24 OG SER A 3 22.245 9.724 0.503 1.00 0.00 O ATOM 0 H SER A 3 19.532 12.580 1.512 1.00 0.00 H new ATOM 0 HA SER A 3 20.613 11.514 -0.136 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.365 10.477 2.204 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.627 9.022 1.564 1.00 0.00 H new ATOM 0 HG SER A 3 22.876 9.180 1.019 1.00 0.00 H new ATOM 30 N GLY A 4 18.081 10.472 -0.827 1.00 0.00 N ATOM 31 CA GLY A 4 17.174 9.710 -1.666 1.00 0.00 C ATOM 32 C GLY A 4 17.733 9.471 -3.055 1.00 0.00 C ATOM 33 O GLY A 4 18.667 10.149 -3.480 1.00 0.00 O ATOM 0 H GLY A 4 17.786 11.430 -0.638 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.964 8.751 -1.192 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.225 10.241 -1.746 1.00 0.00 H new ATOM 37 N SER A 5 17.160 8.503 -3.763 1.00 0.00 N ATOM 38 CA SER A 5 17.610 8.172 -5.110 1.00 0.00 C ATOM 39 C SER A 5 17.275 9.296 -6.086 1.00 0.00 C ATOM 40 O SER A 5 16.316 10.042 -5.885 1.00 0.00 O ATOM 41 CB SER A 5 16.967 6.865 -5.578 1.00 0.00 C ATOM 42 OG SER A 5 17.574 5.746 -4.956 1.00 0.00 O ATOM 0 H SER A 5 16.383 7.934 -3.426 1.00 0.00 H new ATOM 0 HA SER A 5 18.693 8.047 -5.085 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.901 6.878 -5.349 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.060 6.778 -6.661 1.00 0.00 H new ATOM 0 HG SER A 5 17.144 4.924 -5.271 1.00 0.00 H new ATOM 48 N SER A 6 18.071 9.409 -7.144 1.00 0.00 N ATOM 49 CA SER A 6 17.862 10.444 -8.150 1.00 0.00 C ATOM 50 C SER A 6 18.437 10.015 -9.497 1.00 0.00 C ATOM 51 O SER A 6 19.487 9.378 -9.562 1.00 0.00 O ATOM 52 CB SER A 6 18.506 11.758 -7.703 1.00 0.00 C ATOM 53 OG SER A 6 18.616 12.666 -8.785 1.00 0.00 O ATOM 0 H SER A 6 18.866 8.797 -7.327 1.00 0.00 H new ATOM 0 HA SER A 6 16.788 10.595 -8.263 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.911 12.206 -6.907 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.494 11.560 -7.289 1.00 0.00 H new ATOM 0 HG SER A 6 19.029 13.498 -8.473 1.00 0.00 H new ATOM 59 N GLY A 7 17.739 10.371 -10.571 1.00 0.00 N ATOM 60 CA GLY A 7 18.194 10.016 -11.903 1.00 0.00 C ATOM 61 C GLY A 7 17.053 9.896 -12.893 1.00 0.00 C ATOM 62 O GLY A 7 16.056 9.228 -12.621 1.00 0.00 O ATOM 0 H GLY A 7 16.867 10.899 -10.543 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.899 10.769 -12.255 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.734 9.070 -11.859 1.00 0.00 H new ATOM 66 N GLN A 8 17.199 10.545 -14.043 1.00 0.00 N ATOM 67 CA GLN A 8 16.170 10.509 -15.076 1.00 0.00 C ATOM 68 C GLN A 8 15.943 9.084 -15.569 1.00 0.00 C ATOM 69 O GLN A 8 14.805 8.625 -15.666 1.00 0.00 O ATOM 70 CB GLN A 8 16.562 11.410 -16.248 1.00 0.00 C ATOM 71 CG GLN A 8 16.377 12.892 -15.964 1.00 0.00 C ATOM 72 CD GLN A 8 16.922 13.771 -17.073 1.00 0.00 C ATOM 73 OE1 GLN A 8 16.882 13.405 -18.248 1.00 0.00 O ATOM 74 NE2 GLN A 8 17.437 14.939 -16.704 1.00 0.00 N ATOM 0 H GLN A 8 18.019 11.102 -14.283 1.00 0.00 H new ATOM 0 HA GLN A 8 15.241 10.876 -14.640 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.605 11.225 -16.505 1.00 0.00 H new ATOM 0 HB3 GLN A 8 15.966 11.138 -17.119 1.00 0.00 H new ATOM 0 HG2 GLN A 8 15.316 13.102 -15.827 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.875 13.144 -15.028 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.450 15.202 -15.719 1.00 0.00 H new ATOM 0 HE22 GLN A 8 17.820 15.572 -17.406 1.00 0.00 H new ATOM 83 N GLU A 9 17.033 8.389 -15.879 1.00 0.00 N ATOM 84 CA GLU A 9 16.951 7.016 -16.363 1.00 0.00 C ATOM 85 C GLU A 9 16.652 6.052 -15.218 1.00 0.00 C ATOM 86 O GLU A 9 17.279 6.115 -14.161 1.00 0.00 O ATOM 87 CB GLU A 9 18.257 6.617 -17.053 1.00 0.00 C ATOM 88 CG GLU A 9 18.647 7.537 -18.197 1.00 0.00 C ATOM 89 CD GLU A 9 19.957 7.136 -18.849 1.00 0.00 C ATOM 90 OE1 GLU A 9 20.829 6.589 -18.141 1.00 0.00 O ATOM 91 OE2 GLU A 9 20.109 7.368 -20.066 1.00 0.00 O ATOM 0 H GLU A 9 17.982 8.754 -15.804 1.00 0.00 H new ATOM 0 HA GLU A 9 16.135 6.960 -17.084 1.00 0.00 H new ATOM 0 HB2 GLU A 9 19.060 6.608 -16.316 1.00 0.00 H new ATOM 0 HB3 GLU A 9 18.161 5.600 -17.433 1.00 0.00 H new ATOM 0 HG2 GLU A 9 17.856 7.533 -18.947 1.00 0.00 H new ATOM 0 HG3 GLU A 9 18.728 8.558 -17.825 1.00 0.00 H new ATOM 98 N SER A 10 15.690 5.162 -15.438 1.00 0.00 N ATOM 99 CA SER A 10 15.304 4.188 -14.424 1.00 0.00 C ATOM 100 C SER A 10 15.782 2.790 -14.805 1.00 0.00 C ATOM 101 O SER A 10 15.895 2.459 -15.985 1.00 0.00 O ATOM 102 CB SER A 10 13.786 4.187 -14.239 1.00 0.00 C ATOM 103 OG SER A 10 13.127 3.780 -15.426 1.00 0.00 O ATOM 0 H SER A 10 15.164 5.095 -16.309 1.00 0.00 H new ATOM 0 HA SER A 10 15.777 4.472 -13.484 1.00 0.00 H new ATOM 0 HB2 SER A 10 13.517 3.517 -13.422 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.450 5.185 -13.957 1.00 0.00 H new ATOM 0 HG SER A 10 12.158 3.786 -15.281 1.00 0.00 H new ATOM 109 N VAL A 11 16.062 1.971 -13.795 1.00 0.00 N ATOM 110 CA VAL A 11 16.526 0.608 -14.022 1.00 0.00 C ATOM 111 C VAL A 11 15.418 -0.260 -14.608 1.00 0.00 C ATOM 112 O VAL A 11 15.668 -1.104 -15.468 1.00 0.00 O ATOM 113 CB VAL A 11 17.033 -0.037 -12.718 1.00 0.00 C ATOM 114 CG1 VAL A 11 18.280 0.677 -12.219 1.00 0.00 C ATOM 115 CG2 VAL A 11 15.941 -0.024 -11.659 1.00 0.00 C ATOM 0 H VAL A 11 15.975 2.229 -12.812 1.00 0.00 H new ATOM 0 HA VAL A 11 17.350 0.669 -14.733 1.00 0.00 H new ATOM 0 HB VAL A 11 17.296 -1.075 -12.924 1.00 0.00 H new ATOM 0 HG11 VAL A 11 18.624 0.208 -11.297 1.00 0.00 H new ATOM 0 HG12 VAL A 11 19.064 0.611 -12.974 1.00 0.00 H new ATOM 0 HG13 VAL A 11 18.048 1.725 -12.028 1.00 0.00 H new ATOM 0 HG21 VAL A 11 16.316 -0.483 -10.744 1.00 0.00 H new ATOM 0 HG22 VAL A 11 15.645 1.005 -11.454 1.00 0.00 H new ATOM 0 HG23 VAL A 11 15.078 -0.584 -12.019 1.00 0.00 H new ATOM 125 N GLU A 12 14.194 -0.045 -14.137 1.00 0.00 N ATOM 126 CA GLU A 12 13.047 -0.808 -14.615 1.00 0.00 C ATOM 127 C GLU A 12 13.426 -2.268 -14.852 1.00 0.00 C ATOM 128 O GLU A 12 13.061 -2.857 -15.870 1.00 0.00 O ATOM 129 CB GLU A 12 12.501 -0.196 -15.907 1.00 0.00 C ATOM 130 CG GLU A 12 13.584 0.282 -16.859 1.00 0.00 C ATOM 131 CD GLU A 12 13.028 1.085 -18.019 1.00 0.00 C ATOM 132 OE1 GLU A 12 12.525 2.203 -17.781 1.00 0.00 O ATOM 133 OE2 GLU A 12 13.095 0.595 -19.166 1.00 0.00 O ATOM 0 H GLU A 12 13.971 0.651 -13.425 1.00 0.00 H new ATOM 0 HA GLU A 12 12.273 -0.770 -13.848 1.00 0.00 H new ATOM 0 HB2 GLU A 12 11.882 -0.935 -16.416 1.00 0.00 H new ATOM 0 HB3 GLU A 12 11.853 0.644 -15.656 1.00 0.00 H new ATOM 0 HG2 GLU A 12 14.301 0.892 -16.310 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.128 -0.579 -17.246 1.00 0.00 H new ATOM 140 N ASP A 13 14.160 -2.843 -13.906 1.00 0.00 N ATOM 141 CA ASP A 13 14.588 -4.233 -14.011 1.00 0.00 C ATOM 142 C ASP A 13 14.092 -5.046 -12.819 1.00 0.00 C ATOM 143 O ASP A 13 13.964 -6.268 -12.898 1.00 0.00 O ATOM 144 CB ASP A 13 16.113 -4.314 -14.099 1.00 0.00 C ATOM 145 CG ASP A 13 16.645 -5.676 -13.698 1.00 0.00 C ATOM 146 OD1 ASP A 13 16.921 -5.875 -12.496 1.00 0.00 O ATOM 147 OD2 ASP A 13 16.784 -6.543 -14.585 1.00 0.00 O ATOM 0 H ASP A 13 14.471 -2.369 -13.058 1.00 0.00 H new ATOM 0 HA ASP A 13 14.156 -4.653 -14.920 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.428 -4.090 -15.118 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.552 -3.552 -13.455 1.00 0.00 H new ATOM 152 N SER A 14 13.815 -4.359 -11.715 1.00 0.00 N ATOM 153 CA SER A 14 13.337 -5.018 -10.505 1.00 0.00 C ATOM 154 C SER A 14 12.033 -4.389 -10.023 1.00 0.00 C ATOM 155 O SER A 14 11.858 -4.131 -8.832 1.00 0.00 O ATOM 156 CB SER A 14 14.394 -4.934 -9.402 1.00 0.00 C ATOM 157 OG SER A 14 15.431 -5.876 -9.617 1.00 0.00 O ATOM 0 H SER A 14 13.913 -3.347 -11.634 1.00 0.00 H new ATOM 0 HA SER A 14 13.150 -6.066 -10.741 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.813 -3.928 -9.371 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.929 -5.115 -8.433 1.00 0.00 H new ATOM 0 HG SER A 14 15.779 -5.777 -10.528 1.00 0.00 H new ATOM 163 N LEU A 15 11.120 -4.146 -10.957 1.00 0.00 N ATOM 164 CA LEU A 15 9.831 -3.547 -10.630 1.00 0.00 C ATOM 165 C LEU A 15 8.736 -4.608 -10.577 1.00 0.00 C ATOM 166 O LEU A 15 8.659 -5.479 -11.444 1.00 0.00 O ATOM 167 CB LEU A 15 9.468 -2.475 -11.659 1.00 0.00 C ATOM 168 CG LEU A 15 9.977 -1.063 -11.364 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.818 -0.172 -12.586 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.241 -0.470 -10.170 1.00 0.00 C ATOM 0 H LEU A 15 11.249 -4.355 -11.947 1.00 0.00 H new ATOM 0 HA LEU A 15 9.912 -3.085 -9.646 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.856 -2.785 -12.629 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.382 -2.437 -11.748 1.00 0.00 H new ATOM 0 HG LEU A 15 11.037 -1.123 -11.119 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.185 0.828 -12.357 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.390 -0.587 -13.416 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.765 -0.117 -12.862 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.616 0.535 -9.974 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.174 -0.424 -10.387 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.406 -1.096 -9.293 1.00 0.00 H new ATOM 182 N ALA A 16 7.890 -4.527 -9.556 1.00 0.00 N ATOM 183 CA ALA A 16 6.796 -5.478 -9.393 1.00 0.00 C ATOM 184 C ALA A 16 5.453 -4.760 -9.313 1.00 0.00 C ATOM 185 O ALA A 16 5.287 -3.813 -8.543 1.00 0.00 O ATOM 186 CB ALA A 16 7.017 -6.328 -8.150 1.00 0.00 C ATOM 0 H ALA A 16 7.940 -3.813 -8.829 1.00 0.00 H new ATOM 0 HA ALA A 16 6.779 -6.129 -10.267 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.193 -7.033 -8.040 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.954 -6.876 -8.246 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.062 -5.684 -7.272 1.00 0.00 H new ATOM 192 N THR A 17 4.495 -5.217 -10.115 1.00 0.00 N ATOM 193 CA THR A 17 3.167 -4.618 -10.136 1.00 0.00 C ATOM 194 C THR A 17 2.451 -4.820 -8.806 1.00 0.00 C ATOM 195 O THR A 17 1.928 -5.899 -8.528 1.00 0.00 O ATOM 196 CB THR A 17 2.303 -5.208 -11.266 1.00 0.00 C ATOM 197 OG1 THR A 17 2.999 -5.117 -12.514 1.00 0.00 O ATOM 198 CG2 THR A 17 0.972 -4.478 -11.368 1.00 0.00 C ATOM 0 H THR A 17 4.615 -6.000 -10.758 1.00 0.00 H new ATOM 0 HA THR A 17 3.304 -3.551 -10.313 1.00 0.00 H new ATOM 0 HB THR A 17 2.108 -6.255 -11.034 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.443 -5.496 -13.227 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.379 -4.913 -12.173 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.431 -4.574 -10.427 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.151 -3.423 -11.578 1.00 0.00 H new ATOM 206 N VAL A 18 2.429 -3.774 -7.986 1.00 0.00 N ATOM 207 CA VAL A 18 1.775 -3.836 -6.684 1.00 0.00 C ATOM 208 C VAL A 18 0.442 -3.096 -6.703 1.00 0.00 C ATOM 209 O VAL A 18 0.400 -1.873 -6.840 1.00 0.00 O ATOM 210 CB VAL A 18 2.666 -3.238 -5.579 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.894 -3.126 -4.273 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.922 -4.077 -5.395 1.00 0.00 C ATOM 0 H VAL A 18 2.857 -2.873 -8.200 1.00 0.00 H new ATOM 0 HA VAL A 18 1.599 -4.890 -6.468 1.00 0.00 H new ATOM 0 HB VAL A 18 2.968 -2.235 -5.882 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.539 -2.702 -3.504 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.028 -2.480 -4.417 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.561 -4.116 -3.961 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.540 -3.640 -4.611 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.643 -5.093 -5.114 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.484 -4.100 -6.329 1.00 0.00 H new ATOM 222 N LYS A 19 -0.646 -3.846 -6.564 1.00 0.00 N ATOM 223 CA LYS A 19 -1.982 -3.263 -6.563 1.00 0.00 C ATOM 224 C LYS A 19 -2.368 -2.789 -5.166 1.00 0.00 C ATOM 225 O LYS A 19 -2.087 -3.459 -4.172 1.00 0.00 O ATOM 226 CB LYS A 19 -3.006 -4.281 -7.069 1.00 0.00 C ATOM 227 CG LYS A 19 -2.756 -4.739 -8.496 1.00 0.00 C ATOM 228 CD LYS A 19 -3.846 -5.680 -8.979 1.00 0.00 C ATOM 229 CE LYS A 19 -3.727 -5.951 -10.471 1.00 0.00 C ATOM 230 NZ LYS A 19 -4.162 -4.781 -11.284 1.00 0.00 N ATOM 0 H LYS A 19 -0.628 -4.860 -6.451 1.00 0.00 H new ATOM 0 HA LYS A 19 -1.975 -2.401 -7.231 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.998 -5.150 -6.411 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.002 -3.843 -7.006 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.705 -3.871 -9.154 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.790 -5.240 -8.554 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -3.785 -6.620 -8.431 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.823 -5.248 -8.763 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.693 -6.198 -10.714 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.332 -6.819 -10.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.195 -5.049 -12.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.107 -4.476 -10.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.487 -4.000 -11.157 1.00 0.00 H new ATOM 244 N VAL A 20 -3.016 -1.630 -5.096 1.00 0.00 N ATOM 245 CA VAL A 20 -3.443 -1.068 -3.820 1.00 0.00 C ATOM 246 C VAL A 20 -4.954 -0.874 -3.784 1.00 0.00 C ATOM 247 O VAL A 20 -5.515 -0.127 -4.586 1.00 0.00 O ATOM 248 CB VAL A 20 -2.756 0.282 -3.544 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.344 0.937 -2.303 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.253 0.095 -3.397 1.00 0.00 C ATOM 0 H VAL A 20 -3.257 -1.062 -5.908 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.153 -1.780 -3.047 1.00 0.00 H new ATOM 0 HB VAL A 20 -2.936 0.941 -4.393 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.846 1.890 -2.124 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.410 1.107 -2.452 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.198 0.284 -1.443 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.784 1.059 -3.202 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.050 -0.582 -2.567 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.847 -0.327 -4.316 1.00 0.00 H new ATOM 260 N VAL A 21 -5.610 -1.552 -2.847 1.00 0.00 N ATOM 261 CA VAL A 21 -7.058 -1.453 -2.704 1.00 0.00 C ATOM 262 C VAL A 21 -7.435 -0.778 -1.390 1.00 0.00 C ATOM 263 O VAL A 21 -6.985 -1.185 -0.318 1.00 0.00 O ATOM 264 CB VAL A 21 -7.723 -2.841 -2.765 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.223 -2.724 -2.541 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.426 -3.516 -4.095 1.00 0.00 C ATOM 0 H VAL A 21 -5.162 -2.176 -2.176 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.419 -0.848 -3.536 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.307 -3.459 -1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.676 -3.714 -2.588 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.411 -2.284 -1.562 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.658 -2.089 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.904 -4.495 -4.121 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.813 -2.902 -4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.349 -3.635 -4.210 1.00 0.00 H new ATOM 276 N LEU A 22 -8.264 0.256 -1.480 1.00 0.00 N ATOM 277 CA LEU A 22 -8.704 0.989 -0.298 1.00 0.00 C ATOM 278 C LEU A 22 -9.750 0.195 0.478 1.00 0.00 C ATOM 279 O LEU A 22 -10.762 -0.228 -0.081 1.00 0.00 O ATOM 280 CB LEU A 22 -9.276 2.349 -0.701 1.00 0.00 C ATOM 281 CG LEU A 22 -8.257 3.409 -1.119 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.953 4.591 -1.776 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.442 3.869 0.081 1.00 0.00 C ATOM 0 H LEU A 22 -8.645 0.606 -2.359 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.839 1.142 0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.972 2.198 -1.526 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.854 2.740 0.136 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.578 2.964 -1.846 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -8.211 5.335 -2.066 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.491 4.251 -2.661 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.657 5.036 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.722 4.623 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.108 4.295 0.831 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.912 3.018 0.508 1.00 0.00 H new ATOM 295 N ILE A 23 -9.498 -0.002 1.767 1.00 0.00 N ATOM 296 CA ILE A 23 -10.420 -0.743 2.620 1.00 0.00 C ATOM 297 C ILE A 23 -11.693 0.056 2.878 1.00 0.00 C ATOM 298 O ILE A 23 -12.802 -0.379 2.567 1.00 0.00 O ATOM 299 CB ILE A 23 -9.771 -1.104 3.970 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.093 -2.473 3.884 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.813 -1.091 5.078 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.039 -3.594 3.516 1.00 0.00 C ATOM 0 H ILE A 23 -8.664 0.341 2.244 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.672 -1.662 2.090 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.012 -0.358 4.204 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.292 -2.427 3.146 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.629 -2.700 4.844 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.340 -1.348 6.026 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.255 -0.097 5.151 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.593 -1.819 4.853 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.490 -4.534 3.473 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -10.826 -3.667 4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.484 -3.390 2.542 1.00 0.00 H new ATOM 314 N PRO A 24 -11.532 1.254 3.460 1.00 0.00 N ATOM 315 CA PRO A 24 -12.657 2.140 3.770 1.00 0.00 C ATOM 316 C PRO A 24 -13.297 2.726 2.516 1.00 0.00 C ATOM 317 O PRO A 24 -14.507 2.951 2.472 1.00 0.00 O ATOM 318 CB PRO A 24 -12.015 3.248 4.610 1.00 0.00 C ATOM 319 CG PRO A 24 -10.586 3.260 4.191 1.00 0.00 C ATOM 320 CD PRO A 24 -10.239 1.835 3.858 1.00 0.00 C ATOM 0 HA PRO A 24 -13.463 1.612 4.280 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.490 4.211 4.425 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.113 3.044 5.676 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.438 3.909 3.328 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.949 3.640 4.989 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.507 1.777 3.052 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.811 1.315 4.715 1.00 0.00 H new ATOM 328 N VAL A 25 -12.479 2.970 1.498 1.00 0.00 N ATOM 329 CA VAL A 25 -12.965 3.528 0.242 1.00 0.00 C ATOM 330 C VAL A 25 -13.420 2.426 -0.709 1.00 0.00 C ATOM 331 O VAL A 25 -14.539 2.456 -1.221 1.00 0.00 O ATOM 332 CB VAL A 25 -11.883 4.376 -0.452 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.515 5.339 -1.446 1.00 0.00 C ATOM 334 CG2 VAL A 25 -11.054 5.127 0.578 1.00 0.00 C ATOM 0 H VAL A 25 -11.475 2.790 1.518 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.814 4.166 0.487 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.219 3.709 -1.002 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.735 5.930 -1.927 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -13.061 4.775 -2.202 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.202 6.003 -0.922 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.294 5.721 0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.702 5.785 1.157 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.571 4.414 1.246 1.00 0.00 H new ATOM 344 N GLY A 26 -12.544 1.453 -0.941 1.00 0.00 N ATOM 345 CA GLY A 26 -12.875 0.354 -1.830 1.00 0.00 C ATOM 346 C GLY A 26 -12.311 0.547 -3.223 1.00 0.00 C ATOM 347 O GLY A 26 -12.419 -0.339 -4.071 1.00 0.00 O ATOM 0 H GLY A 26 -11.612 1.406 -0.530 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.491 -0.576 -1.411 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -13.959 0.253 -1.891 1.00 0.00 H new ATOM 351 N GLN A 27 -11.710 1.708 -3.462 1.00 0.00 N ATOM 352 CA GLN A 27 -11.129 2.014 -4.764 1.00 0.00 C ATOM 353 C GLN A 27 -9.798 1.294 -4.949 1.00 0.00 C ATOM 354 O GLN A 27 -9.032 1.133 -4.000 1.00 0.00 O ATOM 355 CB GLN A 27 -10.932 3.524 -4.915 1.00 0.00 C ATOM 356 CG GLN A 27 -10.653 3.960 -6.345 1.00 0.00 C ATOM 357 CD GLN A 27 -10.405 5.451 -6.462 1.00 0.00 C ATOM 358 OE1 GLN A 27 -11.172 6.263 -5.942 1.00 0.00 O ATOM 359 NE2 GLN A 27 -9.328 5.820 -7.146 1.00 0.00 N ATOM 0 H GLN A 27 -11.613 2.452 -2.771 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.819 1.666 -5.533 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.824 4.036 -4.555 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -10.105 3.840 -4.279 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.785 3.420 -6.723 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.498 3.685 -6.976 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.720 5.113 -7.560 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -9.109 6.810 -7.257 1.00 0.00 H new ATOM 368 N GLU A 28 -9.530 0.863 -6.178 1.00 0.00 N ATOM 369 CA GLU A 28 -8.291 0.159 -6.486 1.00 0.00 C ATOM 370 C GLU A 28 -7.333 1.058 -7.264 1.00 0.00 C ATOM 371 O GLU A 28 -7.758 1.869 -8.087 1.00 0.00 O ATOM 372 CB GLU A 28 -8.585 -1.108 -7.291 1.00 0.00 C ATOM 373 CG GLU A 28 -7.338 -1.795 -7.823 1.00 0.00 C ATOM 374 CD GLU A 28 -7.566 -3.263 -8.128 1.00 0.00 C ATOM 375 OE1 GLU A 28 -8.559 -3.578 -8.818 1.00 0.00 O ATOM 376 OE2 GLU A 28 -6.752 -4.096 -7.678 1.00 0.00 O ATOM 0 H GLU A 28 -10.154 0.989 -6.975 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.818 -0.119 -5.544 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.135 -1.808 -6.662 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -9.235 -0.854 -8.128 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.006 -1.287 -8.728 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.535 -1.700 -7.092 1.00 0.00 H new ATOM 383 N ILE A 29 -6.041 0.907 -6.997 1.00 0.00 N ATOM 384 CA ILE A 29 -5.023 1.703 -7.671 1.00 0.00 C ATOM 385 C ILE A 29 -3.826 0.846 -8.066 1.00 0.00 C ATOM 386 O ILE A 29 -3.487 -0.120 -7.381 1.00 0.00 O ATOM 387 CB ILE A 29 -4.539 2.865 -6.784 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.723 3.728 -6.343 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.512 3.706 -7.527 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.345 4.819 -5.366 1.00 0.00 C ATOM 0 H ILE A 29 -5.674 0.240 -6.318 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.486 2.111 -8.570 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.066 2.450 -5.894 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.179 4.182 -7.223 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.478 3.088 -5.886 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.179 4.523 -6.887 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.658 3.084 -7.795 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.962 4.114 -8.432 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.233 5.391 -5.097 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.916 4.372 -4.469 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.613 5.482 -5.826 1.00 0.00 H new ATOM 402 N VAL A 30 -3.186 1.206 -9.174 1.00 0.00 N ATOM 403 CA VAL A 30 -2.023 0.472 -9.658 1.00 0.00 C ATOM 404 C VAL A 30 -0.808 1.385 -9.780 1.00 0.00 C ATOM 405 O VAL A 30 -0.859 2.417 -10.449 1.00 0.00 O ATOM 406 CB VAL A 30 -2.301 -0.179 -11.026 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.059 -0.889 -11.542 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.474 -1.143 -10.929 1.00 0.00 C ATOM 0 H VAL A 30 -3.453 2.002 -9.753 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.815 -0.309 -8.927 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.563 0.606 -11.735 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.275 -1.343 -12.509 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.248 -0.169 -11.652 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.763 -1.664 -10.835 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.656 -1.594 -11.905 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.243 -1.925 -10.205 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.364 -0.602 -10.607 1.00 0.00 H new ATOM 418 N ILE A 31 0.283 0.997 -9.129 1.00 0.00 N ATOM 419 CA ILE A 31 1.512 1.780 -9.165 1.00 0.00 C ATOM 420 C ILE A 31 2.739 0.883 -9.047 1.00 0.00 C ATOM 421 O ILE A 31 2.782 -0.051 -8.246 1.00 0.00 O ATOM 422 CB ILE A 31 1.546 2.828 -8.037 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.816 3.676 -8.137 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.462 2.147 -6.679 1.00 0.00 C ATOM 425 CD1 ILE A 31 3.107 4.478 -6.888 1.00 0.00 C ATOM 0 H ILE A 31 0.341 0.146 -8.570 1.00 0.00 H new ATOM 0 HA ILE A 31 1.531 2.293 -10.127 1.00 0.00 H new ATOM 0 HB ILE A 31 0.684 3.486 -8.146 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.664 3.023 -8.345 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.723 4.357 -8.983 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.487 2.901 -5.892 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.532 1.583 -6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.307 1.469 -6.559 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.021 5.055 -7.031 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.277 5.156 -6.690 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.233 3.802 -6.042 1.00 0.00 H new ATOM 437 N PRO A 32 3.764 1.171 -9.863 1.00 0.00 N ATOM 438 CA PRO A 32 5.013 0.403 -9.868 1.00 0.00 C ATOM 439 C PRO A 32 5.833 0.622 -8.601 1.00 0.00 C ATOM 440 O PRO A 32 5.899 1.734 -8.076 1.00 0.00 O ATOM 441 CB PRO A 32 5.760 0.948 -11.088 1.00 0.00 C ATOM 442 CG PRO A 32 5.221 2.323 -11.279 1.00 0.00 C ATOM 443 CD PRO A 32 3.783 2.269 -10.844 1.00 0.00 C ATOM 0 HA PRO A 32 4.831 -0.671 -9.907 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.837 0.965 -10.918 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.586 0.329 -11.968 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.781 3.047 -10.687 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.302 2.633 -12.321 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.462 3.211 -10.399 1.00 0.00 H new ATOM 0 HD3 PRO A 32 3.117 2.070 -11.683 1.00 0.00 H new ATOM 451 N PHE A 33 6.456 -0.445 -8.113 1.00 0.00 N ATOM 452 CA PHE A 33 7.272 -0.370 -6.907 1.00 0.00 C ATOM 453 C PHE A 33 8.453 -1.331 -6.988 1.00 0.00 C ATOM 454 O PHE A 33 8.379 -2.371 -7.643 1.00 0.00 O ATOM 455 CB PHE A 33 6.425 -0.687 -5.672 1.00 0.00 C ATOM 456 CG PHE A 33 6.988 -0.125 -4.398 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.270 1.227 -4.287 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.235 -0.949 -3.312 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.788 1.747 -3.116 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.752 -0.434 -2.138 1.00 0.00 C ATOM 461 CZ PHE A 33 8.030 0.915 -2.041 1.00 0.00 C ATOM 0 H PHE A 33 6.411 -1.373 -8.534 1.00 0.00 H new ATOM 0 HA PHE A 33 7.659 0.646 -6.823 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.419 -0.293 -5.820 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.332 -1.769 -5.573 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.083 1.882 -5.125 1.00 0.00 H new ATOM 0 HD2 PHE A 33 7.021 -2.005 -3.383 1.00 0.00 H new ATOM 0 HE1 PHE A 33 8.003 2.803 -3.042 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.938 -1.086 -1.297 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.436 1.319 -1.125 1.00 0.00 H new ATOM 471 N LYS A 34 9.544 -0.977 -6.317 1.00 0.00 N ATOM 472 CA LYS A 34 10.743 -1.807 -6.311 1.00 0.00 C ATOM 473 C LYS A 34 10.660 -2.875 -5.225 1.00 0.00 C ATOM 474 O LYS A 34 10.414 -2.570 -4.058 1.00 0.00 O ATOM 475 CB LYS A 34 11.986 -0.941 -6.095 1.00 0.00 C ATOM 476 CG LYS A 34 12.573 -0.388 -7.383 1.00 0.00 C ATOM 477 CD LYS A 34 11.851 0.872 -7.828 1.00 0.00 C ATOM 478 CE LYS A 34 12.749 1.758 -8.678 1.00 0.00 C ATOM 479 NZ LYS A 34 13.585 2.664 -7.842 1.00 0.00 N ATOM 0 H LYS A 34 9.623 -0.120 -5.770 1.00 0.00 H new ATOM 0 HA LYS A 34 10.816 -2.303 -7.279 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.730 -0.111 -5.436 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.746 -1.532 -5.583 1.00 0.00 H new ATOM 0 HG2 LYS A 34 13.631 -0.170 -7.238 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.508 -1.142 -8.167 1.00 0.00 H new ATOM 0 HD2 LYS A 34 10.961 0.601 -8.397 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.513 1.427 -6.953 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.395 1.134 -9.296 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.136 2.352 -9.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.183 3.251 -8.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 12.968 3.277 -7.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.188 2.097 -7.212 1.00 0.00 H new ATOM 493 N VAL A 35 10.867 -4.128 -5.616 1.00 0.00 N ATOM 494 CA VAL A 35 10.818 -5.241 -4.675 1.00 0.00 C ATOM 495 C VAL A 35 11.992 -5.192 -3.704 1.00 0.00 C ATOM 496 O VAL A 35 12.006 -5.897 -2.695 1.00 0.00 O ATOM 497 CB VAL A 35 10.829 -6.596 -5.408 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.652 -6.694 -6.367 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.145 -6.793 -6.144 1.00 0.00 C ATOM 0 H VAL A 35 11.070 -4.398 -6.578 1.00 0.00 H new ATOM 0 HA VAL A 35 9.886 -5.144 -4.119 1.00 0.00 H new ATOM 0 HB VAL A 35 10.731 -7.390 -4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.676 -7.658 -6.876 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.720 -6.601 -5.810 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.715 -5.893 -7.104 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.135 -7.755 -6.656 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.276 -5.995 -6.874 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.968 -6.771 -5.430 1.00 0.00 H new ATOM 509 N ASP A 36 12.975 -4.354 -4.015 1.00 0.00 N ATOM 510 CA ASP A 36 14.154 -4.211 -3.169 1.00 0.00 C ATOM 511 C ASP A 36 14.082 -2.926 -2.349 1.00 0.00 C ATOM 512 O ASP A 36 15.029 -2.570 -1.646 1.00 0.00 O ATOM 513 CB ASP A 36 15.424 -4.216 -4.021 1.00 0.00 C ATOM 514 CG ASP A 36 15.301 -3.335 -5.249 1.00 0.00 C ATOM 515 OD1 ASP A 36 15.268 -2.097 -5.090 1.00 0.00 O ATOM 516 OD2 ASP A 36 15.236 -3.884 -6.369 1.00 0.00 O ATOM 0 H ASP A 36 12.979 -3.764 -4.847 1.00 0.00 H new ATOM 0 HA ASP A 36 14.183 -5.058 -2.483 1.00 0.00 H new ATOM 0 HB2 ASP A 36 16.265 -3.876 -3.416 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.646 -5.237 -4.331 1.00 0.00 H new ATOM 521 N THR A 37 12.952 -2.231 -2.445 1.00 0.00 N ATOM 522 CA THR A 37 12.757 -0.985 -1.715 1.00 0.00 C ATOM 523 C THR A 37 11.775 -1.170 -0.564 1.00 0.00 C ATOM 524 O THR A 37 10.693 -1.730 -0.743 1.00 0.00 O ATOM 525 CB THR A 37 12.241 0.133 -2.641 1.00 0.00 C ATOM 526 OG1 THR A 37 13.252 0.488 -3.591 1.00 0.00 O ATOM 527 CG2 THR A 37 11.841 1.360 -1.836 1.00 0.00 C ATOM 0 H THR A 37 12.158 -2.511 -3.021 1.00 0.00 H new ATOM 0 HA THR A 37 13.729 -0.697 -1.316 1.00 0.00 H new ATOM 0 HB THR A 37 11.362 -0.239 -3.168 1.00 0.00 H new ATOM 0 HG1 THR A 37 12.916 1.198 -4.177 1.00 0.00 H new ATOM 0 HG21 THR A 37 11.480 2.136 -2.511 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.051 1.093 -1.134 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.705 1.731 -1.285 1.00 0.00 H new ATOM 535 N ILE A 38 12.158 -0.696 0.617 1.00 0.00 N ATOM 536 CA ILE A 38 11.310 -0.808 1.796 1.00 0.00 C ATOM 537 C ILE A 38 9.906 -0.282 1.516 1.00 0.00 C ATOM 538 O ILE A 38 9.729 0.678 0.765 1.00 0.00 O ATOM 539 CB ILE A 38 11.904 -0.041 2.992 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.146 1.423 2.618 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.197 -0.697 3.452 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.621 2.272 3.776 1.00 0.00 C ATOM 0 H ILE A 38 13.051 -0.231 0.782 1.00 0.00 H new ATOM 0 HA ILE A 38 11.255 -1.868 2.045 1.00 0.00 H new ATOM 0 HB ILE A 38 11.191 -0.072 3.816 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.885 1.468 1.818 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.222 1.846 2.223 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.605 -0.144 4.298 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.996 -1.725 3.754 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.918 -0.693 2.634 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.772 3.297 3.438 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.873 2.258 4.569 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.561 1.874 4.158 1.00 0.00 H new ATOM 554 N LEU A 39 8.910 -0.915 2.125 1.00 0.00 N ATOM 555 CA LEU A 39 7.521 -0.510 1.944 1.00 0.00 C ATOM 556 C LEU A 39 7.300 0.915 2.439 1.00 0.00 C ATOM 557 O LEU A 39 6.370 1.597 2.007 1.00 0.00 O ATOM 558 CB LEU A 39 6.588 -1.470 2.684 1.00 0.00 C ATOM 559 CG LEU A 39 6.592 -2.920 2.197 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.275 -3.868 3.343 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.598 -3.103 1.060 1.00 0.00 C ATOM 0 H LEU A 39 9.039 -1.712 2.749 1.00 0.00 H new ATOM 0 HA LEU A 39 7.295 -0.543 0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.855 -1.462 3.741 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.571 -1.086 2.610 1.00 0.00 H new ATOM 0 HG LEU A 39 7.588 -3.155 1.823 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.282 -4.895 2.978 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.025 -3.756 4.126 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.290 -3.634 3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.614 -4.140 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.597 -2.849 1.408 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.870 -2.450 0.230 1.00 0.00 H new ATOM 573 N LYS A 40 8.162 1.361 3.346 1.00 0.00 N ATOM 574 CA LYS A 40 8.064 2.707 3.898 1.00 0.00 C ATOM 575 C LYS A 40 7.838 3.734 2.793 1.00 0.00 C ATOM 576 O LYS A 40 6.794 4.386 2.743 1.00 0.00 O ATOM 577 CB LYS A 40 9.335 3.054 4.678 1.00 0.00 C ATOM 578 CG LYS A 40 9.102 4.034 5.815 1.00 0.00 C ATOM 579 CD LYS A 40 9.214 5.473 5.343 1.00 0.00 C ATOM 580 CE LYS A 40 9.664 6.395 6.466 1.00 0.00 C ATOM 581 NZ LYS A 40 10.284 7.644 5.943 1.00 0.00 N ATOM 0 H LYS A 40 8.937 0.810 3.715 1.00 0.00 H new ATOM 0 HA LYS A 40 7.210 2.733 4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.765 2.137 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.069 3.475 3.991 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.114 3.867 6.244 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.828 3.853 6.607 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.922 5.532 4.517 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.250 5.808 4.961 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.809 6.649 7.092 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.380 5.872 7.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.577 8.246 6.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.115 7.404 5.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 9.593 8.156 5.358 1.00 0.00 H new ATOM 595 N TYR A 41 8.820 3.871 1.910 1.00 0.00 N ATOM 596 CA TYR A 41 8.727 4.820 0.806 1.00 0.00 C ATOM 597 C TYR A 41 7.291 4.931 0.302 1.00 0.00 C ATOM 598 O TYR A 41 6.634 5.956 0.487 1.00 0.00 O ATOM 599 CB TYR A 41 9.649 4.394 -0.338 1.00 0.00 C ATOM 600 CG TYR A 41 11.048 4.958 -0.231 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.978 4.403 0.639 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.439 6.047 -1.001 1.00 0.00 C ATOM 603 CE1 TYR A 41 13.256 4.917 0.740 1.00 0.00 C ATOM 604 CE2 TYR A 41 12.716 6.566 -0.908 1.00 0.00 C ATOM 605 CZ TYR A 41 13.621 5.998 -0.035 1.00 0.00 C ATOM 606 OH TYR A 41 14.894 6.511 0.062 1.00 0.00 O ATOM 0 H TYR A 41 9.689 3.338 1.936 1.00 0.00 H new ATOM 0 HA TYR A 41 9.040 5.797 1.173 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.706 3.306 -0.361 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.210 4.711 -1.284 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.697 3.555 1.247 1.00 0.00 H new ATOM 0 HD2 TYR A 41 10.732 6.495 -1.684 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.966 4.474 1.423 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.004 7.411 -1.515 1.00 0.00 H new ATOM 0 HH TYR A 41 14.989 7.269 -0.551 1.00 0.00 H new ATOM 616 N LEU A 42 6.811 3.869 -0.334 1.00 0.00 N ATOM 617 CA LEU A 42 5.452 3.845 -0.865 1.00 0.00 C ATOM 618 C LEU A 42 4.464 4.424 0.143 1.00 0.00 C ATOM 619 O LEU A 42 3.571 5.192 -0.217 1.00 0.00 O ATOM 620 CB LEU A 42 5.049 2.414 -1.226 1.00 0.00 C ATOM 621 CG LEU A 42 3.796 2.267 -2.089 1.00 0.00 C ATOM 622 CD1 LEU A 42 4.044 2.809 -3.488 1.00 0.00 C ATOM 623 CD2 LEU A 42 3.357 0.812 -2.149 1.00 0.00 C ATOM 0 H LEU A 42 7.342 3.013 -0.495 1.00 0.00 H new ATOM 0 HA LEU A 42 5.429 4.460 -1.764 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.882 1.944 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.897 1.857 -0.302 1.00 0.00 H new ATOM 0 HG LEU A 42 2.995 2.849 -1.633 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.141 2.696 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.309 3.864 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.860 2.256 -3.953 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.464 0.727 -2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.156 0.208 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.137 0.457 -1.142 1.00 0.00 H new ATOM 635 N LYS A 43 4.630 4.053 1.408 1.00 0.00 N ATOM 636 CA LYS A 43 3.756 4.538 2.469 1.00 0.00 C ATOM 637 C LYS A 43 3.508 6.036 2.328 1.00 0.00 C ATOM 638 O LYS A 43 2.401 6.463 2.000 1.00 0.00 O ATOM 639 CB LYS A 43 4.369 4.238 3.839 1.00 0.00 C ATOM 640 CG LYS A 43 3.351 4.200 4.966 1.00 0.00 C ATOM 641 CD LYS A 43 3.801 3.286 6.093 1.00 0.00 C ATOM 642 CE LYS A 43 3.347 1.853 5.863 1.00 0.00 C ATOM 643 NZ LYS A 43 3.909 0.923 6.881 1.00 0.00 N ATOM 0 H LYS A 43 5.363 3.417 1.723 1.00 0.00 H new ATOM 0 HA LYS A 43 2.801 4.020 2.384 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.885 3.279 3.795 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.121 4.994 4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.197 5.207 5.353 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.391 3.857 4.579 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.887 3.316 6.175 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.400 3.649 7.039 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.258 1.808 5.892 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.653 1.530 4.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.576 -0.044 6.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.948 0.947 6.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.596 1.216 7.829 1.00 0.00 H new ATOM 657 N ASP A 44 4.544 6.829 2.578 1.00 0.00 N ATOM 658 CA ASP A 44 4.439 8.280 2.476 1.00 0.00 C ATOM 659 C ASP A 44 3.623 8.681 1.251 1.00 0.00 C ATOM 660 O ASP A 44 2.739 9.534 1.333 1.00 0.00 O ATOM 661 CB ASP A 44 5.831 8.910 2.406 1.00 0.00 C ATOM 662 CG ASP A 44 6.828 8.213 3.311 1.00 0.00 C ATOM 663 OD1 ASP A 44 7.110 7.020 3.074 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.326 8.860 4.256 1.00 0.00 O ATOM 0 H ASP A 44 5.466 6.491 2.853 1.00 0.00 H new ATOM 0 HA ASP A 44 3.928 8.646 3.366 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.191 8.875 1.378 1.00 0.00 H new ATOM 0 HB3 ASP A 44 5.765 9.962 2.685 1.00 0.00 H new ATOM 669 N HIS A 45 3.927 8.060 0.115 1.00 0.00 N ATOM 670 CA HIS A 45 3.222 8.353 -1.128 1.00 0.00 C ATOM 671 C HIS A 45 1.748 8.644 -0.862 1.00 0.00 C ATOM 672 O HIS A 45 1.195 9.618 -1.372 1.00 0.00 O ATOM 673 CB HIS A 45 3.355 7.182 -2.102 1.00 0.00 C ATOM 674 CG HIS A 45 3.215 7.579 -3.539 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.258 7.529 -4.439 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.144 8.034 -4.232 1.00 0.00 C ATOM 677 CE1 HIS A 45 3.836 7.937 -5.623 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.557 8.249 -5.524 1.00 0.00 N ATOM 0 H HIS A 45 4.656 7.352 0.030 1.00 0.00 H new ATOM 0 HA HIS A 45 3.674 9.239 -1.573 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.326 6.709 -1.957 1.00 0.00 H new ATOM 0 HB3 HIS A 45 2.598 6.435 -1.865 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.150 8.197 -3.841 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.435 8.004 -6.519 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.971 8.594 -6.284 1.00 0.00 H new ATOM 687 N PHE A 46 1.118 7.792 -0.060 1.00 0.00 N ATOM 688 CA PHE A 46 -0.292 7.957 0.273 1.00 0.00 C ATOM 689 C PHE A 46 -0.459 8.794 1.538 1.00 0.00 C ATOM 690 O PHE A 46 -1.407 9.569 1.662 1.00 0.00 O ATOM 691 CB PHE A 46 -0.957 6.591 0.461 1.00 0.00 C ATOM 692 CG PHE A 46 -1.145 5.834 -0.822 1.00 0.00 C ATOM 693 CD1 PHE A 46 -0.076 5.194 -1.428 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.392 5.764 -1.424 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.247 4.496 -2.609 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.568 5.068 -2.605 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.494 4.434 -3.199 1.00 0.00 C ATOM 0 H PHE A 46 1.561 6.981 0.371 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.775 8.479 -0.553 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -0.352 5.992 1.142 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.928 6.731 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.902 5.241 -0.973 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -3.235 6.259 -0.965 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.594 4.000 -3.070 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.545 5.020 -3.063 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.629 3.891 -4.123 1.00 0.00 H new ATOM 707 N SER A 47 0.470 8.631 2.474 1.00 0.00 N ATOM 708 CA SER A 47 0.425 9.368 3.732 1.00 0.00 C ATOM 709 C SER A 47 0.390 10.873 3.479 1.00 0.00 C ATOM 710 O SER A 47 -0.538 11.563 3.899 1.00 0.00 O ATOM 711 CB SER A 47 1.634 9.014 4.599 1.00 0.00 C ATOM 712 OG SER A 47 2.060 7.683 4.361 1.00 0.00 O ATOM 0 H SER A 47 1.263 7.995 2.386 1.00 0.00 H new ATOM 0 HA SER A 47 -0.486 9.084 4.258 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.451 9.704 4.388 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.378 9.135 5.652 1.00 0.00 H new ATOM 0 HG SER A 47 1.303 7.149 4.041 1.00 0.00 H new ATOM 718 N HIS A 48 1.410 11.374 2.788 1.00 0.00 N ATOM 719 CA HIS A 48 1.497 12.796 2.478 1.00 0.00 C ATOM 720 C HIS A 48 0.317 13.238 1.618 1.00 0.00 C ATOM 721 O HIS A 48 -0.398 14.181 1.962 1.00 0.00 O ATOM 722 CB HIS A 48 2.811 13.104 1.758 1.00 0.00 C ATOM 723 CG HIS A 48 2.702 13.051 0.265 1.00 0.00 C ATOM 724 ND1 HIS A 48 2.489 14.169 -0.513 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.780 12.007 -0.592 1.00 0.00 C ATOM 726 CE1 HIS A 48 2.439 13.814 -1.785 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.613 12.507 -1.860 1.00 0.00 N ATOM 0 H HIS A 48 2.187 10.816 2.433 1.00 0.00 H new ATOM 0 HA HIS A 48 1.467 13.349 3.417 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.154 14.095 2.054 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.570 12.393 2.084 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.943 10.973 -0.328 1.00 0.00 H new ATOM 0 HE1 HIS A 48 2.282 14.480 -2.621 1.00 0.00 H new ATOM 0 HE2 HIS A 48 2.622 11.958 -2.720 1.00 0.00 H new ATOM 736 N LEU A 49 0.118 12.552 0.498 1.00 0.00 N ATOM 737 CA LEU A 49 -0.976 12.874 -0.413 1.00 0.00 C ATOM 738 C LEU A 49 -2.302 12.956 0.337 1.00 0.00 C ATOM 739 O LEU A 49 -2.965 13.994 0.336 1.00 0.00 O ATOM 740 CB LEU A 49 -1.068 11.825 -1.522 1.00 0.00 C ATOM 741 CG LEU A 49 -1.957 12.183 -2.713 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.327 12.641 -2.237 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.300 13.258 -3.565 1.00 0.00 C ATOM 0 H LEU A 49 0.699 11.769 0.198 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.771 13.847 -0.859 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.062 11.627 -1.892 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.436 10.896 -1.086 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.087 11.291 -3.326 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.946 12.892 -3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.801 11.840 -1.670 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.216 13.520 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.947 13.500 -4.408 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.139 14.152 -2.963 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.342 12.893 -3.936 1.00 0.00 H new ATOM 755 N LEU A 50 -2.682 11.856 0.977 1.00 0.00 N ATOM 756 CA LEU A 50 -3.929 11.803 1.733 1.00 0.00 C ATOM 757 C LEU A 50 -3.998 12.938 2.749 1.00 0.00 C ATOM 758 O LEU A 50 -5.076 13.443 3.060 1.00 0.00 O ATOM 759 CB LEU A 50 -4.059 10.456 2.446 1.00 0.00 C ATOM 760 CG LEU A 50 -4.413 9.260 1.562 1.00 0.00 C ATOM 761 CD1 LEU A 50 -4.239 7.958 2.330 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.837 9.386 1.039 1.00 0.00 C ATOM 0 H LEU A 50 -2.145 10.989 0.988 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.756 11.917 1.032 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.117 10.243 2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.822 10.549 3.219 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.733 9.249 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.496 7.118 1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.203 7.863 2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.894 7.959 3.201 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.072 8.526 0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.531 9.423 1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.929 10.300 0.452 1.00 0.00 H new ATOM 774 N GLY A 51 -2.838 13.337 3.263 1.00 0.00 N ATOM 775 CA GLY A 51 -2.789 14.412 4.237 1.00 0.00 C ATOM 776 C GLY A 51 -2.760 13.900 5.664 1.00 0.00 C ATOM 777 O GLY A 51 -2.968 14.663 6.608 1.00 0.00 O ATOM 0 H GLY A 51 -1.932 12.935 3.022 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.905 15.023 4.055 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.656 15.059 4.104 1.00 0.00 H new ATOM 781 N ILE A 52 -2.505 12.606 5.821 1.00 0.00 N ATOM 782 CA ILE A 52 -2.452 11.994 7.143 1.00 0.00 C ATOM 783 C ILE A 52 -1.110 11.309 7.378 1.00 0.00 C ATOM 784 O ILE A 52 -0.475 10.799 6.454 1.00 0.00 O ATOM 785 CB ILE A 52 -3.581 10.964 7.333 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.403 9.795 6.363 1.00 0.00 C ATOM 787 CG2 ILE A 52 -4.938 11.624 7.133 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.557 8.817 6.378 1.00 0.00 C ATOM 0 H ILE A 52 -2.332 11.961 5.050 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.579 12.798 7.868 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.533 10.577 8.351 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.282 10.187 5.353 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.484 9.264 6.611 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.726 10.884 7.270 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.063 12.426 7.860 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.998 12.035 6.125 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.363 8.014 5.666 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.665 8.397 7.378 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.476 9.334 6.100 1.00 0.00 H new ATOM 800 N PRO A 53 -0.667 11.293 8.644 1.00 0.00 N ATOM 801 CA PRO A 53 0.603 10.670 9.030 1.00 0.00 C ATOM 802 C PRO A 53 0.560 9.150 8.923 1.00 0.00 C ATOM 803 O PRO A 53 -0.362 8.508 9.426 1.00 0.00 O ATOM 804 CB PRO A 53 0.778 11.099 10.489 1.00 0.00 C ATOM 805 CG PRO A 53 -0.606 11.355 10.978 1.00 0.00 C ATOM 806 CD PRO A 53 -1.372 11.880 9.795 1.00 0.00 C ATOM 0 HA PRO A 53 1.422 10.977 8.379 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.267 10.320 11.075 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.397 11.993 10.567 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.059 10.441 11.362 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.604 12.078 11.794 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.417 11.573 9.825 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.361 12.969 9.760 1.00 0.00 H new ATOM 814 N HIS A 54 1.563 8.579 8.264 1.00 0.00 N ATOM 815 CA HIS A 54 1.640 7.133 8.091 1.00 0.00 C ATOM 816 C HIS A 54 1.480 6.417 9.429 1.00 0.00 C ATOM 817 O HIS A 54 1.156 5.230 9.474 1.00 0.00 O ATOM 818 CB HIS A 54 2.972 6.745 7.448 1.00 0.00 C ATOM 819 CG HIS A 54 4.160 7.385 8.098 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.481 7.201 9.426 1.00 0.00 N ATOM 821 CD2 HIS A 54 5.107 8.210 7.593 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.574 7.887 9.711 1.00 0.00 C ATOM 823 NE2 HIS A 54 5.974 8.508 8.616 1.00 0.00 N ATOM 0 H HIS A 54 2.334 9.096 7.841 1.00 0.00 H new ATOM 0 HA HIS A 54 0.826 6.826 7.435 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.085 5.662 7.491 1.00 0.00 H new ATOM 0 HB3 HIS A 54 2.952 7.022 6.394 1.00 0.00 H new ATOM 0 HD2 HIS A 54 5.169 8.567 6.576 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.058 7.932 10.675 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.793 9.111 8.542 1.00 0.00 H new ATOM 832 N SER A 55 1.710 7.146 10.516 1.00 0.00 N ATOM 833 CA SER A 55 1.596 6.580 11.855 1.00 0.00 C ATOM 834 C SER A 55 0.234 5.920 12.051 1.00 0.00 C ATOM 835 O SER A 55 0.116 4.907 12.740 1.00 0.00 O ATOM 836 CB SER A 55 1.805 7.667 12.911 1.00 0.00 C ATOM 837 OG SER A 55 2.064 7.098 14.183 1.00 0.00 O ATOM 0 H SER A 55 1.977 8.130 10.496 1.00 0.00 H new ATOM 0 HA SER A 55 2.369 5.820 11.969 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.637 8.307 12.619 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.920 8.301 12.966 1.00 0.00 H new ATOM 0 HG SER A 55 2.196 7.813 14.840 1.00 0.00 H new ATOM 843 N VAL A 56 -0.793 6.503 11.441 1.00 0.00 N ATOM 844 CA VAL A 56 -2.147 5.972 11.546 1.00 0.00 C ATOM 845 C VAL A 56 -2.462 5.035 10.386 1.00 0.00 C ATOM 846 O VAL A 56 -3.329 4.167 10.492 1.00 0.00 O ATOM 847 CB VAL A 56 -3.192 7.103 11.577 1.00 0.00 C ATOM 848 CG1 VAL A 56 -3.092 7.888 12.876 1.00 0.00 C ATOM 849 CG2 VAL A 56 -3.018 8.021 10.376 1.00 0.00 C ATOM 0 H VAL A 56 -0.713 7.344 10.869 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.197 5.415 12.482 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.185 6.657 11.525 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.838 8.683 12.879 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.269 7.220 13.719 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.097 8.324 12.962 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.764 8.815 10.413 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -2.020 8.460 10.395 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.144 7.447 9.458 1.00 0.00 H new ATOM 859 N LEU A 57 -1.752 5.216 9.277 1.00 0.00 N ATOM 860 CA LEU A 57 -1.955 4.386 8.095 1.00 0.00 C ATOM 861 C LEU A 57 -1.018 3.182 8.107 1.00 0.00 C ATOM 862 O LEU A 57 0.179 3.319 8.361 1.00 0.00 O ATOM 863 CB LEU A 57 -1.730 5.209 6.825 1.00 0.00 C ATOM 864 CG LEU A 57 -1.257 4.431 5.596 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.395 3.603 5.019 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.700 5.381 4.546 1.00 0.00 C ATOM 0 H LEU A 57 -1.031 5.930 9.172 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.983 4.023 8.108 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.662 5.714 6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.996 5.985 7.044 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.461 3.753 5.902 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.040 3.056 4.145 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.748 2.897 5.770 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.213 4.262 4.727 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.368 4.810 3.679 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.476 6.084 4.243 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.144 5.930 4.963 1.00 0.00 H new ATOM 878 N GLN A 58 -1.570 2.006 7.829 1.00 0.00 N ATOM 879 CA GLN A 58 -0.783 0.779 7.807 1.00 0.00 C ATOM 880 C GLN A 58 -1.084 -0.039 6.555 1.00 0.00 C ATOM 881 O GLN A 58 -2.013 0.271 5.809 1.00 0.00 O ATOM 882 CB GLN A 58 -1.065 -0.057 9.056 1.00 0.00 C ATOM 883 CG GLN A 58 -0.940 0.727 10.353 1.00 0.00 C ATOM 884 CD GLN A 58 -0.779 -0.171 11.564 1.00 0.00 C ATOM 885 OE1 GLN A 58 0.260 -0.161 12.225 1.00 0.00 O ATOM 886 NE2 GLN A 58 -1.810 -0.954 11.862 1.00 0.00 N ATOM 0 H GLN A 58 -2.559 1.877 7.616 1.00 0.00 H new ATOM 0 HA GLN A 58 0.271 1.055 7.794 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.071 -0.471 8.987 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.375 -0.900 9.083 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.084 1.398 10.286 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.824 1.351 10.483 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -2.652 -0.930 11.287 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.760 -1.579 12.666 1.00 0.00 H new ATOM 895 N ILE A 59 -0.293 -1.083 6.332 1.00 0.00 N ATOM 896 CA ILE A 59 -0.477 -1.945 5.171 1.00 0.00 C ATOM 897 C ILE A 59 -0.527 -3.413 5.579 1.00 0.00 C ATOM 898 O ILE A 59 0.295 -3.877 6.368 1.00 0.00 O ATOM 899 CB ILE A 59 0.651 -1.749 4.140 1.00 0.00 C ATOM 900 CG1 ILE A 59 0.707 -0.289 3.685 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.447 -2.673 2.949 1.00 0.00 C ATOM 902 CD1 ILE A 59 2.003 0.079 2.997 1.00 0.00 C ATOM 0 H ILE A 59 0.481 -1.352 6.939 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.427 -1.664 4.717 1.00 0.00 H new ATOM 0 HB ILE A 59 1.601 -2.000 4.611 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.123 -0.096 3.006 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.568 0.359 4.551 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.252 -2.522 2.230 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.452 -3.709 3.287 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.509 -2.450 2.475 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.973 1.128 2.702 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.836 -0.082 3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.135 -0.544 2.112 1.00 0.00 H new ATOM 914 N ARG A 60 -1.498 -4.140 5.035 1.00 0.00 N ATOM 915 CA ARG A 60 -1.656 -5.556 5.342 1.00 0.00 C ATOM 916 C ARG A 60 -1.508 -6.405 4.083 1.00 0.00 C ATOM 917 O ARG A 60 -2.192 -6.178 3.084 1.00 0.00 O ATOM 918 CB ARG A 60 -3.021 -5.812 5.984 1.00 0.00 C ATOM 919 CG ARG A 60 -3.194 -7.230 6.502 1.00 0.00 C ATOM 920 CD ARG A 60 -4.655 -7.652 6.493 1.00 0.00 C ATOM 921 NE ARG A 60 -5.268 -7.474 5.180 1.00 0.00 N ATOM 922 CZ ARG A 60 -6.524 -7.807 4.903 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.296 -8.332 5.844 1.00 0.00 N ATOM 924 NH2 ARG A 60 -7.010 -7.614 3.684 1.00 0.00 N ATOM 0 H ARG A 60 -2.187 -3.771 4.379 1.00 0.00 H new ATOM 0 HA ARG A 60 -0.872 -5.839 6.045 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.162 -5.113 6.809 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.802 -5.604 5.253 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -2.612 -7.917 5.887 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -2.801 -7.299 7.516 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -4.732 -8.698 6.790 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.205 -7.069 7.232 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.701 -7.072 4.434 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.926 -8.481 6.783 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.260 -8.587 5.629 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.419 -7.209 2.958 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.974 -7.870 3.473 1.00 0.00 H new ATOM 938 N TYR A 61 -0.611 -7.383 4.137 1.00 0.00 N ATOM 939 CA TYR A 61 -0.371 -8.264 3.000 1.00 0.00 C ATOM 940 C TYR A 61 -0.252 -9.717 3.452 1.00 0.00 C ATOM 941 O TYR A 61 0.306 -10.006 4.511 1.00 0.00 O ATOM 942 CB TYR A 61 0.901 -7.843 2.261 1.00 0.00 C ATOM 943 CG TYR A 61 1.400 -8.877 1.277 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.713 -9.130 0.097 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.560 -9.600 1.528 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.165 -10.075 -0.804 1.00 0.00 C ATOM 947 CE2 TYR A 61 3.020 -10.545 0.632 1.00 0.00 C ATOM 948 CZ TYR A 61 2.319 -10.779 -0.532 1.00 0.00 C ATOM 949 OH TYR A 61 2.774 -11.719 -1.428 1.00 0.00 O ATOM 0 H TYR A 61 -0.038 -7.586 4.956 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.221 -8.181 2.323 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.711 -6.910 1.730 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.685 -7.640 2.991 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.190 -8.579 -0.120 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.111 -9.420 2.439 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.618 -10.261 -1.716 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.924 -11.098 0.842 1.00 0.00 H new ATOM 0 HH TYR A 61 3.599 -12.124 -1.087 1.00 0.00 H new ATOM 959 N SER A 62 -0.781 -10.627 2.641 1.00 0.00 N ATOM 960 CA SER A 62 -0.738 -12.050 2.957 1.00 0.00 C ATOM 961 C SER A 62 -1.432 -12.332 4.286 1.00 0.00 C ATOM 962 O SER A 62 -1.085 -13.278 4.992 1.00 0.00 O ATOM 963 CB SER A 62 0.711 -12.538 3.012 1.00 0.00 C ATOM 964 OG SER A 62 1.187 -12.869 1.718 1.00 0.00 O ATOM 0 H SER A 62 -1.244 -10.404 1.760 1.00 0.00 H new ATOM 0 HA SER A 62 -1.266 -12.588 2.170 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.342 -11.764 3.448 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.780 -13.410 3.662 1.00 0.00 H new ATOM 0 HG SER A 62 1.678 -12.107 1.345 1.00 0.00 H new ATOM 970 N GLY A 63 -2.416 -11.503 4.620 1.00 0.00 N ATOM 971 CA GLY A 63 -3.144 -11.679 5.863 1.00 0.00 C ATOM 972 C GLY A 63 -2.298 -11.363 7.081 1.00 0.00 C ATOM 973 O GLY A 63 -2.719 -11.590 8.215 1.00 0.00 O ATOM 0 H GLY A 63 -2.722 -10.713 4.052 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.024 -11.036 5.859 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.501 -12.707 5.929 1.00 0.00 H new ATOM 977 N LYS A 64 -1.099 -10.840 6.846 1.00 0.00 N ATOM 978 CA LYS A 64 -0.190 -10.493 7.932 1.00 0.00 C ATOM 979 C LYS A 64 0.196 -9.019 7.868 1.00 0.00 C ATOM 980 O LYS A 64 0.289 -8.438 6.787 1.00 0.00 O ATOM 981 CB LYS A 64 1.067 -11.364 7.870 1.00 0.00 C ATOM 982 CG LYS A 64 1.970 -11.044 6.691 1.00 0.00 C ATOM 983 CD LYS A 64 3.315 -11.742 6.813 1.00 0.00 C ATOM 984 CE LYS A 64 3.883 -12.099 5.448 1.00 0.00 C ATOM 985 NZ LYS A 64 4.157 -10.887 4.627 1.00 0.00 N ATOM 0 H LYS A 64 -0.734 -10.647 5.913 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.704 -10.675 8.876 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.632 -11.239 8.794 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.771 -12.412 7.817 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.483 -11.350 5.765 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.122 -9.966 6.630 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.015 -11.095 7.342 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.204 -12.647 7.410 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.804 -12.667 5.575 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.181 -12.744 4.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 3.732 -11.003 3.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.746 -10.052 5.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.184 -10.758 4.530 1.00 0.00 H new ATOM 999 N ILE A 65 0.421 -8.420 9.033 1.00 0.00 N ATOM 1000 CA ILE A 65 0.799 -7.014 9.108 1.00 0.00 C ATOM 1001 C ILE A 65 2.282 -6.827 8.806 1.00 0.00 C ATOM 1002 O ILE A 65 3.139 -7.450 9.435 1.00 0.00 O ATOM 1003 CB ILE A 65 0.491 -6.422 10.496 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.921 -6.812 10.939 1.00 0.00 C ATOM 1005 CG2 ILE A 65 0.646 -4.909 10.472 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.998 -5.901 10.393 1.00 0.00 C ATOM 0 H ILE A 65 0.348 -8.886 9.937 1.00 0.00 H new ATOM 0 HA ILE A 65 0.208 -6.488 8.358 1.00 0.00 H new ATOM 0 HB ILE A 65 1.202 -6.829 11.215 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.124 -7.834 10.619 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.967 -6.804 12.028 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.425 -4.505 11.460 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.669 -4.652 10.195 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.044 -4.484 9.743 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.973 -6.237 10.747 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.819 -4.881 10.734 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.979 -5.928 9.303 1.00 0.00 H new ATOM 1018 N LEU A 66 2.579 -5.965 7.841 1.00 0.00 N ATOM 1019 CA LEU A 66 3.960 -5.693 7.455 1.00 0.00 C ATOM 1020 C LEU A 66 4.504 -4.478 8.200 1.00 0.00 C ATOM 1021 O LEU A 66 3.769 -3.791 8.910 1.00 0.00 O ATOM 1022 CB LEU A 66 4.053 -5.464 5.946 1.00 0.00 C ATOM 1023 CG LEU A 66 3.062 -6.249 5.085 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.175 -5.833 3.627 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.293 -7.745 5.235 1.00 0.00 C ATOM 0 H LEU A 66 1.882 -5.442 7.311 1.00 0.00 H new ATOM 0 HA LEU A 66 4.564 -6.560 7.722 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.911 -4.401 5.751 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.063 -5.715 5.622 1.00 0.00 H new ATOM 0 HG LEU A 66 2.053 -6.022 5.428 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.462 -6.402 3.030 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.958 -4.769 3.534 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.186 -6.029 3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.579 -8.287 4.615 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.307 -7.990 4.919 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.159 -8.031 6.278 1.00 0.00 H new ATOM 1037 N LYS A 67 5.796 -4.217 8.031 1.00 0.00 N ATOM 1038 CA LYS A 67 6.439 -3.082 8.683 1.00 0.00 C ATOM 1039 C LYS A 67 6.991 -2.103 7.652 1.00 0.00 C ATOM 1040 O LYS A 67 6.842 -2.306 6.448 1.00 0.00 O ATOM 1041 CB LYS A 67 7.567 -3.566 9.597 1.00 0.00 C ATOM 1042 CG LYS A 67 7.102 -3.930 10.997 1.00 0.00 C ATOM 1043 CD LYS A 67 8.261 -3.962 11.978 1.00 0.00 C ATOM 1044 CE LYS A 67 9.127 -5.197 11.778 1.00 0.00 C ATOM 1045 NZ LYS A 67 9.862 -5.566 13.019 1.00 0.00 N ATOM 0 H LYS A 67 6.419 -4.776 7.448 1.00 0.00 H new ATOM 0 HA LYS A 67 5.689 -2.566 9.282 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.043 -4.436 9.144 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.326 -2.787 9.666 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.359 -3.207 11.334 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.614 -4.904 10.977 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.869 -3.066 11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.876 -3.947 12.998 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.501 -6.033 11.465 1.00 0.00 H new ATOM 0 HE3 LYS A 67 9.840 -5.014 10.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.440 -6.412 12.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.479 -4.779 13.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.181 -5.766 13.779 1.00 0.00 H new ATOM 1059 N ASN A 68 7.628 -1.041 8.133 1.00 0.00 N ATOM 1060 CA ASN A 68 8.203 -0.030 7.253 1.00 0.00 C ATOM 1061 C ASN A 68 9.617 -0.417 6.831 1.00 0.00 C ATOM 1062 O ASN A 68 9.960 -0.363 5.651 1.00 0.00 O ATOM 1063 CB ASN A 68 8.221 1.332 7.949 1.00 0.00 C ATOM 1064 CG ASN A 68 8.500 1.219 9.435 1.00 0.00 C ATOM 1065 OD1 ASN A 68 7.740 0.593 10.174 1.00 0.00 O ATOM 1066 ND2 ASN A 68 9.594 1.825 9.879 1.00 0.00 N ATOM 0 H ASN A 68 7.759 -0.858 9.128 1.00 0.00 H new ATOM 0 HA ASN A 68 7.581 0.034 6.360 1.00 0.00 H new ATOM 0 HB2 ASN A 68 8.980 1.963 7.487 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.261 1.826 7.799 1.00 0.00 H new ATOM 0 HD21 ASN A 68 9.834 1.783 10.869 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.195 2.333 9.230 1.00 0.00 H new ATOM 1073 N ASN A 69 10.433 -0.807 7.805 1.00 0.00 N ATOM 1074 CA ASN A 69 11.811 -1.203 7.535 1.00 0.00 C ATOM 1075 C ASN A 69 11.858 -2.531 6.785 1.00 0.00 C ATOM 1076 O ASN A 69 12.916 -2.955 6.321 1.00 0.00 O ATOM 1077 CB ASN A 69 12.597 -1.315 8.843 1.00 0.00 C ATOM 1078 CG ASN A 69 12.232 -2.558 9.632 1.00 0.00 C ATOM 1079 OD1 ASN A 69 11.233 -2.580 10.350 1.00 0.00 O ATOM 1080 ND2 ASN A 69 13.044 -3.601 9.500 1.00 0.00 N ATOM 0 H ASN A 69 10.164 -0.857 8.788 1.00 0.00 H new ATOM 0 HA ASN A 69 12.267 -0.436 6.909 1.00 0.00 H new ATOM 0 HB2 ASN A 69 13.664 -1.328 8.622 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.409 -0.432 9.454 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.850 -4.465 10.005 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.861 -3.537 8.893 1.00 0.00 H new ATOM 1087 N GLU A 70 10.704 -3.181 6.670 1.00 0.00 N ATOM 1088 CA GLU A 70 10.615 -4.460 5.976 1.00 0.00 C ATOM 1089 C GLU A 70 10.778 -4.275 4.470 1.00 0.00 C ATOM 1090 O GLU A 70 10.720 -3.156 3.960 1.00 0.00 O ATOM 1091 CB GLU A 70 9.275 -5.135 6.275 1.00 0.00 C ATOM 1092 CG GLU A 70 9.306 -6.034 7.500 1.00 0.00 C ATOM 1093 CD GLU A 70 10.239 -7.217 7.332 1.00 0.00 C ATOM 1094 OE1 GLU A 70 11.458 -7.046 7.543 1.00 0.00 O ATOM 1095 OE2 GLU A 70 9.750 -8.314 6.990 1.00 0.00 O ATOM 0 H GLU A 70 9.819 -2.843 7.048 1.00 0.00 H new ATOM 0 HA GLU A 70 11.423 -5.096 6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.515 -4.367 6.418 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.974 -5.725 5.409 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.618 -5.451 8.366 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.299 -6.397 7.705 1.00 0.00 H new ATOM 1102 N THR A 71 10.984 -5.382 3.763 1.00 0.00 N ATOM 1103 CA THR A 71 11.159 -5.343 2.316 1.00 0.00 C ATOM 1104 C THR A 71 10.356 -6.446 1.636 1.00 0.00 C ATOM 1105 O THR A 71 10.175 -7.530 2.193 1.00 0.00 O ATOM 1106 CB THR A 71 12.641 -5.486 1.925 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.460 -4.729 2.822 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.873 -5.013 0.498 1.00 0.00 C ATOM 0 H THR A 71 11.034 -6.316 4.169 1.00 0.00 H new ATOM 0 HA THR A 71 10.795 -4.372 1.979 1.00 0.00 H new ATOM 0 HB THR A 71 12.910 -6.540 1.990 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.401 -4.827 2.567 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.927 -5.124 0.245 1.00 0.00 H new ATOM 0 HG22 THR A 71 12.271 -5.611 -0.186 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.587 -3.965 0.411 1.00 0.00 H new ATOM 1116 N LEU A 72 9.878 -6.165 0.429 1.00 0.00 N ATOM 1117 CA LEU A 72 9.095 -7.135 -0.329 1.00 0.00 C ATOM 1118 C LEU A 72 9.907 -8.396 -0.603 1.00 0.00 C ATOM 1119 O LEU A 72 9.402 -9.512 -0.481 1.00 0.00 O ATOM 1120 CB LEU A 72 8.624 -6.521 -1.648 1.00 0.00 C ATOM 1121 CG LEU A 72 7.557 -5.431 -1.539 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.416 -5.889 -0.644 1.00 0.00 C ATOM 1123 CD2 LEU A 72 8.166 -4.140 -1.011 1.00 0.00 C ATOM 0 H LEU A 72 10.019 -5.273 -0.046 1.00 0.00 H new ATOM 0 HA LEU A 72 8.225 -7.408 0.268 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.490 -6.103 -2.161 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.235 -7.320 -2.279 1.00 0.00 H new ATOM 0 HG LEU A 72 7.157 -5.240 -2.535 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.666 -5.101 -0.578 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.962 -6.787 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.800 -6.108 0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.393 -3.375 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.594 -4.316 -0.024 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.949 -3.802 -1.690 1.00 0.00 H new ATOM 1135 N VAL A 73 11.171 -8.211 -0.972 1.00 0.00 N ATOM 1136 CA VAL A 73 12.055 -9.334 -1.260 1.00 0.00 C ATOM 1137 C VAL A 73 12.319 -10.161 -0.007 1.00 0.00 C ATOM 1138 O VAL A 73 12.533 -11.371 -0.085 1.00 0.00 O ATOM 1139 CB VAL A 73 13.400 -8.854 -1.838 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.224 -8.368 -3.269 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.996 -7.761 -0.964 1.00 0.00 C ATOM 0 H VAL A 73 11.605 -7.294 -1.078 1.00 0.00 H new ATOM 0 HA VAL A 73 11.549 -9.954 -2.001 1.00 0.00 H new ATOM 0 HB VAL A 73 14.092 -9.696 -1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.185 -8.033 -3.660 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.845 -9.183 -3.886 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.516 -7.539 -3.287 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.946 -7.434 -1.387 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.309 -6.916 -0.919 1.00 0.00 H new ATOM 0 HG23 VAL A 73 14.161 -8.149 0.041 1.00 0.00 H new ATOM 1151 N GLN A 74 12.302 -9.501 1.146 1.00 0.00 N ATOM 1152 CA GLN A 74 12.540 -10.176 2.416 1.00 0.00 C ATOM 1153 C GLN A 74 11.348 -11.045 2.802 1.00 0.00 C ATOM 1154 O GLN A 74 11.500 -12.058 3.486 1.00 0.00 O ATOM 1155 CB GLN A 74 12.817 -9.152 3.518 1.00 0.00 C ATOM 1156 CG GLN A 74 14.283 -8.764 3.634 1.00 0.00 C ATOM 1157 CD GLN A 74 14.633 -8.206 4.999 1.00 0.00 C ATOM 1158 OE1 GLN A 74 13.941 -8.464 5.984 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.713 -7.436 5.065 1.00 0.00 N ATOM 0 H GLN A 74 12.126 -8.500 1.227 1.00 0.00 H new ATOM 0 HA GLN A 74 13.413 -10.819 2.299 1.00 0.00 H new ATOM 0 HB2 GLN A 74 12.227 -8.256 3.326 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.480 -9.557 4.472 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.903 -9.638 3.433 1.00 0.00 H new ATOM 0 HG3 GLN A 74 14.520 -8.023 2.871 1.00 0.00 H new ATOM 0 HE21 GLN A 74 16.258 -7.248 4.223 1.00 0.00 H new ATOM 0 HE22 GLN A 74 15.998 -7.032 5.957 1.00 0.00 H new ATOM 1168 N HIS A 75 10.161 -10.644 2.359 1.00 0.00 N ATOM 1169 CA HIS A 75 8.942 -11.387 2.658 1.00 0.00 C ATOM 1170 C HIS A 75 8.754 -12.540 1.677 1.00 0.00 C ATOM 1171 O HIS A 75 8.252 -13.603 2.041 1.00 0.00 O ATOM 1172 CB HIS A 75 7.728 -10.458 2.609 1.00 0.00 C ATOM 1173 CG HIS A 75 7.461 -9.753 3.903 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.778 -10.334 4.950 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.791 -8.507 4.317 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.698 -9.476 5.952 1.00 0.00 C ATOM 1177 NE2 HIS A 75 7.306 -8.359 5.593 1.00 0.00 N ATOM 0 H HIS A 75 10.017 -9.809 1.792 1.00 0.00 H new ATOM 0 HA HIS A 75 9.035 -11.799 3.663 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.880 -9.716 1.825 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.848 -11.038 2.332 1.00 0.00 H new ATOM 0 HD2 HIS A 75 8.335 -7.767 3.749 1.00 0.00 H new ATOM 0 HE1 HIS A 75 6.218 -9.657 6.902 1.00 0.00 H new ATOM 0 HE2 HIS A 75 7.400 -7.523 6.170 1.00 0.00 H new ATOM 1186 N GLY A 76 9.161 -12.322 0.430 1.00 0.00 N ATOM 1187 CA GLY A 76 9.028 -13.352 -0.584 1.00 0.00 C ATOM 1188 C GLY A 76 8.368 -12.839 -1.849 1.00 0.00 C ATOM 1189 O GLY A 76 7.367 -13.391 -2.303 1.00 0.00 O ATOM 0 H GLY A 76 9.580 -11.451 0.104 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.014 -13.748 -0.827 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.443 -14.179 -0.182 1.00 0.00 H new ATOM 1193 N VAL A 77 8.930 -11.778 -2.419 1.00 0.00 N ATOM 1194 CA VAL A 77 8.390 -11.189 -3.638 1.00 0.00 C ATOM 1195 C VAL A 77 9.473 -11.035 -4.700 1.00 0.00 C ATOM 1196 O VAL A 77 10.558 -10.521 -4.427 1.00 0.00 O ATOM 1197 CB VAL A 77 7.755 -9.813 -3.364 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.172 -9.229 -4.642 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.690 -9.924 -2.284 1.00 0.00 C ATOM 0 H VAL A 77 9.760 -11.309 -2.056 1.00 0.00 H new ATOM 0 HA VAL A 77 7.620 -11.869 -4.004 1.00 0.00 H new ATOM 0 HB VAL A 77 8.533 -9.138 -3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.728 -8.257 -4.428 1.00 0.00 H new ATOM 0 HG12 VAL A 77 7.963 -9.112 -5.382 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.407 -9.900 -5.032 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.252 -8.943 -2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.912 -10.614 -2.610 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.142 -10.295 -1.364 1.00 0.00 H new ATOM 1209 N LYS A 78 9.171 -11.482 -5.915 1.00 0.00 N ATOM 1210 CA LYS A 78 10.117 -11.392 -7.021 1.00 0.00 C ATOM 1211 C LYS A 78 9.738 -10.260 -7.970 1.00 0.00 C ATOM 1212 O LYS A 78 8.603 -9.785 -7.986 1.00 0.00 O ATOM 1213 CB LYS A 78 10.166 -12.717 -7.785 1.00 0.00 C ATOM 1214 CG LYS A 78 11.167 -13.709 -7.218 1.00 0.00 C ATOM 1215 CD LYS A 78 12.598 -13.260 -7.464 1.00 0.00 C ATOM 1216 CE LYS A 78 13.593 -14.133 -6.715 1.00 0.00 C ATOM 1217 NZ LYS A 78 13.477 -13.966 -5.240 1.00 0.00 N ATOM 0 H LYS A 78 8.278 -11.910 -6.158 1.00 0.00 H new ATOM 0 HA LYS A 78 11.103 -11.181 -6.607 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.174 -13.169 -7.776 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.416 -12.517 -8.827 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.000 -13.824 -6.147 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.008 -14.687 -7.672 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.813 -13.296 -8.532 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.714 -12.223 -7.150 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.428 -15.178 -6.976 1.00 0.00 H new ATOM 0 HE3 LYS A 78 14.606 -13.882 -7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.325 -14.352 -4.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.388 -12.955 -5.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 12.636 -14.473 -4.898 1.00 0.00 H new ATOM 1231 N PRO A 79 10.711 -9.817 -8.781 1.00 0.00 N ATOM 1232 CA PRO A 79 10.502 -8.737 -9.750 1.00 0.00 C ATOM 1233 C PRO A 79 9.598 -9.158 -10.902 1.00 0.00 C ATOM 1234 O PRO A 79 9.624 -10.310 -11.334 1.00 0.00 O ATOM 1235 CB PRO A 79 11.915 -8.440 -10.259 1.00 0.00 C ATOM 1236 CG PRO A 79 12.666 -9.710 -10.053 1.00 0.00 C ATOM 1237 CD PRO A 79 12.088 -10.337 -8.815 1.00 0.00 C ATOM 0 HA PRO A 79 10.006 -7.877 -9.301 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.905 -8.152 -11.310 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.370 -7.617 -9.707 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.557 -10.371 -10.913 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.732 -9.518 -9.932 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.105 -11.425 -8.870 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.647 -10.054 -7.923 1.00 0.00 H new ATOM 1245 N GLN A 80 8.799 -8.217 -11.396 1.00 0.00 N ATOM 1246 CA GLN A 80 7.886 -8.492 -12.499 1.00 0.00 C ATOM 1247 C GLN A 80 6.798 -9.473 -12.074 1.00 0.00 C ATOM 1248 O GLN A 80 6.571 -10.486 -12.734 1.00 0.00 O ATOM 1249 CB GLN A 80 8.655 -9.053 -13.697 1.00 0.00 C ATOM 1250 CG GLN A 80 9.915 -8.272 -14.031 1.00 0.00 C ATOM 1251 CD GLN A 80 9.662 -7.151 -15.020 1.00 0.00 C ATOM 1252 OE1 GLN A 80 9.296 -6.040 -14.635 1.00 0.00 O ATOM 1253 NE2 GLN A 80 9.857 -7.436 -16.302 1.00 0.00 N ATOM 0 H GLN A 80 8.766 -7.258 -11.050 1.00 0.00 H new ATOM 0 HA GLN A 80 7.411 -7.554 -12.787 1.00 0.00 H new ATOM 0 HB2 GLN A 80 8.923 -10.089 -13.493 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.000 -9.059 -14.568 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.333 -7.855 -13.115 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.661 -8.952 -14.442 1.00 0.00 H new ATOM 0 HE21 GLN A 80 10.161 -8.370 -16.576 1.00 0.00 H new ATOM 0 HE22 GLN A 80 9.703 -6.721 -17.013 1.00 0.00 H new ATOM 1262 N GLU A 81 6.130 -9.164 -10.967 1.00 0.00 N ATOM 1263 CA GLU A 81 5.067 -10.020 -10.453 1.00 0.00 C ATOM 1264 C GLU A 81 3.837 -9.197 -10.082 1.00 0.00 C ATOM 1265 O GLU A 81 3.904 -7.971 -9.986 1.00 0.00 O ATOM 1266 CB GLU A 81 5.557 -10.804 -9.234 1.00 0.00 C ATOM 1267 CG GLU A 81 5.372 -10.063 -7.920 1.00 0.00 C ATOM 1268 CD GLU A 81 5.678 -10.930 -6.714 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.642 -11.720 -6.779 1.00 0.00 O ATOM 1270 OE2 GLU A 81 4.952 -10.817 -5.704 1.00 0.00 O ATOM 0 H GLU A 81 6.306 -8.328 -10.409 1.00 0.00 H new ATOM 0 HA GLU A 81 4.789 -10.722 -11.239 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.024 -11.753 -9.184 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.614 -11.038 -9.364 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.020 -9.187 -7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.346 -9.702 -7.852 1.00 0.00 H new ATOM 1277 N ILE A 82 2.716 -9.879 -9.874 1.00 0.00 N ATOM 1278 CA ILE A 82 1.472 -9.211 -9.513 1.00 0.00 C ATOM 1279 C ILE A 82 1.004 -9.634 -8.124 1.00 0.00 C ATOM 1280 O ILE A 82 0.882 -10.824 -7.834 1.00 0.00 O ATOM 1281 CB ILE A 82 0.356 -9.511 -10.531 1.00 0.00 C ATOM 1282 CG1 ILE A 82 0.765 -9.029 -11.925 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.946 -8.854 -10.099 1.00 0.00 C ATOM 1284 CD1 ILE A 82 -0.056 -9.638 -13.040 1.00 0.00 C ATOM 0 H ILE A 82 2.644 -10.894 -9.949 1.00 0.00 H new ATOM 0 HA ILE A 82 1.677 -8.140 -9.515 1.00 0.00 H new ATOM 0 HB ILE A 82 0.200 -10.589 -10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.672 -7.944 -11.967 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.816 -9.265 -12.088 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.725 -9.075 -10.829 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.242 -9.240 -9.124 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.805 -7.775 -10.035 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.289 -9.251 -13.999 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.056 -10.722 -13.024 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.106 -9.380 -12.901 1.00 0.00 H new ATOM 1296 N VAL A 83 0.742 -8.651 -7.269 1.00 0.00 N ATOM 1297 CA VAL A 83 0.285 -8.921 -5.911 1.00 0.00 C ATOM 1298 C VAL A 83 -0.971 -8.120 -5.585 1.00 0.00 C ATOM 1299 O VAL A 83 -1.482 -7.380 -6.426 1.00 0.00 O ATOM 1300 CB VAL A 83 1.375 -8.589 -4.875 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.690 -9.254 -5.253 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.547 -7.083 -4.747 1.00 0.00 C ATOM 0 H VAL A 83 0.838 -7.660 -7.493 1.00 0.00 H new ATOM 0 HA VAL A 83 0.058 -9.986 -5.859 1.00 0.00 H new ATOM 0 HB VAL A 83 1.063 -8.979 -3.906 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.449 -9.008 -4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.554 -10.335 -5.289 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.011 -8.896 -6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.321 -6.866 -4.011 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.837 -6.667 -5.712 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.606 -6.635 -4.427 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.462 -8.272 -4.360 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.659 -7.562 -3.923 1.00 0.00 C ATOM 1314 C GLN A 84 -2.569 -7.204 -2.443 1.00 0.00 C ATOM 1315 O GLN A 84 -2.543 -8.083 -1.581 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.904 -8.413 -4.180 1.00 0.00 C ATOM 1317 CG GLN A 84 -5.201 -7.730 -3.778 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.416 -8.350 -4.438 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.411 -8.629 -5.637 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.467 -8.569 -3.657 1.00 0.00 N ATOM 0 H GLN A 84 -1.050 -8.880 -3.652 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.734 -6.639 -4.497 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.949 -8.665 -5.239 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.812 -9.351 -3.633 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -5.314 -7.782 -2.695 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.148 -6.674 -4.042 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.428 -8.322 -2.668 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.314 -8.984 -4.046 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.522 -5.907 -2.155 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.436 -5.432 -0.779 1.00 0.00 C ATOM 1331 C VAL A 85 -3.567 -4.461 -0.462 1.00 0.00 C ATOM 1332 O VAL A 85 -4.003 -3.698 -1.324 1.00 0.00 O ATOM 1333 CB VAL A 85 -1.088 -4.740 -0.508 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.067 -5.626 -0.951 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -1.033 -3.389 -1.206 1.00 0.00 C ATOM 0 H VAL A 85 -2.542 -5.167 -2.856 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.522 -6.307 -0.135 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.995 -4.573 0.565 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.011 -5.120 -0.751 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.036 -6.566 -0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.018 -5.828 -2.019 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.073 -2.914 -1.004 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.149 -3.530 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.838 -2.754 -0.834 1.00 0.00 H new ATOM 1345 N GLU A 86 -4.037 -4.494 0.781 1.00 0.00 N ATOM 1346 CA GLU A 86 -5.119 -3.615 1.212 1.00 0.00 C ATOM 1347 C GLU A 86 -4.598 -2.532 2.151 1.00 0.00 C ATOM 1348 O GLU A 86 -3.813 -2.807 3.059 1.00 0.00 O ATOM 1349 CB GLU A 86 -6.216 -4.424 1.907 1.00 0.00 C ATOM 1350 CG GLU A 86 -7.208 -5.056 0.946 1.00 0.00 C ATOM 1351 CD GLU A 86 -6.586 -6.153 0.103 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -6.252 -7.216 0.667 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -6.433 -5.948 -1.119 1.00 0.00 O ATOM 0 H GLU A 86 -3.686 -5.119 1.507 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.537 -3.134 0.328 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.753 -5.208 2.506 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.755 -3.773 2.596 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -8.044 -5.467 1.511 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.615 -4.286 0.291 1.00 0.00 H new ATOM 1360 N ILE A 87 -5.040 -1.299 1.926 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.619 -0.174 2.751 1.00 0.00 C ATOM 1362 C ILE A 87 -5.750 0.295 3.660 1.00 0.00 C ATOM 1363 O ILE A 87 -6.917 0.292 3.267 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.143 1.010 1.889 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.779 0.703 1.269 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.078 2.281 2.724 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.245 1.819 0.399 1.00 0.00 C ATOM 0 H ILE A 87 -5.690 -1.054 1.179 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.787 -0.525 3.362 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.860 1.164 1.083 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.064 0.501 2.066 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.856 -0.206 0.673 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.740 3.109 2.101 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.068 2.506 3.121 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.380 2.139 3.549 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.275 1.532 -0.007 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.940 2.006 -0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.135 2.725 0.996 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.397 0.699 4.875 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.383 1.172 5.840 1.00 0.00 C ATOM 1381 C PHE A 88 -5.707 1.917 6.988 1.00 0.00 C ATOM 1382 O PHE A 88 -4.485 1.874 7.135 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.196 -0.002 6.388 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.402 -0.920 7.273 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -5.946 -0.489 8.509 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -6.112 -2.213 6.870 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.214 -1.331 9.325 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.381 -3.060 7.682 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.933 -2.619 8.911 1.00 0.00 C ATOM 0 H PHE A 88 -4.436 0.709 5.215 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.054 1.862 5.328 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.046 0.386 6.950 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.600 -0.575 5.553 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.165 0.516 8.838 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.461 -2.564 5.910 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.862 -0.983 10.285 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.161 -4.066 7.355 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.364 -3.280 9.548 1.00 0.00 H new ATOM 1399 N SER A 89 -6.510 2.599 7.797 1.00 0.00 N ATOM 1400 CA SER A 89 -5.990 3.357 8.929 1.00 0.00 C ATOM 1401 C SER A 89 -6.476 2.765 10.249 1.00 0.00 C ATOM 1402 O SER A 89 -7.609 2.295 10.353 1.00 0.00 O ATOM 1403 CB SER A 89 -6.417 4.823 8.828 1.00 0.00 C ATOM 1404 OG SER A 89 -5.595 5.650 9.634 1.00 0.00 O ATOM 0 H SER A 89 -7.523 2.643 7.690 1.00 0.00 H new ATOM 0 HA SER A 89 -4.902 3.300 8.903 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.361 5.151 7.790 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.457 4.925 9.139 1.00 0.00 H new ATOM 0 HG SER A 89 -4.893 5.108 10.050 1.00 0.00 H new ATOM 1410 N THR A 90 -5.609 2.791 11.256 1.00 0.00 N ATOM 1411 CA THR A 90 -5.947 2.256 12.569 1.00 0.00 C ATOM 1412 C THR A 90 -6.932 3.164 13.296 1.00 0.00 C ATOM 1413 O THR A 90 -7.782 2.695 14.052 1.00 0.00 O ATOM 1414 CB THR A 90 -4.691 2.077 13.443 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.168 3.356 13.819 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.624 1.285 12.701 1.00 0.00 C ATOM 0 H THR A 90 -4.667 3.177 11.187 1.00 0.00 H new ATOM 0 HA THR A 90 -6.408 1.282 12.404 1.00 0.00 H new ATOM 0 HB THR A 90 -4.975 1.524 14.339 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.371 3.233 14.376 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.747 1.171 13.338 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.015 0.301 12.443 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.345 1.815 11.790 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.812 4.467 13.061 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.694 5.442 13.694 1.00 0.00 C ATOM 1426 C ASN A 91 -8.391 6.305 12.648 1.00 0.00 C ATOM 1427 O ASN A 91 -7.981 7.429 12.360 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.900 6.329 14.656 1.00 0.00 C ATOM 1429 CG ASN A 91 -7.741 6.814 15.821 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -8.917 6.469 15.940 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.140 7.621 16.688 1.00 0.00 N ATOM 0 H ASN A 91 -6.114 4.872 12.438 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.454 4.897 14.255 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.043 5.772 15.036 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.506 7.188 14.113 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.655 7.981 17.492 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.163 7.881 16.550 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.472 5.768 12.063 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.251 6.472 11.040 1.00 0.00 C ATOM 1440 C PRO A 92 -11.027 7.653 11.612 1.00 0.00 C ATOM 1441 O PRO A 92 -11.454 8.543 10.876 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.214 5.399 10.526 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.350 4.439 11.657 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.018 4.432 12.356 1.00 0.00 C ATOM 0 HA PRO A 92 -9.614 6.899 10.266 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.178 5.829 10.254 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.821 4.908 9.635 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.146 4.746 12.336 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.606 3.443 11.295 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.128 4.269 13.428 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.370 3.641 11.978 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.204 7.657 12.929 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.927 8.730 13.601 1.00 0.00 C ATOM 1454 C ASP A 93 -11.102 10.013 13.617 1.00 0.00 C ATOM 1455 O ASP A 93 -11.636 11.110 13.448 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.281 8.319 15.031 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.399 7.296 15.078 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -13.171 6.148 14.642 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -14.501 7.642 15.552 1.00 0.00 O ATOM 0 H ASP A 93 -10.856 6.928 13.552 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.847 8.917 13.047 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.396 7.909 15.518 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.576 9.202 15.598 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.797 9.869 13.822 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.897 11.017 13.862 1.00 0.00 C ATOM 1466 C LEU A 94 -8.318 11.303 12.480 1.00 0.00 C ATOM 1467 O LEU A 94 -8.310 12.446 12.024 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.765 10.768 14.860 1.00 0.00 C ATOM 1469 CG LEU A 94 -8.042 11.184 16.306 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -6.922 10.713 17.220 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -8.213 12.693 16.403 1.00 0.00 C ATOM 0 H LEU A 94 -9.339 8.969 13.963 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.471 11.887 14.183 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.524 9.705 14.848 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.878 11.299 14.514 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.970 10.712 16.629 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.136 11.018 18.244 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.846 9.627 17.173 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.980 11.156 16.899 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.409 12.971 17.438 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.302 13.185 16.062 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.050 13.005 15.779 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.836 10.257 11.818 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.255 10.395 10.488 1.00 0.00 C ATOM 1485 C TYR A 95 -7.885 9.406 9.513 1.00 0.00 C ATOM 1486 O TYR A 95 -7.331 8.347 9.217 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.742 10.178 10.545 1.00 0.00 C ATOM 1488 CG TYR A 95 -5.041 11.063 11.551 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -5.017 10.732 12.900 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.401 12.230 11.152 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.378 11.538 13.822 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.759 13.042 12.067 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.750 12.692 13.401 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.112 13.496 14.316 1.00 0.00 O ATOM 0 H TYR A 95 -7.836 9.304 12.181 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.458 11.406 10.134 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.542 9.135 10.790 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.320 10.360 9.557 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.506 9.829 13.234 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.405 12.507 10.108 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.370 11.266 14.867 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.267 13.946 11.739 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.720 14.268 13.856 1.00 0.00 H new ATOM 1504 N PRO A 96 -9.073 9.759 8.999 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.805 8.918 8.047 1.00 0.00 C ATOM 1506 C PRO A 96 -9.124 8.856 6.685 1.00 0.00 C ATOM 1507 O PRO A 96 -8.449 9.799 6.273 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.165 9.612 7.934 1.00 0.00 C ATOM 1509 CG PRO A 96 -10.894 11.035 8.284 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.792 11.007 9.306 1.00 0.00 C ATOM 0 HA PRO A 96 -9.866 7.882 8.381 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.573 9.523 6.927 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.893 9.169 8.613 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.595 11.603 7.403 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.787 11.515 8.685 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.141 11.877 9.219 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.186 11.004 10.322 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.305 7.738 5.988 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.708 7.553 4.671 1.00 0.00 C ATOM 1520 C VAL A 97 -9.672 7.973 3.567 1.00 0.00 C ATOM 1521 O VAL A 97 -10.860 7.653 3.612 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.293 6.087 4.443 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.383 5.972 3.230 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.613 5.528 5.684 1.00 0.00 C ATOM 0 H VAL A 97 -9.860 6.947 6.314 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.820 8.184 4.635 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.190 5.499 4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.100 4.929 3.085 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.908 6.332 2.345 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.487 6.572 3.389 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.326 4.492 5.506 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.724 6.117 5.908 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.301 5.574 6.528 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.153 8.692 2.577 1.00 0.00 N ATOM 1535 CA ARG A 98 -9.968 9.157 1.462 1.00 0.00 C ATOM 1536 C ARG A 98 -9.480 8.559 0.145 1.00 0.00 C ATOM 1537 O ARG A 98 -8.577 7.723 0.129 1.00 0.00 O ATOM 1538 CB ARG A 98 -9.938 10.685 1.383 1.00 0.00 C ATOM 1539 CG ARG A 98 -10.455 11.370 2.637 1.00 0.00 C ATOM 1540 CD ARG A 98 -10.176 12.864 2.610 1.00 0.00 C ATOM 1541 NE ARG A 98 -10.851 13.566 3.699 1.00 0.00 N ATOM 1542 CZ ARG A 98 -12.143 13.876 3.684 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -12.895 13.547 2.643 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -12.685 14.516 4.712 1.00 0.00 N ATOM 0 H ARG A 98 -8.172 8.965 2.525 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.993 8.829 1.632 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.915 11.011 1.197 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.535 11.008 0.530 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -11.528 11.201 2.730 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -9.985 10.927 3.515 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.102 13.034 2.680 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -10.502 13.277 1.655 1.00 0.00 H new ATOM 0 HE ARG A 98 -10.301 13.833 4.515 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -12.482 13.055 1.851 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -13.887 13.786 2.634 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.110 14.771 5.515 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -13.677 14.753 4.699 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.084 8.994 -0.956 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.712 8.500 -2.276 1.00 0.00 C ATOM 1560 C ARG A 99 -8.710 9.437 -2.944 1.00 0.00 C ATOM 1561 O ARG A 99 -8.680 10.634 -2.660 1.00 0.00 O ATOM 1562 CB ARG A 99 -10.954 8.353 -3.158 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.491 9.676 -3.679 1.00 0.00 C ATOM 1564 CD ARG A 99 -12.535 10.262 -2.741 1.00 0.00 C ATOM 1565 NE ARG A 99 -13.322 11.311 -3.385 1.00 0.00 N ATOM 1566 CZ ARG A 99 -12.939 12.581 -3.451 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -11.785 12.958 -2.917 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -13.710 13.477 -4.054 1.00 0.00 N ATOM 0 H ARG A 99 -10.832 9.687 -0.960 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.245 7.523 -2.152 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -10.714 7.709 -4.004 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.737 7.852 -2.588 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.669 10.382 -3.797 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.929 9.529 -4.666 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.200 9.469 -2.398 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -12.042 10.669 -1.858 1.00 0.00 H new ATOM 0 HE ARG A 99 -14.214 11.054 -3.807 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.189 12.272 -2.454 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -11.494 13.934 -2.969 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -14.597 13.191 -4.467 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -13.415 14.452 -4.104 1.00 0.00 H new ATOM 1582 N ILE A 100 -7.890 8.882 -3.831 1.00 0.00 N ATOM 1583 CA ILE A 100 -6.887 9.668 -4.539 1.00 0.00 C ATOM 1584 C ILE A 100 -7.436 10.199 -5.859 1.00 0.00 C ATOM 1585 O ILE A 100 -7.371 9.524 -6.887 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.619 8.840 -4.819 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -4.952 8.428 -3.505 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.651 9.632 -5.686 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.400 9.595 -2.716 1.00 0.00 C ATOM 0 H ILE A 100 -7.901 7.892 -4.076 1.00 0.00 H new ATOM 0 HA ILE A 100 -6.628 10.507 -3.893 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.904 7.937 -5.358 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.677 7.895 -2.890 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.143 7.730 -3.721 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.760 9.034 -5.876 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.130 9.880 -6.633 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.369 10.550 -5.171 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.942 9.229 -1.797 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.651 10.116 -3.312 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.209 10.282 -2.469 1.00 0.00 H new ATOM 1601 N ASP A 101 -7.975 11.412 -5.824 1.00 0.00 N ATOM 1602 CA ASP A 101 -8.533 12.036 -7.018 1.00 0.00 C ATOM 1603 C ASP A 101 -9.304 11.019 -7.853 1.00 0.00 C ATOM 1604 O ASP A 101 -9.186 10.988 -9.078 1.00 0.00 O ATOM 1605 CB ASP A 101 -7.420 12.665 -7.858 1.00 0.00 C ATOM 1606 CG ASP A 101 -6.503 13.549 -7.036 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -5.844 13.026 -6.113 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -6.445 14.765 -7.315 1.00 0.00 O ATOM 0 H ASP A 101 -8.038 11.983 -4.981 1.00 0.00 H new ATOM 0 HA ASP A 101 -9.224 12.817 -6.701 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.833 11.876 -8.328 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -7.863 13.254 -8.661 1.00 0.00 H new ATOM 1613 N GLY A 102 -10.094 10.186 -7.182 1.00 0.00 N ATOM 1614 CA GLY A 102 -10.871 9.178 -7.878 1.00 0.00 C ATOM 1615 C GLY A 102 -11.843 9.780 -8.874 1.00 0.00 C ATOM 1616 O GLY A 102 -11.798 10.980 -9.148 1.00 0.00 O ATOM 0 H GLY A 102 -10.209 10.192 -6.169 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -10.196 8.499 -8.399 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.423 8.583 -7.151 1.00 0.00 H new ATOM 1620 N LEU A 103 -12.722 8.946 -9.418 1.00 0.00 N ATOM 1621 CA LEU A 103 -13.708 9.403 -10.391 1.00 0.00 C ATOM 1622 C LEU A 103 -15.094 8.860 -10.057 1.00 0.00 C ATOM 1623 O LEU A 103 -15.241 7.708 -9.650 1.00 0.00 O ATOM 1624 CB LEU A 103 -13.303 8.967 -11.800 1.00 0.00 C ATOM 1625 CG LEU A 103 -12.251 9.833 -12.494 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -11.685 9.114 -13.709 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -12.846 11.175 -12.896 1.00 0.00 C ATOM 0 H LEU A 103 -12.772 7.950 -9.202 1.00 0.00 H new ATOM 0 HA LEU A 103 -13.745 10.492 -10.351 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.927 7.945 -11.749 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -14.197 8.947 -12.423 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.437 10.014 -11.792 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.938 9.745 -14.190 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.222 8.179 -13.395 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -12.489 8.902 -14.414 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -12.083 11.778 -13.388 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.679 11.013 -13.580 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -13.203 11.696 -12.007 1.00 0.00 H new ATOM 1639 N THR A 104 -16.111 9.699 -10.235 1.00 0.00 N ATOM 1640 CA THR A 104 -17.485 9.304 -9.954 1.00 0.00 C ATOM 1641 C THR A 104 -18.413 9.687 -11.101 1.00 0.00 C ATOM 1642 O THR A 104 -19.276 8.906 -11.502 1.00 0.00 O ATOM 1643 CB THR A 104 -18.001 9.949 -8.654 1.00 0.00 C ATOM 1644 OG1 THR A 104 -17.935 11.376 -8.756 1.00 0.00 O ATOM 1645 CG2 THR A 104 -17.185 9.483 -7.458 1.00 0.00 C ATOM 0 H THR A 104 -16.008 10.656 -10.572 1.00 0.00 H new ATOM 0 HA THR A 104 -17.484 8.220 -9.837 1.00 0.00 H new ATOM 0 HB THR A 104 -19.037 9.643 -8.508 1.00 0.00 H new ATOM 0 HG1 THR A 104 -18.266 11.779 -7.926 1.00 0.00 H new ATOM 0 HG21 THR A 104 -17.568 9.952 -6.551 1.00 0.00 H new ATOM 0 HG22 THR A 104 -17.260 8.400 -7.366 1.00 0.00 H new ATOM 0 HG23 THR A 104 -16.141 9.763 -7.598 1.00 0.00 H new ATOM 1653 N ASP A 105 -18.229 10.894 -11.626 1.00 0.00 N ATOM 1654 CA ASP A 105 -19.049 11.381 -12.729 1.00 0.00 C ATOM 1655 C ASP A 105 -18.935 10.458 -13.939 1.00 0.00 C ATOM 1656 O ASP A 105 -17.861 9.933 -14.234 1.00 0.00 O ATOM 1657 CB ASP A 105 -18.633 12.801 -13.114 1.00 0.00 C ATOM 1658 CG ASP A 105 -18.299 13.654 -11.906 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -18.980 13.507 -10.869 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -17.356 14.467 -11.997 1.00 0.00 O ATOM 0 H ASP A 105 -17.519 11.553 -11.305 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.088 11.392 -12.400 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -17.767 12.756 -13.774 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -19.439 13.273 -13.677 1.00 0.00 H new ATOM 1665 N VAL A 106 -20.050 10.264 -14.636 1.00 0.00 N ATOM 1666 CA VAL A 106 -20.076 9.406 -15.814 1.00 0.00 C ATOM 1667 C VAL A 106 -20.816 10.075 -16.966 1.00 0.00 C ATOM 1668 O VAL A 106 -21.763 10.832 -16.753 1.00 0.00 O ATOM 1669 CB VAL A 106 -20.744 8.052 -15.507 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -22.205 8.249 -15.136 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -20.609 7.111 -16.695 1.00 0.00 C ATOM 0 H VAL A 106 -20.948 10.690 -14.405 1.00 0.00 H new ATOM 0 HA VAL A 106 -19.039 9.235 -16.103 1.00 0.00 H new ATOM 0 HB VAL A 106 -20.236 7.601 -14.655 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -22.660 7.282 -14.923 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -22.274 8.885 -14.253 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -22.730 8.722 -15.966 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -21.086 6.159 -16.461 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -21.091 7.554 -17.567 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -19.553 6.945 -16.909 1.00 0.00 H new ATOM 1681 N SER A 107 -20.378 9.791 -18.189 1.00 0.00 N ATOM 1682 CA SER A 107 -20.997 10.369 -19.376 1.00 0.00 C ATOM 1683 C SER A 107 -22.053 9.429 -19.950 1.00 0.00 C ATOM 1684 O SER A 107 -23.204 9.819 -20.147 1.00 0.00 O ATOM 1685 CB SER A 107 -19.935 10.668 -20.436 1.00 0.00 C ATOM 1686 OG SER A 107 -20.459 11.488 -21.466 1.00 0.00 O ATOM 0 H SER A 107 -19.597 9.164 -18.383 1.00 0.00 H new ATOM 0 HA SER A 107 -21.483 11.300 -19.085 1.00 0.00 H new ATOM 0 HB2 SER A 107 -19.082 11.163 -19.971 1.00 0.00 H new ATOM 0 HB3 SER A 107 -19.568 9.734 -20.862 1.00 0.00 H new ATOM 0 HG SER A 107 -19.760 11.666 -22.130 1.00 0.00 H new ATOM 1692 N GLN A 108 -21.653 8.190 -20.215 1.00 0.00 N ATOM 1693 CA GLN A 108 -22.564 7.195 -20.766 1.00 0.00 C ATOM 1694 C GLN A 108 -22.271 5.812 -20.194 1.00 0.00 C ATOM 1695 O GLN A 108 -21.140 5.329 -20.262 1.00 0.00 O ATOM 1696 CB GLN A 108 -22.456 7.162 -22.292 1.00 0.00 C ATOM 1697 CG GLN A 108 -22.957 8.430 -22.964 1.00 0.00 C ATOM 1698 CD GLN A 108 -23.097 8.278 -24.466 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -23.550 7.243 -24.957 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -22.710 9.311 -25.205 1.00 0.00 N ATOM 0 H GLN A 108 -20.704 7.851 -20.057 1.00 0.00 H new ATOM 0 HA GLN A 108 -23.579 7.476 -20.487 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -21.415 7.000 -22.571 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -23.024 6.312 -22.670 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -23.922 8.705 -22.539 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -22.269 9.247 -22.748 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -22.340 10.149 -24.756 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -22.782 9.266 -26.221 1.00 0.00 H new ATOM 1709 N ILE A 109 -23.296 5.180 -19.632 1.00 0.00 N ATOM 1710 CA ILE A 109 -23.147 3.852 -19.049 1.00 0.00 C ATOM 1711 C ILE A 109 -24.414 3.025 -19.236 1.00 0.00 C ATOM 1712 O ILE A 109 -25.494 3.415 -18.791 1.00 0.00 O ATOM 1713 CB ILE A 109 -22.816 3.930 -17.547 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -23.021 2.566 -16.886 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -23.675 4.988 -16.870 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -22.223 2.385 -15.613 1.00 0.00 C ATOM 0 H ILE A 109 -24.238 5.566 -19.568 1.00 0.00 H new ATOM 0 HA ILE A 109 -22.320 3.370 -19.570 1.00 0.00 H new ATOM 0 HB ILE A 109 -21.769 4.213 -17.434 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -24.080 2.435 -16.663 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -22.745 1.784 -17.593 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -23.430 5.031 -15.809 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -23.484 5.959 -17.327 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -24.728 4.732 -16.989 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -22.418 1.396 -15.199 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -21.160 2.484 -15.833 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -22.516 3.145 -14.889 1.00 0.00 H new ATOM 1728 N ILE A 110 -24.274 1.880 -19.897 1.00 0.00 N ATOM 1729 CA ILE A 110 -25.407 0.996 -20.140 1.00 0.00 C ATOM 1730 C ILE A 110 -24.940 -0.410 -20.503 1.00 0.00 C ATOM 1731 O ILE A 110 -23.830 -0.598 -21.003 1.00 0.00 O ATOM 1732 CB ILE A 110 -26.308 1.532 -21.268 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -27.543 0.644 -21.431 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -25.531 1.612 -22.574 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -28.752 1.381 -21.962 1.00 0.00 C ATOM 0 H ILE A 110 -23.388 1.543 -20.273 1.00 0.00 H new ATOM 0 HA ILE A 110 -25.981 0.958 -19.214 1.00 0.00 H new ATOM 0 HB ILE A 110 -26.639 2.536 -21.002 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -27.303 -0.177 -22.106 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -27.792 0.202 -20.466 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -26.181 1.993 -23.362 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -24.680 2.282 -22.451 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -25.174 0.619 -22.846 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -29.589 0.689 -22.052 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -29.018 2.185 -21.276 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -28.521 1.800 -22.941 1.00 0.00 H new ATOM 1747 N THR A 111 -25.795 -1.396 -20.249 1.00 0.00 N ATOM 1748 CA THR A 111 -25.471 -2.784 -20.549 1.00 0.00 C ATOM 1749 C THR A 111 -26.181 -3.254 -21.814 1.00 0.00 C ATOM 1750 O THR A 111 -27.316 -2.860 -22.084 1.00 0.00 O ATOM 1751 CB THR A 111 -25.854 -3.715 -19.383 1.00 0.00 C ATOM 1752 OG1 THR A 111 -25.205 -3.287 -18.181 1.00 0.00 O ATOM 1753 CG2 THR A 111 -25.466 -5.154 -19.690 1.00 0.00 C ATOM 0 H THR A 111 -26.717 -1.258 -19.836 1.00 0.00 H new ATOM 0 HA THR A 111 -24.393 -2.830 -20.702 1.00 0.00 H new ATOM 0 HB THR A 111 -26.935 -3.667 -19.249 1.00 0.00 H new ATOM 0 HG1 THR A 111 -25.455 -3.883 -17.444 1.00 0.00 H new ATOM 0 HG21 THR A 111 -25.746 -5.793 -18.853 1.00 0.00 H new ATOM 0 HG22 THR A 111 -25.984 -5.487 -20.589 1.00 0.00 H new ATOM 0 HG23 THR A 111 -24.389 -5.215 -19.848 1.00 0.00 H new ATOM 1761 N VAL A 112 -25.506 -4.099 -22.587 1.00 0.00 N ATOM 1762 CA VAL A 112 -26.074 -4.625 -23.823 1.00 0.00 C ATOM 1763 C VAL A 112 -26.550 -6.062 -23.642 1.00 0.00 C ATOM 1764 O VAL A 112 -25.848 -6.890 -23.061 1.00 0.00 O ATOM 1765 CB VAL A 112 -25.053 -4.574 -24.975 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -25.704 -4.996 -26.284 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -24.452 -3.182 -25.093 1.00 0.00 C ATOM 0 H VAL A 112 -24.565 -4.434 -22.379 1.00 0.00 H new ATOM 0 HA VAL A 112 -26.926 -3.993 -24.074 1.00 0.00 H new ATOM 0 HB VAL A 112 -24.247 -5.275 -24.755 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -24.968 -4.954 -27.087 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -26.081 -6.014 -26.191 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -26.530 -4.323 -26.513 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -23.733 -3.164 -25.912 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -25.244 -2.459 -25.290 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -23.948 -2.923 -24.162 1.00 0.00 H new ATOM 1777 N SER A 113 -27.746 -6.351 -24.143 1.00 0.00 N ATOM 1778 CA SER A 113 -28.318 -7.688 -24.035 1.00 0.00 C ATOM 1779 C SER A 113 -27.360 -8.735 -24.595 1.00 0.00 C ATOM 1780 O SER A 113 -26.415 -8.409 -25.311 1.00 0.00 O ATOM 1781 CB SER A 113 -29.655 -7.755 -24.774 1.00 0.00 C ATOM 1782 OG SER A 113 -29.523 -7.301 -26.110 1.00 0.00 O ATOM 0 H SER A 113 -28.338 -5.677 -24.628 1.00 0.00 H new ATOM 0 HA SER A 113 -28.485 -7.901 -22.979 1.00 0.00 H new ATOM 0 HB2 SER A 113 -30.025 -8.780 -24.770 1.00 0.00 H new ATOM 0 HB3 SER A 113 -30.394 -7.147 -24.251 1.00 0.00 H new ATOM 0 HG SER A 113 -30.391 -7.355 -26.561 1.00 0.00 H new ATOM 1788 N GLY A 114 -27.614 -9.998 -24.262 1.00 0.00 N ATOM 1789 CA GLY A 114 -26.766 -11.075 -24.740 1.00 0.00 C ATOM 1790 C GLY A 114 -27.560 -12.199 -25.376 1.00 0.00 C ATOM 1791 O GLY A 114 -28.766 -12.087 -25.599 1.00 0.00 O ATOM 0 H GLY A 114 -28.391 -10.294 -23.671 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -26.056 -10.679 -25.466 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -26.183 -11.471 -23.908 1.00 0.00 H new ATOM 1795 N PRO A 115 -26.878 -13.313 -25.679 1.00 0.00 N ATOM 1796 CA PRO A 115 -27.507 -14.483 -26.298 1.00 0.00 C ATOM 1797 C PRO A 115 -28.453 -15.205 -25.344 1.00 0.00 C ATOM 1798 O PRO A 115 -28.763 -14.703 -24.264 1.00 0.00 O ATOM 1799 CB PRO A 115 -26.318 -15.380 -26.652 1.00 0.00 C ATOM 1800 CG PRO A 115 -25.248 -14.986 -25.693 1.00 0.00 C ATOM 1801 CD PRO A 115 -25.439 -13.516 -25.440 1.00 0.00 C ATOM 0 HA PRO A 115 -28.122 -14.209 -27.155 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -26.573 -16.435 -26.549 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -26.001 -15.228 -27.684 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -25.326 -15.555 -24.766 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -24.260 -15.185 -26.107 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -25.158 -13.244 -24.423 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -24.831 -12.910 -26.112 1.00 0.00 H new ATOM 1809 N SER A 116 -28.908 -16.386 -25.750 1.00 0.00 N ATOM 1810 CA SER A 116 -29.821 -17.176 -24.933 1.00 0.00 C ATOM 1811 C SER A 116 -29.545 -18.667 -25.096 1.00 0.00 C ATOM 1812 O SER A 116 -28.670 -19.067 -25.864 1.00 0.00 O ATOM 1813 CB SER A 116 -31.272 -16.870 -25.311 1.00 0.00 C ATOM 1814 OG SER A 116 -31.549 -17.277 -26.640 1.00 0.00 O ATOM 0 H SER A 116 -28.659 -16.817 -26.640 1.00 0.00 H new ATOM 0 HA SER A 116 -29.660 -16.907 -23.889 1.00 0.00 H new ATOM 0 HB2 SER A 116 -31.946 -17.381 -24.623 1.00 0.00 H new ATOM 0 HB3 SER A 116 -31.461 -15.801 -25.208 1.00 0.00 H new ATOM 0 HG SER A 116 -32.483 -17.072 -26.857 1.00 0.00 H new ATOM 1820 N SER A 117 -30.298 -19.485 -24.367 1.00 0.00 N ATOM 1821 CA SER A 117 -30.133 -20.933 -24.427 1.00 0.00 C ATOM 1822 C SER A 117 -31.476 -21.624 -24.640 1.00 0.00 C ATOM 1823 O SER A 117 -32.519 -20.975 -24.696 1.00 0.00 O ATOM 1824 CB SER A 117 -29.480 -21.446 -23.143 1.00 0.00 C ATOM 1825 OG SER A 117 -28.082 -21.212 -23.152 1.00 0.00 O ATOM 0 H SER A 117 -31.028 -19.170 -23.728 1.00 0.00 H new ATOM 0 HA SER A 117 -29.486 -21.166 -25.273 1.00 0.00 H new ATOM 0 HB2 SER A 117 -29.929 -20.952 -22.281 1.00 0.00 H new ATOM 0 HB3 SER A 117 -29.672 -22.513 -23.035 1.00 0.00 H new ATOM 0 HG SER A 117 -27.689 -21.548 -22.319 1.00 0.00 H new ATOM 1831 N GLY A 118 -31.441 -22.948 -24.759 1.00 0.00 N ATOM 1832 CA GLY A 118 -32.660 -23.707 -24.965 1.00 0.00 C ATOM 1833 C GLY A 118 -32.565 -24.647 -26.150 1.00 0.00 C ATOM 1834 O GLY A 118 -33.579 -25.147 -26.637 1.00 0.00 O ATOM 0 H GLY A 118 -30.590 -23.508 -24.716 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -32.882 -24.282 -24.066 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -33.491 -23.019 -25.117 1.00 0.00 H new TER 1838 GLY A 118