USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1106 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 47 TYR OH : rot 15:sc= 0.998 USER MOD Set 1.2: A 98 LYS NZ :NH3+ 150:sc= 0.956 (180deg=-0.241) USER MOD Set 2.1: A 16 THR OG1 : rot 180:sc= 0.622 USER MOD Set 2.2: A 128 THR OG1 : rot -107:sc= -0.439 USER MOD Single : A 1 GLY N :NH3+ -128:sc= 0.0159 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 140:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0441 X(o=-0.044,f=-0.24) USER MOD Single : A 14 GLN :FLIP amide:sc= -0.44 F(o=-1.2,f=-0.44) USER MOD Single : A 19 HIS : no HD1:sc= -0.751 K(o=-0.75,f=-6.4!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.308 USER MOD Single : A 21 SER OG : rot 180:sc= 0.0781 USER MOD Single : A 22 GLN : amide:sc= -0.233 X(o=-0.23,f=-0.45) USER MOD Single : A 24 ASN : amide:sc= -0.317 K(o=-0.32,f=-2.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 HIS : no HD1:sc=-0.00427 X(o=-0.0043,f=-0.0043) USER MOD Single : A 33 CYS SG : rot 170:sc= -2.27! USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 40 SER OG : rot -147:sc= 0.26 USER MOD Single : A 44 SER OG : rot -170:sc= -0.811 USER MOD Single : A 50 MET CE :methyl -148:sc= -1.59 (180deg=-2.96!) USER MOD Single : A 51 TYR OH : rot 165:sc= -1.2 USER MOD Single : A 56 LYS NZ :NH3+ 156:sc= -0.108 (180deg=-0.506) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -123:sc= 0.0573 (180deg=-0.366) USER MOD Single : A 64 THR OG1 : rot 132:sc= 1.76 USER MOD Single : A 65 HIS : no HD1:sc= -0.0164 X(o=-0.016,f=-0.016) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 166:sc= -0.0108 (180deg=-0.182) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.562 K(o=-0.56,f=-3.5!) USER MOD Single : A 77 GLN : amide:sc= -0.0179 X(o=-0.018,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 48:sc= 0.47 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN :FLIP amide:sc=-0.00313 F(o=-0.68,f=-0.0031) USER MOD Single : A 92 THR OG1 : rot 6:sc= 0.44 USER MOD Single : A 99 ASN : amide:sc= -2.76! C(o=-2.8!,f=-3.3!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.023) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 167:sc= -0.14 USER MOD Single : A 125 LYS NZ :NH3+ -161:sc= -0.0202 (180deg=-0.166) USER MOD Single : A 129 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.24) USER MOD Single : A 131 TYR OH : rot 150:sc= 0.801 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.622 -2.706 -6.247 1.00 0.00 N ATOM 2 CA GLY A 1 19.798 -2.428 -4.834 1.00 0.00 C ATOM 3 C GLY A 1 18.718 -1.516 -4.284 1.00 0.00 C ATOM 4 O GLY A 1 17.574 -1.555 -4.737 1.00 0.00 O ATOM 0 H1 GLY A 1 19.644 -3.734 -6.404 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.707 -2.327 -6.564 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.389 -2.257 -6.787 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.795 -3.366 -4.279 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.773 -1.968 -4.676 1.00 0.00 H new ATOM 8 N SER A 2 19.082 -0.695 -3.304 1.00 0.00 N ATOM 9 CA SER A 2 18.135 0.226 -2.688 1.00 0.00 C ATOM 10 C SER A 2 18.696 1.644 -2.659 1.00 0.00 C ATOM 11 O SER A 2 19.247 2.086 -1.651 1.00 0.00 O ATOM 12 CB SER A 2 17.798 -0.230 -1.267 1.00 0.00 C ATOM 13 OG SER A 2 16.750 -1.184 -1.272 1.00 0.00 O ATOM 0 H SER A 2 20.026 -0.649 -2.920 1.00 0.00 H new ATOM 0 HA SER A 2 17.225 0.226 -3.288 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.684 -0.661 -0.800 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.507 0.631 -0.665 1.00 0.00 H new ATOM 0 HG SER A 2 16.555 -1.461 -0.352 1.00 0.00 H new ATOM 19 N SER A 3 18.553 2.353 -3.775 1.00 0.00 N ATOM 20 CA SER A 3 19.049 3.720 -3.880 1.00 0.00 C ATOM 21 C SER A 3 18.625 4.547 -2.670 1.00 0.00 C ATOM 22 O SER A 3 17.436 4.711 -2.401 1.00 0.00 O ATOM 23 CB SER A 3 18.534 4.374 -5.164 1.00 0.00 C ATOM 24 OG SER A 3 19.102 3.764 -6.310 1.00 0.00 O ATOM 0 H SER A 3 18.098 2.003 -4.618 1.00 0.00 H new ATOM 0 HA SER A 3 20.138 3.684 -3.910 1.00 0.00 H new ATOM 0 HB2 SER A 3 17.448 4.294 -5.206 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.775 5.437 -5.157 1.00 0.00 H new ATOM 0 HG SER A 3 18.756 4.198 -7.117 1.00 0.00 H new ATOM 30 N GLY A 4 19.609 5.066 -1.942 1.00 0.00 N ATOM 31 CA GLY A 4 19.320 5.870 -0.769 1.00 0.00 C ATOM 32 C GLY A 4 18.101 6.751 -0.956 1.00 0.00 C ATOM 33 O GLY A 4 17.917 7.351 -2.015 1.00 0.00 O ATOM 0 H GLY A 4 20.601 4.944 -2.144 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.163 5.214 0.087 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.183 6.494 -0.538 1.00 0.00 H new ATOM 37 N SER A 5 17.265 6.830 0.075 1.00 0.00 N ATOM 38 CA SER A 5 16.055 7.641 0.017 1.00 0.00 C ATOM 39 C SER A 5 16.398 9.123 -0.099 1.00 0.00 C ATOM 40 O SER A 5 15.885 9.824 -0.970 1.00 0.00 O ATOM 41 CB SER A 5 15.195 7.400 1.259 1.00 0.00 C ATOM 42 OG SER A 5 14.058 8.247 1.264 1.00 0.00 O ATOM 0 H SER A 5 17.404 6.342 0.960 1.00 0.00 H new ATOM 0 HA SER A 5 15.492 7.347 -0.869 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.876 6.358 1.288 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.788 7.577 2.156 1.00 0.00 H new ATOM 0 HG SER A 5 13.524 8.073 2.067 1.00 0.00 H new ATOM 48 N SER A 6 17.271 9.592 0.787 1.00 0.00 N ATOM 49 CA SER A 6 17.681 10.991 0.788 1.00 0.00 C ATOM 50 C SER A 6 16.466 11.914 0.774 1.00 0.00 C ATOM 51 O SER A 6 16.364 12.812 -0.060 1.00 0.00 O ATOM 52 CB SER A 6 18.572 11.284 -0.420 1.00 0.00 C ATOM 53 OG SER A 6 19.487 12.330 -0.138 1.00 0.00 O ATOM 0 H SER A 6 17.708 9.024 1.513 1.00 0.00 H new ATOM 0 HA SER A 6 18.246 11.177 1.701 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.119 10.384 -0.699 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.953 11.559 -1.274 1.00 0.00 H new ATOM 0 HG SER A 6 20.046 12.497 -0.926 1.00 0.00 H new ATOM 59 N GLY A 7 15.545 11.684 1.706 1.00 0.00 N ATOM 60 CA GLY A 7 14.349 12.502 1.784 1.00 0.00 C ATOM 61 C GLY A 7 13.386 12.230 0.645 1.00 0.00 C ATOM 62 O GLY A 7 13.804 11.920 -0.470 1.00 0.00 O ATOM 0 H GLY A 7 15.606 10.946 2.408 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.846 12.316 2.733 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.631 13.555 1.774 1.00 0.00 H new ATOM 66 N SER A 8 12.092 12.344 0.927 1.00 0.00 N ATOM 67 CA SER A 8 11.066 12.102 -0.081 1.00 0.00 C ATOM 68 C SER A 8 10.437 13.414 -0.541 1.00 0.00 C ATOM 69 O SER A 8 9.428 13.871 -0.004 1.00 0.00 O ATOM 70 CB SER A 8 9.985 11.173 0.474 1.00 0.00 C ATOM 71 OG SER A 8 10.310 9.814 0.238 1.00 0.00 O ATOM 0 H SER A 8 11.729 12.602 1.845 1.00 0.00 H new ATOM 0 HA SER A 8 11.540 11.625 -0.939 1.00 0.00 H new ATOM 0 HB2 SER A 8 9.870 11.342 1.545 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.027 11.407 0.010 1.00 0.00 H new ATOM 0 HG SER A 8 10.074 9.280 1.025 1.00 0.00 H new ATOM 77 N PRO A 9 11.048 14.036 -1.561 1.00 0.00 N ATOM 78 CA PRO A 9 10.567 15.304 -2.118 1.00 0.00 C ATOM 79 C PRO A 9 9.253 15.143 -2.875 1.00 0.00 C ATOM 80 O PRO A 9 8.494 16.100 -3.032 1.00 0.00 O ATOM 81 CB PRO A 9 11.687 15.719 -3.074 1.00 0.00 C ATOM 82 CG PRO A 9 12.353 14.442 -3.455 1.00 0.00 C ATOM 83 CD PRO A 9 12.255 13.549 -2.249 1.00 0.00 C ATOM 0 HA PRO A 9 10.359 16.038 -1.340 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.290 16.235 -3.948 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.387 16.402 -2.592 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.864 13.989 -4.317 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.394 14.612 -3.732 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.161 12.501 -2.532 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.139 13.630 -1.616 1.00 0.00 H new ATOM 91 N LEU A 10 8.989 13.927 -3.341 1.00 0.00 N ATOM 92 CA LEU A 10 7.765 13.640 -4.082 1.00 0.00 C ATOM 93 C LEU A 10 6.626 13.281 -3.133 1.00 0.00 C ATOM 94 O LEU A 10 5.518 13.801 -3.252 1.00 0.00 O ATOM 95 CB LEU A 10 8.000 12.497 -5.071 1.00 0.00 C ATOM 96 CG LEU A 10 9.166 12.680 -6.043 1.00 0.00 C ATOM 97 CD1 LEU A 10 9.205 11.541 -7.050 1.00 0.00 C ATOM 98 CD2 LEU A 10 9.062 14.021 -6.755 1.00 0.00 C ATOM 0 H LEU A 10 9.606 13.124 -3.219 1.00 0.00 H new ATOM 0 HA LEU A 10 7.485 14.537 -4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 10 8.166 11.581 -4.504 1.00 0.00 H new ATOM 0 HB3 LEU A 10 7.089 12.352 -5.651 1.00 0.00 H new ATOM 0 HG LEU A 10 10.095 12.666 -5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.041 11.688 -7.734 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.329 10.594 -6.524 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.273 11.523 -7.615 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.900 14.134 -7.443 1.00 0.00 H new ATOM 0 HD22 LEU A 10 8.127 14.065 -7.313 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.085 14.826 -6.020 1.00 0.00 H new ATOM 110 N GLY A 11 6.909 12.389 -2.188 1.00 0.00 N ATOM 111 CA GLY A 11 5.899 11.977 -1.231 1.00 0.00 C ATOM 112 C GLY A 11 6.005 10.508 -0.872 1.00 0.00 C ATOM 113 O GLY A 11 6.765 9.765 -1.492 1.00 0.00 O ATOM 0 H GLY A 11 7.819 11.945 -2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.994 12.577 -0.326 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.910 12.177 -1.643 1.00 0.00 H new ATOM 117 N GLN A 12 5.244 10.090 0.134 1.00 0.00 N ATOM 118 CA GLN A 12 5.258 8.700 0.576 1.00 0.00 C ATOM 119 C GLN A 12 3.839 8.164 0.732 1.00 0.00 C ATOM 120 O GLN A 12 2.869 8.921 0.677 1.00 0.00 O ATOM 121 CB GLN A 12 6.013 8.572 1.900 1.00 0.00 C ATOM 122 CG GLN A 12 7.397 9.202 1.875 1.00 0.00 C ATOM 123 CD GLN A 12 8.154 8.999 3.172 1.00 0.00 C ATOM 124 OE1 GLN A 12 8.216 7.888 3.701 1.00 0.00 O ATOM 125 NE2 GLN A 12 8.735 10.073 3.693 1.00 0.00 N ATOM 0 H GLN A 12 4.610 10.693 0.658 1.00 0.00 H new ATOM 0 HA GLN A 12 5.768 8.108 -0.184 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.425 9.038 2.691 1.00 0.00 H new ATOM 0 HB3 GLN A 12 6.108 7.516 2.154 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.971 8.775 1.053 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.302 10.270 1.677 1.00 0.00 H new ATOM 0 HE21 GLN A 12 8.658 10.974 3.221 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.258 9.997 4.565 1.00 0.00 H new ATOM 134 N ILE A 13 3.725 6.855 0.926 1.00 0.00 N ATOM 135 CA ILE A 13 2.424 6.218 1.091 1.00 0.00 C ATOM 136 C ILE A 13 2.546 4.913 1.871 1.00 0.00 C ATOM 137 O ILE A 13 3.485 4.144 1.669 1.00 0.00 O ATOM 138 CB ILE A 13 1.762 5.930 -0.269 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.499 5.087 -0.078 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.741 5.225 -1.196 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.415 5.087 -1.283 1.00 0.00 C ATOM 0 H ILE A 13 4.517 6.215 0.973 1.00 0.00 H new ATOM 0 HA ILE A 13 1.800 6.915 1.649 1.00 0.00 H new ATOM 0 HB ILE A 13 1.478 6.878 -0.726 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.788 4.061 0.149 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.051 5.462 0.785 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.258 5.028 -2.153 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.614 5.859 -1.353 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.053 4.282 -0.747 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.289 4.470 -1.077 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.734 6.107 -1.498 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.118 4.684 -2.144 1.00 0.00 H new ATOM 153 N GLN A 14 1.589 4.671 2.761 1.00 0.00 N ATOM 154 CA GLN A 14 1.588 3.458 3.570 1.00 0.00 C ATOM 155 C GLN A 14 0.564 2.456 3.049 1.00 0.00 C ATOM 156 O GLN A 14 -0.618 2.774 2.912 1.00 0.00 O ATOM 157 CB GLN A 14 1.291 3.795 5.032 1.00 0.00 C ATOM 158 CG GLN A 14 1.640 2.674 5.998 1.00 0.00 C ATOM 159 CD GLN A 14 1.890 3.174 7.407 1.00 0.00 C ATOM 160 OE1 GLN A 14 3.039 2.814 7.968 1.00 0.00 O flip ATOM 161 NE2 GLN A 14 1.061 3.877 7.986 1.00 0.00 N flip ATOM 0 H GLN A 14 0.805 5.298 2.940 1.00 0.00 H new ATOM 0 HA GLN A 14 2.578 3.006 3.502 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.848 4.690 5.310 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.232 4.034 5.133 1.00 0.00 H new ATOM 0 HG2 GLN A 14 0.828 1.947 6.013 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.528 2.153 5.639 1.00 0.00 H new ATOM 0 HE21 GLN A 14 0.191 4.130 7.518 1.00 0.00 H new ATOM 0 HE22 GLN A 14 1.245 4.206 8.934 1.00 0.00 H new ATOM 170 N LEU A 15 1.023 1.244 2.759 1.00 0.00 N ATOM 171 CA LEU A 15 0.147 0.194 2.252 1.00 0.00 C ATOM 172 C LEU A 15 0.434 -1.136 2.941 1.00 0.00 C ATOM 173 O LEU A 15 1.589 -1.543 3.073 1.00 0.00 O ATOM 174 CB LEU A 15 0.318 0.045 0.739 1.00 0.00 C ATOM 175 CG LEU A 15 -0.143 1.231 -0.109 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.378 1.104 -1.532 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.661 1.334 -0.101 1.00 0.00 C ATOM 0 H LEU A 15 1.998 0.964 2.866 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.882 0.479 2.469 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.372 -0.138 0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.230 -0.841 0.417 1.00 0.00 H new ATOM 0 HG LEU A 15 0.265 2.144 0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 15 0.040 1.957 -2.121 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.468 1.081 -1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.000 0.183 -1.977 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.971 2.183 -0.709 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.090 0.419 -0.510 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.011 1.473 0.922 1.00 0.00 H new ATOM 189 N THR A 16 -0.624 -1.812 3.377 1.00 0.00 N ATOM 190 CA THR A 16 -0.486 -3.097 4.052 1.00 0.00 C ATOM 191 C THR A 16 -0.793 -4.251 3.105 1.00 0.00 C ATOM 192 O THR A 16 -1.955 -4.530 2.808 1.00 0.00 O ATOM 193 CB THR A 16 -1.415 -3.191 5.276 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.252 -2.036 6.106 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.122 -4.447 6.083 1.00 0.00 C ATOM 0 H THR A 16 -1.587 -1.491 3.275 1.00 0.00 H new ATOM 0 HA THR A 16 0.549 -3.170 4.385 1.00 0.00 H new ATOM 0 HB THR A 16 -2.444 -3.239 4.920 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.848 -2.104 6.881 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.791 -4.491 6.943 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.277 -5.326 5.457 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.088 -4.425 6.428 1.00 0.00 H new ATOM 203 N ILE A 17 0.255 -4.918 2.634 1.00 0.00 N ATOM 204 CA ILE A 17 0.096 -6.044 1.721 1.00 0.00 C ATOM 205 C ILE A 17 0.202 -7.372 2.463 1.00 0.00 C ATOM 206 O ILE A 17 1.206 -7.650 3.119 1.00 0.00 O ATOM 207 CB ILE A 17 1.149 -6.011 0.598 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.235 -4.609 -0.010 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.814 -7.039 -0.472 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.414 -4.424 -0.939 1.00 0.00 C ATOM 0 H ILE A 17 1.223 -4.699 2.869 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.897 -5.955 1.280 1.00 0.00 H new ATOM 0 HB ILE A 17 2.121 -6.262 1.024 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.315 -4.402 -0.558 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.298 -3.876 0.794 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.567 -7.004 -1.259 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.799 -8.034 -0.028 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -0.165 -6.816 -0.897 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.411 -3.408 -1.332 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.340 -4.598 -0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.342 -5.133 -1.764 1.00 0.00 H new ATOM 222 N ARG A 18 -0.840 -8.190 2.353 1.00 0.00 N ATOM 223 CA ARG A 18 -0.864 -9.490 3.013 1.00 0.00 C ATOM 224 C ARG A 18 -1.778 -10.460 2.269 1.00 0.00 C ATOM 225 O ARG A 18 -2.998 -10.296 2.261 1.00 0.00 O ATOM 226 CB ARG A 18 -1.331 -9.341 4.462 1.00 0.00 C ATOM 227 CG ARG A 18 -1.454 -10.664 5.200 1.00 0.00 C ATOM 228 CD ARG A 18 -2.526 -10.603 6.277 1.00 0.00 C ATOM 229 NE ARG A 18 -1.993 -10.133 7.554 1.00 0.00 N ATOM 230 CZ ARG A 18 -2.755 -9.790 8.586 1.00 0.00 C ATOM 231 NH1 ARG A 18 -4.076 -9.864 8.493 1.00 0.00 N ATOM 232 NH2 ARG A 18 -2.197 -9.373 9.715 1.00 0.00 N ATOM 0 H ARG A 18 -1.678 -7.975 1.813 1.00 0.00 H new ATOM 0 HA ARG A 18 0.149 -9.893 3.005 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.630 -8.700 4.997 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.297 -8.837 4.474 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.694 -11.457 4.491 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.496 -10.920 5.653 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -3.328 -9.940 5.953 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.964 -11.592 6.409 1.00 0.00 H new ATOM 0 HE ARG A 18 -0.981 -10.065 7.658 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.509 -10.185 7.627 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.659 -9.600 9.287 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.181 -9.316 9.791 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -2.784 -9.110 10.507 1.00 0.00 H new ATOM 246 N HIS A 19 -1.179 -11.469 1.646 1.00 0.00 N ATOM 247 CA HIS A 19 -1.938 -12.466 0.899 1.00 0.00 C ATOM 248 C HIS A 19 -2.117 -13.739 1.720 1.00 0.00 C ATOM 249 O HIS A 19 -1.147 -14.434 2.025 1.00 0.00 O ATOM 250 CB HIS A 19 -1.237 -12.789 -0.420 1.00 0.00 C ATOM 251 CG HIS A 19 -1.858 -13.931 -1.164 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.624 -15.252 -0.846 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.710 -13.944 -2.216 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.304 -16.028 -1.671 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.972 -15.259 -2.512 1.00 0.00 N ATOM 0 H HIS A 19 -0.170 -11.618 1.643 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.923 -12.052 0.685 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.249 -11.903 -1.055 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.192 -13.023 -0.219 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -3.109 -13.081 -2.727 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.312 -17.108 -1.660 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.583 -15.588 -3.259 1.00 0.00 H new ATOM 263 N SER A 20 -3.362 -14.040 2.074 1.00 0.00 N ATOM 264 CA SER A 20 -3.666 -15.228 2.864 1.00 0.00 C ATOM 265 C SER A 20 -3.612 -16.483 1.999 1.00 0.00 C ATOM 266 O SER A 20 -4.304 -16.582 0.985 1.00 0.00 O ATOM 267 CB SER A 20 -5.048 -15.097 3.508 1.00 0.00 C ATOM 268 OG SER A 20 -5.496 -16.344 4.010 1.00 0.00 O ATOM 0 H SER A 20 -4.177 -13.478 1.827 1.00 0.00 H new ATOM 0 HA SER A 20 -2.914 -15.316 3.648 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.008 -14.368 4.318 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.760 -14.719 2.774 1.00 0.00 H new ATOM 0 HG SER A 20 -6.380 -16.234 4.418 1.00 0.00 H new ATOM 274 N SER A 21 -2.785 -17.440 2.407 1.00 0.00 N ATOM 275 CA SER A 21 -2.637 -18.689 1.668 1.00 0.00 C ATOM 276 C SER A 21 -3.826 -19.611 1.916 1.00 0.00 C ATOM 277 O SER A 21 -3.995 -20.620 1.231 1.00 0.00 O ATOM 278 CB SER A 21 -1.339 -19.392 2.070 1.00 0.00 C ATOM 279 OG SER A 21 -1.050 -19.186 3.442 1.00 0.00 O ATOM 0 H SER A 21 -2.207 -17.375 3.245 1.00 0.00 H new ATOM 0 HA SER A 21 -2.600 -18.452 0.605 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.423 -20.460 1.870 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.516 -19.018 1.462 1.00 0.00 H new ATOM 0 HG SER A 21 -0.217 -19.647 3.674 1.00 0.00 H new ATOM 285 N GLN A 22 -4.647 -19.257 2.900 1.00 0.00 N ATOM 286 CA GLN A 22 -5.820 -20.053 3.239 1.00 0.00 C ATOM 287 C GLN A 22 -7.061 -19.527 2.525 1.00 0.00 C ATOM 288 O GLN A 22 -7.971 -20.288 2.199 1.00 0.00 O ATOM 289 CB GLN A 22 -6.047 -20.047 4.752 1.00 0.00 C ATOM 290 CG GLN A 22 -7.149 -20.991 5.206 1.00 0.00 C ATOM 291 CD GLN A 22 -7.018 -22.375 4.601 1.00 0.00 C ATOM 292 OE1 GLN A 22 -5.928 -22.947 4.561 1.00 0.00 O ATOM 293 NE2 GLN A 22 -8.131 -22.921 4.125 1.00 0.00 N ATOM 0 H GLN A 22 -4.521 -18.425 3.476 1.00 0.00 H new ATOM 0 HA GLN A 22 -5.640 -21.076 2.909 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.117 -20.320 5.251 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.294 -19.034 5.070 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -7.129 -21.070 6.293 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -8.117 -20.570 4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.013 -22.411 4.179 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -8.104 -23.850 3.705 1.00 0.00 H new ATOM 302 N ARG A 23 -7.089 -18.220 2.285 1.00 0.00 N ATOM 303 CA ARG A 23 -8.218 -17.591 1.610 1.00 0.00 C ATOM 304 C ARG A 23 -7.899 -17.333 0.140 1.00 0.00 C ATOM 305 O ARG A 23 -8.798 -17.254 -0.695 1.00 0.00 O ATOM 306 CB ARG A 23 -8.585 -16.277 2.301 1.00 0.00 C ATOM 307 CG ARG A 23 -9.460 -16.459 3.531 1.00 0.00 C ATOM 308 CD ARG A 23 -10.924 -16.622 3.153 1.00 0.00 C ATOM 309 NE ARG A 23 -11.523 -15.361 2.724 1.00 0.00 N ATOM 310 CZ ARG A 23 -12.809 -15.223 2.422 1.00 0.00 C ATOM 311 NH1 ARG A 23 -13.628 -16.263 2.504 1.00 0.00 N ATOM 312 NH2 ARG A 23 -13.279 -14.043 2.039 1.00 0.00 N ATOM 0 H ARG A 23 -6.343 -17.576 2.548 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.067 -18.273 1.665 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -7.670 -15.760 2.590 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.103 -15.634 1.589 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -9.127 -17.334 4.089 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.347 -15.598 4.190 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -11.012 -17.356 2.352 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.477 -17.014 4.006 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.921 -14.541 2.652 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -13.271 -17.171 2.800 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -14.615 -16.154 2.272 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.653 -13.240 1.976 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -14.267 -13.938 1.807 1.00 0.00 H new ATOM 326 N ASN A 24 -6.612 -17.203 -0.166 1.00 0.00 N ATOM 327 CA ASN A 24 -6.174 -16.953 -1.535 1.00 0.00 C ATOM 328 C ASN A 24 -6.684 -15.604 -2.031 1.00 0.00 C ATOM 329 O ASN A 24 -7.267 -15.507 -3.111 1.00 0.00 O ATOM 330 CB ASN A 24 -6.664 -18.068 -2.461 1.00 0.00 C ATOM 331 CG ASN A 24 -6.435 -19.448 -1.875 1.00 0.00 C ATOM 332 OD1 ASN A 24 -7.224 -19.929 -1.062 1.00 0.00 O ATOM 333 ND2 ASN A 24 -5.349 -20.093 -2.288 1.00 0.00 N ATOM 0 H ASN A 24 -5.855 -17.267 0.515 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.084 -16.935 -1.544 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.727 -17.932 -2.658 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.150 -17.993 -3.419 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.142 -21.025 -1.929 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -4.722 -19.656 -2.964 1.00 0.00 H new ATOM 340 N LYS A 25 -6.461 -14.564 -1.235 1.00 0.00 N ATOM 341 CA LYS A 25 -6.895 -13.219 -1.592 1.00 0.00 C ATOM 342 C LYS A 25 -5.804 -12.196 -1.292 1.00 0.00 C ATOM 343 O LYS A 25 -4.971 -12.404 -0.408 1.00 0.00 O ATOM 344 CB LYS A 25 -8.173 -12.854 -0.833 1.00 0.00 C ATOM 345 CG LYS A 25 -9.379 -13.683 -1.240 1.00 0.00 C ATOM 346 CD LYS A 25 -10.672 -12.900 -1.084 1.00 0.00 C ATOM 347 CE LYS A 25 -11.856 -13.822 -0.837 1.00 0.00 C ATOM 348 NZ LYS A 25 -12.310 -14.490 -2.088 1.00 0.00 N ATOM 0 H LYS A 25 -5.981 -14.627 -0.337 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.098 -13.203 -2.663 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.000 -12.980 0.236 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.395 -11.800 -0.998 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.269 -14.003 -2.276 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.423 -14.586 -0.631 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.576 -12.199 -0.255 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.851 -12.309 -1.982 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.580 -14.578 -0.101 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.680 -13.249 -0.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.118 -15.110 -1.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.597 -13.770 -2.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.532 -15.058 -2.480 1.00 0.00 H new ATOM 362 N LEU A 26 -5.815 -11.092 -2.030 1.00 0.00 N ATOM 363 CA LEU A 26 -4.826 -10.036 -1.840 1.00 0.00 C ATOM 364 C LEU A 26 -5.468 -8.791 -1.236 1.00 0.00 C ATOM 365 O LEU A 26 -6.192 -8.062 -1.915 1.00 0.00 O ATOM 366 CB LEU A 26 -4.164 -9.686 -3.174 1.00 0.00 C ATOM 367 CG LEU A 26 -3.048 -8.641 -3.116 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.828 -9.203 -2.404 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.682 -8.173 -4.516 1.00 0.00 C ATOM 0 H LEU A 26 -6.497 -10.904 -2.765 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.067 -10.402 -1.149 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.756 -10.600 -3.605 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.935 -9.328 -3.856 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.410 -7.782 -2.551 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.044 -8.446 -2.372 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.099 -9.488 -1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.465 -10.079 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.887 -7.430 -4.455 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.340 -9.023 -5.106 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.557 -7.730 -4.992 1.00 0.00 H new ATOM 381 N ILE A 27 -5.196 -8.553 0.042 1.00 0.00 N ATOM 382 CA ILE A 27 -5.745 -7.395 0.737 1.00 0.00 C ATOM 383 C ILE A 27 -4.739 -6.249 0.775 1.00 0.00 C ATOM 384 O ILE A 27 -3.552 -6.459 1.025 1.00 0.00 O ATOM 385 CB ILE A 27 -6.160 -7.746 2.177 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.229 -8.841 2.170 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.668 -6.507 2.900 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.660 -10.241 2.099 1.00 0.00 C ATOM 0 H ILE A 27 -4.599 -9.146 0.618 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.628 -7.083 0.180 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.286 -8.120 2.710 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.837 -8.750 3.070 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.893 -8.684 1.320 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.957 -6.772 3.917 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.879 -5.755 2.932 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.532 -6.105 2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.475 -10.965 2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.076 -10.350 1.185 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.019 -10.417 2.963 1.00 0.00 H new ATOM 400 N VAL A 28 -5.221 -5.036 0.526 1.00 0.00 N ATOM 401 CA VAL A 28 -4.365 -3.856 0.534 1.00 0.00 C ATOM 402 C VAL A 28 -5.074 -2.668 1.175 1.00 0.00 C ATOM 403 O VAL A 28 -6.056 -2.154 0.640 1.00 0.00 O ATOM 404 CB VAL A 28 -3.926 -3.471 -0.891 1.00 0.00 C ATOM 405 CG1 VAL A 28 -2.920 -2.330 -0.850 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.348 -4.677 -1.614 1.00 0.00 C ATOM 0 H VAL A 28 -6.201 -4.845 0.316 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.482 -4.109 1.121 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.802 -3.131 -1.443 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.621 -2.072 -1.866 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.374 -1.461 -0.373 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.043 -2.639 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.043 -4.387 -2.619 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.483 -5.050 -1.066 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.103 -5.460 -1.676 1.00 0.00 H new ATOM 416 N VAL A 29 -4.568 -2.234 2.325 1.00 0.00 N ATOM 417 CA VAL A 29 -5.151 -1.105 3.040 1.00 0.00 C ATOM 418 C VAL A 29 -4.413 0.190 2.717 1.00 0.00 C ATOM 419 O VAL A 29 -3.186 0.208 2.611 1.00 0.00 O ATOM 420 CB VAL A 29 -5.126 -1.331 4.563 1.00 0.00 C ATOM 421 CG1 VAL A 29 -5.800 -0.174 5.285 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.794 -2.651 4.916 1.00 0.00 C ATOM 0 H VAL A 29 -3.755 -2.648 2.782 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.187 -1.022 2.710 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.087 -1.377 4.889 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.773 -0.351 6.360 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.274 0.753 5.056 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -6.836 -0.094 4.956 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.767 -2.795 5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.830 -2.637 4.577 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.264 -3.469 4.428 1.00 0.00 H new ATOM 432 N VAL A 30 -5.168 1.272 2.562 1.00 0.00 N ATOM 433 CA VAL A 30 -4.586 2.573 2.253 1.00 0.00 C ATOM 434 C VAL A 30 -4.937 3.601 3.323 1.00 0.00 C ATOM 435 O VAL A 30 -5.933 4.316 3.210 1.00 0.00 O ATOM 436 CB VAL A 30 -5.064 3.091 0.883 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.251 4.303 0.457 1.00 0.00 C ATOM 438 CG2 VAL A 30 -4.980 1.988 -0.161 1.00 0.00 C ATOM 0 H VAL A 30 -6.185 1.274 2.645 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.505 2.437 2.225 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.106 3.397 0.973 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.603 4.655 -0.513 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.367 5.097 1.195 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.199 4.028 0.383 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.321 2.371 -1.123 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.948 1.650 -0.251 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.611 1.152 0.141 1.00 0.00 H new ATOM 448 N HIS A 31 -4.112 3.670 4.363 1.00 0.00 N ATOM 449 CA HIS A 31 -4.334 4.611 5.454 1.00 0.00 C ATOM 450 C HIS A 31 -4.459 6.037 4.925 1.00 0.00 C ATOM 451 O HIS A 31 -5.551 6.603 4.890 1.00 0.00 O ATOM 452 CB HIS A 31 -3.192 4.530 6.467 1.00 0.00 C ATOM 453 CG HIS A 31 -3.021 3.169 7.069 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.792 2.706 8.115 1.00 0.00 N ATOM 455 CD2 HIS A 31 -2.163 2.168 6.765 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.414 1.480 8.429 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.427 1.130 7.624 1.00 0.00 N ATOM 0 H HIS A 31 -3.284 3.085 4.473 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.268 4.342 5.948 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.262 4.822 5.978 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.373 5.251 7.264 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.410 2.183 5.991 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.839 0.868 9.211 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -1.940 0.234 7.638 1.00 0.00 H new ATOM 465 N ALA A 32 -3.333 6.611 4.514 1.00 0.00 N ATOM 466 CA ALA A 32 -3.317 7.970 3.985 1.00 0.00 C ATOM 467 C ALA A 32 -1.932 8.341 3.467 1.00 0.00 C ATOM 468 O ALA A 32 -0.931 7.738 3.857 1.00 0.00 O ATOM 469 CB ALA A 32 -3.766 8.957 5.053 1.00 0.00 C ATOM 0 H ALA A 32 -2.420 6.156 4.537 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.013 8.016 3.148 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.749 9.967 4.645 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.779 8.711 5.373 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -3.092 8.900 5.908 1.00 0.00 H new ATOM 475 N CYS A 33 -1.881 9.336 2.589 1.00 0.00 N ATOM 476 CA CYS A 33 -0.617 9.786 2.016 1.00 0.00 C ATOM 477 C CYS A 33 -0.192 11.121 2.620 1.00 0.00 C ATOM 478 O CYS A 33 -1.030 11.911 3.057 1.00 0.00 O ATOM 479 CB CYS A 33 -0.739 9.916 0.497 1.00 0.00 C ATOM 480 SG CYS A 33 -0.892 8.336 -0.368 1.00 0.00 S ATOM 0 H CYS A 33 -2.700 9.847 2.258 1.00 0.00 H new ATOM 0 HA CYS A 33 0.145 9.042 2.249 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.608 10.531 0.264 1.00 0.00 H new ATOM 0 HB3 CYS A 33 0.136 10.443 0.117 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.203 8.551 -1.612 1.00 0.00 H new ATOM 486 N ARG A 34 1.114 11.365 2.643 1.00 0.00 N ATOM 487 CA ARG A 34 1.651 12.602 3.197 1.00 0.00 C ATOM 488 C ARG A 34 2.805 13.122 2.345 1.00 0.00 C ATOM 489 O ARG A 34 3.356 12.397 1.519 1.00 0.00 O ATOM 490 CB ARG A 34 2.123 12.380 4.635 1.00 0.00 C ATOM 491 CG ARG A 34 3.320 11.450 4.746 1.00 0.00 C ATOM 492 CD ARG A 34 3.494 10.935 6.166 1.00 0.00 C ATOM 493 NE ARG A 34 4.404 9.794 6.226 1.00 0.00 N ATOM 494 CZ ARG A 34 5.725 9.910 6.303 1.00 0.00 C ATOM 495 NH1 ARG A 34 6.288 11.111 6.330 1.00 0.00 N ATOM 496 NH2 ARG A 34 6.486 8.825 6.354 1.00 0.00 N ATOM 0 H ARG A 34 1.820 10.722 2.284 1.00 0.00 H new ATOM 0 HA ARG A 34 0.856 13.347 3.195 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.379 13.343 5.077 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.299 11.970 5.220 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.193 10.608 4.065 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.222 11.977 4.436 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.875 11.737 6.798 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.523 10.646 6.569 1.00 0.00 H new ATOM 0 HE ARG A 34 4.003 8.856 6.208 1.00 0.00 H new ATOM 0 HH11 ARG A 34 5.706 11.948 6.292 1.00 0.00 H new ATOM 0 HH12 ARG A 34 7.303 11.197 6.389 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.057 7.900 6.334 1.00 0.00 H new ATOM 0 HH22 ARG A 34 7.500 8.916 6.413 1.00 0.00 H new ATOM 510 N ASN A 35 3.166 14.385 2.554 1.00 0.00 N ATOM 511 CA ASN A 35 4.254 15.003 1.805 1.00 0.00 C ATOM 512 C ASN A 35 3.967 14.976 0.307 1.00 0.00 C ATOM 513 O ASN A 35 4.863 14.735 -0.503 1.00 0.00 O ATOM 514 CB ASN A 35 5.573 14.284 2.096 1.00 0.00 C ATOM 515 CG ASN A 35 6.147 14.655 3.450 1.00 0.00 C ATOM 516 OD1 ASN A 35 6.336 15.833 3.755 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.428 13.649 4.269 1.00 0.00 N ATOM 0 H ASN A 35 2.721 15.000 3.236 1.00 0.00 H new ATOM 0 HA ASN A 35 4.336 16.043 2.122 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.413 13.207 2.055 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.296 14.529 1.318 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.817 13.837 5.193 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.255 12.688 3.974 1.00 0.00 H new ATOM 524 N LEU A 36 2.713 15.225 -0.054 1.00 0.00 N ATOM 525 CA LEU A 36 2.307 15.231 -1.455 1.00 0.00 C ATOM 526 C LEU A 36 2.324 16.647 -2.021 1.00 0.00 C ATOM 527 O LEU A 36 1.359 17.397 -1.874 1.00 0.00 O ATOM 528 CB LEU A 36 0.910 14.627 -1.604 1.00 0.00 C ATOM 529 CG LEU A 36 0.781 13.142 -1.262 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.621 12.642 -1.576 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.821 12.328 -2.017 1.00 0.00 C ATOM 0 H LEU A 36 1.960 15.425 0.604 1.00 0.00 H new ATOM 0 HA LEU A 36 3.019 14.627 -2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.224 15.187 -0.968 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.581 14.772 -2.633 1.00 0.00 H new ATOM 0 HG LEU A 36 0.958 13.018 -0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.694 11.584 -1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.348 13.204 -0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.827 12.779 -2.637 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.714 11.274 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.676 12.458 -3.090 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.819 12.669 -1.742 1.00 0.00 H new ATOM 543 N ILE A 37 3.426 17.005 -2.671 1.00 0.00 N ATOM 544 CA ILE A 37 3.567 18.330 -3.263 1.00 0.00 C ATOM 545 C ILE A 37 2.442 18.613 -4.252 1.00 0.00 C ATOM 546 O ILE A 37 2.122 17.779 -5.098 1.00 0.00 O ATOM 547 CB ILE A 37 4.920 18.485 -3.983 1.00 0.00 C ATOM 548 CG1 ILE A 37 5.014 17.505 -5.154 1.00 0.00 C ATOM 549 CG2 ILE A 37 6.067 18.264 -3.008 1.00 0.00 C ATOM 550 CD1 ILE A 37 4.493 18.069 -6.457 1.00 0.00 C ATOM 0 H ILE A 37 4.234 16.396 -2.801 1.00 0.00 H new ATOM 0 HA ILE A 37 3.517 19.048 -2.444 1.00 0.00 H new ATOM 0 HB ILE A 37 4.992 19.499 -4.375 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.054 17.208 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.454 16.603 -4.908 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.016 18.377 -3.531 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.007 18.997 -2.203 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.000 17.260 -2.590 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.591 17.320 -7.243 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.443 18.340 -6.342 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.069 18.954 -6.726 1.00 0.00 H new ATOM 562 N ALA A 38 1.847 19.796 -4.141 1.00 0.00 N ATOM 563 CA ALA A 38 0.760 20.191 -5.028 1.00 0.00 C ATOM 564 C ALA A 38 1.276 21.042 -6.184 1.00 0.00 C ATOM 565 O ALA A 38 1.835 22.119 -5.973 1.00 0.00 O ATOM 566 CB ALA A 38 -0.308 20.945 -4.251 1.00 0.00 C ATOM 0 H ALA A 38 2.100 20.498 -3.445 1.00 0.00 H new ATOM 0 HA ALA A 38 0.319 19.286 -5.446 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.113 21.234 -4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.706 20.304 -3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.129 21.838 -3.805 1.00 0.00 H new ATOM 572 N PHE A 39 1.087 20.552 -7.404 1.00 0.00 N ATOM 573 CA PHE A 39 1.535 21.267 -8.593 1.00 0.00 C ATOM 574 C PHE A 39 1.200 22.752 -8.493 1.00 0.00 C ATOM 575 O PHE A 39 1.939 23.601 -8.993 1.00 0.00 O ATOM 576 CB PHE A 39 0.891 20.670 -9.846 1.00 0.00 C ATOM 577 CG PHE A 39 1.745 20.793 -11.076 1.00 0.00 C ATOM 578 CD1 PHE A 39 1.681 21.928 -11.869 1.00 0.00 C ATOM 579 CD2 PHE A 39 2.611 19.775 -11.439 1.00 0.00 C ATOM 580 CE1 PHE A 39 2.465 22.044 -13.001 1.00 0.00 C ATOM 581 CE2 PHE A 39 3.398 19.885 -12.570 1.00 0.00 C ATOM 582 CZ PHE A 39 3.325 21.022 -13.352 1.00 0.00 C ATOM 0 H PHE A 39 0.626 19.662 -7.596 1.00 0.00 H new ATOM 0 HA PHE A 39 2.618 21.161 -8.664 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.675 19.617 -9.667 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.063 21.165 -10.025 1.00 0.00 H new ATOM 0 HD1 PHE A 39 1.011 22.731 -11.599 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.672 18.884 -10.831 1.00 0.00 H new ATOM 0 HE1 PHE A 39 2.405 22.933 -13.611 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.069 19.084 -12.842 1.00 0.00 H new ATOM 0 HZ PHE A 39 3.939 21.111 -14.236 1.00 0.00 H new ATOM 592 N SER A 40 0.081 23.058 -7.845 1.00 0.00 N ATOM 593 CA SER A 40 -0.356 24.439 -7.683 1.00 0.00 C ATOM 594 C SER A 40 -0.904 24.675 -6.279 1.00 0.00 C ATOM 595 O SER A 40 -1.842 24.005 -5.848 1.00 0.00 O ATOM 596 CB SER A 40 -1.422 24.785 -8.724 1.00 0.00 C ATOM 597 OG SER A 40 -1.920 26.098 -8.528 1.00 0.00 O ATOM 0 H SER A 40 -0.540 22.367 -7.423 1.00 0.00 H new ATOM 0 HA SER A 40 0.508 25.087 -7.830 1.00 0.00 H new ATOM 0 HB2 SER A 40 -0.999 24.699 -9.725 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.241 24.069 -8.662 1.00 0.00 H new ATOM 0 HG SER A 40 -2.865 26.131 -8.786 1.00 0.00 H new ATOM 603 N GLU A 41 -0.311 25.631 -5.572 1.00 0.00 N ATOM 604 CA GLU A 41 -0.740 25.955 -4.216 1.00 0.00 C ATOM 605 C GLU A 41 -2.262 26.023 -4.128 1.00 0.00 C ATOM 606 O GLU A 41 -2.859 25.561 -3.156 1.00 0.00 O ATOM 607 CB GLU A 41 -0.131 27.286 -3.769 1.00 0.00 C ATOM 608 CG GLU A 41 1.336 27.187 -3.388 1.00 0.00 C ATOM 609 CD GLU A 41 1.770 28.293 -2.445 1.00 0.00 C ATOM 610 OE1 GLU A 41 1.256 28.339 -1.308 1.00 0.00 O ATOM 611 OE2 GLU A 41 2.624 29.112 -2.845 1.00 0.00 O ATOM 0 H GLU A 41 0.467 26.194 -5.915 1.00 0.00 H new ATOM 0 HA GLU A 41 -0.391 25.164 -3.553 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.240 28.014 -4.573 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.694 27.665 -2.916 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.521 26.221 -2.918 1.00 0.00 H new ATOM 0 HG3 GLU A 41 1.945 27.225 -4.291 1.00 0.00 H new ATOM 618 N ASP A 42 -2.882 26.604 -5.149 1.00 0.00 N ATOM 619 CA ASP A 42 -4.334 26.733 -5.189 1.00 0.00 C ATOM 620 C ASP A 42 -5.005 25.507 -4.579 1.00 0.00 C ATOM 621 O ASP A 42 -5.873 25.627 -3.715 1.00 0.00 O ATOM 622 CB ASP A 42 -4.811 26.928 -6.629 1.00 0.00 C ATOM 623 CG ASP A 42 -4.093 28.066 -7.328 1.00 0.00 C ATOM 624 OD1 ASP A 42 -3.762 29.062 -6.652 1.00 0.00 O ATOM 625 OD2 ASP A 42 -3.862 27.961 -8.551 1.00 0.00 O ATOM 0 H ASP A 42 -2.402 26.993 -5.960 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.613 27.608 -4.601 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.655 26.006 -7.188 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -5.883 27.124 -6.630 1.00 0.00 H new ATOM 630 N GLY A 43 -4.598 24.327 -5.035 1.00 0.00 N ATOM 631 CA GLY A 43 -5.171 23.095 -4.524 1.00 0.00 C ATOM 632 C GLY A 43 -5.136 21.973 -5.542 1.00 0.00 C ATOM 633 O GLY A 43 -5.386 22.192 -6.727 1.00 0.00 O ATOM 0 H GLY A 43 -3.881 24.202 -5.750 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.627 22.788 -3.631 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -6.203 23.276 -4.222 1.00 0.00 H new ATOM 637 N SER A 44 -4.822 20.767 -5.080 1.00 0.00 N ATOM 638 CA SER A 44 -4.749 19.606 -5.960 1.00 0.00 C ATOM 639 C SER A 44 -5.695 18.506 -5.489 1.00 0.00 C ATOM 640 O SER A 44 -6.179 18.532 -4.357 1.00 0.00 O ATOM 641 CB SER A 44 -3.316 19.073 -6.018 1.00 0.00 C ATOM 642 OG SER A 44 -2.407 20.091 -6.396 1.00 0.00 O ATOM 0 H SER A 44 -4.614 20.568 -4.101 1.00 0.00 H new ATOM 0 HA SER A 44 -5.053 19.919 -6.959 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.034 18.673 -5.044 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.260 18.249 -6.729 1.00 0.00 H new ATOM 0 HG SER A 44 -1.530 19.695 -6.579 1.00 0.00 H new ATOM 648 N ASP A 45 -5.954 17.542 -6.365 1.00 0.00 N ATOM 649 CA ASP A 45 -6.841 16.431 -6.039 1.00 0.00 C ATOM 650 C ASP A 45 -6.105 15.099 -6.142 1.00 0.00 C ATOM 651 O ASP A 45 -6.179 14.397 -7.150 1.00 0.00 O ATOM 652 CB ASP A 45 -8.055 16.430 -6.970 1.00 0.00 C ATOM 653 CG ASP A 45 -8.534 17.831 -7.298 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.437 18.713 -6.419 1.00 0.00 O ATOM 655 OD2 ASP A 45 -9.006 18.045 -8.434 1.00 0.00 O ATOM 0 H ASP A 45 -5.563 17.507 -7.306 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.181 16.559 -5.011 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.800 15.911 -7.894 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.867 15.872 -6.504 1.00 0.00 H new ATOM 660 N PRO A 46 -5.375 14.742 -5.074 1.00 0.00 N ATOM 661 CA PRO A 46 -4.611 13.493 -5.020 1.00 0.00 C ATOM 662 C PRO A 46 -5.511 12.265 -4.938 1.00 0.00 C ATOM 663 O PRO A 46 -6.509 12.262 -4.216 1.00 0.00 O ATOM 664 CB PRO A 46 -3.785 13.637 -3.739 1.00 0.00 C ATOM 665 CG PRO A 46 -4.567 14.579 -2.889 1.00 0.00 C ATOM 666 CD PRO A 46 -5.241 15.531 -3.838 1.00 0.00 C ATOM 0 HA PRO A 46 -4.010 13.345 -5.917 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.651 12.675 -3.244 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.790 14.028 -3.951 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.301 14.044 -2.287 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.916 15.113 -2.197 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.211 15.855 -3.461 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.645 16.429 -3.997 1.00 0.00 H new ATOM 674 N TYR A 47 -5.153 11.224 -5.680 1.00 0.00 N ATOM 675 CA TYR A 47 -5.930 9.990 -5.692 1.00 0.00 C ATOM 676 C TYR A 47 -5.028 8.779 -5.909 1.00 0.00 C ATOM 677 O TYR A 47 -4.157 8.787 -6.779 1.00 0.00 O ATOM 678 CB TYR A 47 -6.998 10.046 -6.786 1.00 0.00 C ATOM 679 CG TYR A 47 -6.433 9.993 -8.187 1.00 0.00 C ATOM 680 CD1 TYR A 47 -5.823 11.106 -8.754 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.507 8.830 -8.944 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.306 11.062 -10.034 1.00 0.00 C ATOM 683 CE2 TYR A 47 -5.992 8.777 -10.225 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.392 9.896 -10.766 1.00 0.00 C ATOM 685 OH TYR A 47 -4.877 9.848 -12.041 1.00 0.00 O ATOM 0 H TYR A 47 -4.329 11.209 -6.282 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.417 9.888 -4.722 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.689 9.214 -6.650 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.576 10.963 -6.671 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.752 12.021 -8.184 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.975 7.952 -8.524 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -4.837 11.936 -10.460 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -6.059 7.865 -10.800 1.00 0.00 H new ATOM 0 HH TYR A 47 -4.289 10.618 -12.185 1.00 0.00 H new ATOM 695 N VAL A 48 -5.243 7.739 -5.110 1.00 0.00 N ATOM 696 CA VAL A 48 -4.451 6.519 -5.214 1.00 0.00 C ATOM 697 C VAL A 48 -5.151 5.482 -6.084 1.00 0.00 C ATOM 698 O VAL A 48 -6.330 5.186 -5.888 1.00 0.00 O ATOM 699 CB VAL A 48 -4.177 5.908 -3.827 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.141 4.799 -3.927 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.725 6.984 -2.851 1.00 0.00 C ATOM 0 H VAL A 48 -5.959 7.717 -4.384 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.503 6.796 -5.675 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.104 5.474 -3.451 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.960 4.379 -2.937 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.508 4.017 -4.591 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.211 5.205 -4.324 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.536 6.535 -1.876 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.811 7.449 -3.220 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.504 7.740 -2.757 1.00 0.00 H new ATOM 711 N ARG A 49 -4.418 4.932 -7.046 1.00 0.00 N ATOM 712 CA ARG A 49 -4.968 3.928 -7.948 1.00 0.00 C ATOM 713 C ARG A 49 -4.183 2.623 -7.854 1.00 0.00 C ATOM 714 O ARG A 49 -2.953 2.629 -7.809 1.00 0.00 O ATOM 715 CB ARG A 49 -4.953 4.442 -9.389 1.00 0.00 C ATOM 716 CG ARG A 49 -5.982 5.527 -9.659 1.00 0.00 C ATOM 717 CD ARG A 49 -6.459 5.495 -11.103 1.00 0.00 C ATOM 718 NE ARG A 49 -5.361 5.689 -12.046 1.00 0.00 N ATOM 719 CZ ARG A 49 -5.521 5.717 -13.365 1.00 0.00 C ATOM 720 NH1 ARG A 49 -6.728 5.565 -13.893 1.00 0.00 N ATOM 721 NH2 ARG A 49 -4.473 5.898 -14.158 1.00 0.00 N ATOM 0 H ARG A 49 -3.441 5.165 -7.221 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.998 3.734 -7.649 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -3.960 4.830 -9.617 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -5.132 3.607 -10.066 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -6.833 5.397 -8.990 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.550 6.503 -9.439 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -6.945 4.540 -11.303 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -7.209 6.272 -11.255 1.00 0.00 H new ATOM 0 HE ARG A 49 -4.420 5.810 -11.672 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -7.536 5.426 -13.286 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -6.848 5.587 -14.906 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -3.543 6.016 -13.755 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -4.597 5.919 -15.170 1.00 0.00 H new ATOM 735 N MET A 50 -4.902 1.506 -7.824 1.00 0.00 N ATOM 736 CA MET A 50 -4.272 0.194 -7.735 1.00 0.00 C ATOM 737 C MET A 50 -4.606 -0.653 -8.959 1.00 0.00 C ATOM 738 O MET A 50 -5.769 -0.771 -9.346 1.00 0.00 O ATOM 739 CB MET A 50 -4.723 -0.528 -6.463 1.00 0.00 C ATOM 740 CG MET A 50 -4.100 0.032 -5.195 1.00 0.00 C ATOM 741 SD MET A 50 -4.518 -0.935 -3.731 1.00 0.00 S ATOM 742 CE MET A 50 -6.059 -0.164 -3.244 1.00 0.00 C ATOM 0 H MET A 50 -5.921 1.483 -7.860 1.00 0.00 H new ATOM 0 HA MET A 50 -3.192 0.339 -7.698 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.808 -0.464 -6.384 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.471 -1.585 -6.546 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.016 0.061 -5.309 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.434 1.060 -5.054 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.158 -0.203 -2.159 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.065 0.876 -3.572 1.00 0.00 H new ATOM 0 HE3 MET A 50 -6.893 -0.695 -3.704 1.00 0.00 H new ATOM 752 N TYR A 51 -3.579 -1.240 -9.564 1.00 0.00 N ATOM 753 CA TYR A 51 -3.764 -2.074 -10.746 1.00 0.00 C ATOM 754 C TYR A 51 -2.945 -3.357 -10.641 1.00 0.00 C ATOM 755 O TYR A 51 -1.714 -3.323 -10.633 1.00 0.00 O ATOM 756 CB TYR A 51 -3.366 -1.304 -12.007 1.00 0.00 C ATOM 757 CG TYR A 51 -4.433 -0.352 -12.497 1.00 0.00 C ATOM 758 CD1 TYR A 51 -5.459 -0.792 -13.324 1.00 0.00 C ATOM 759 CD2 TYR A 51 -4.417 0.989 -12.131 1.00 0.00 C ATOM 760 CE1 TYR A 51 -6.435 0.074 -13.775 1.00 0.00 C ATOM 761 CE2 TYR A 51 -5.390 1.862 -12.576 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.397 1.400 -13.398 1.00 0.00 C ATOM 763 OH TYR A 51 -7.369 2.267 -13.844 1.00 0.00 O ATOM 0 H TYR A 51 -2.611 -1.154 -9.256 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.819 -2.341 -10.809 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.454 -0.742 -11.807 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -3.134 -2.016 -12.799 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.494 -1.830 -13.619 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -3.630 1.354 -11.488 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -7.224 -0.285 -14.419 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -5.363 2.901 -12.282 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.344 3.089 -13.310 1.00 0.00 H new ATOM 773 N LEU A 52 -3.638 -4.488 -10.562 1.00 0.00 N ATOM 774 CA LEU A 52 -2.977 -5.784 -10.458 1.00 0.00 C ATOM 775 C LEU A 52 -2.340 -6.179 -11.786 1.00 0.00 C ATOM 776 O LEU A 52 -2.906 -6.962 -12.550 1.00 0.00 O ATOM 777 CB LEU A 52 -3.978 -6.855 -10.021 1.00 0.00 C ATOM 778 CG LEU A 52 -3.378 -8.147 -9.463 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.511 -7.852 -8.249 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.478 -9.136 -9.107 1.00 0.00 C ATOM 0 H LEU A 52 -4.657 -4.534 -10.568 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.190 -5.703 -9.709 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.632 -6.425 -9.263 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.605 -7.109 -10.876 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.750 -8.595 -10.233 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.093 -8.783 -7.866 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.701 -7.181 -8.535 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.117 -7.381 -7.475 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.033 -10.049 -8.712 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.133 -8.697 -8.355 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.058 -9.372 -9.999 1.00 0.00 H new ATOM 792 N LEU A 53 -1.159 -5.633 -12.055 1.00 0.00 N ATOM 793 CA LEU A 53 -0.443 -5.929 -13.291 1.00 0.00 C ATOM 794 C LEU A 53 -0.112 -7.415 -13.385 1.00 0.00 C ATOM 795 O LEU A 53 0.047 -8.106 -12.379 1.00 0.00 O ATOM 796 CB LEU A 53 0.842 -5.103 -13.370 1.00 0.00 C ATOM 797 CG LEU A 53 0.662 -3.584 -13.403 1.00 0.00 C ATOM 798 CD1 LEU A 53 2.004 -2.885 -13.253 1.00 0.00 C ATOM 799 CD2 LEU A 53 -0.023 -3.157 -14.693 1.00 0.00 C ATOM 0 H LEU A 53 -0.677 -4.983 -11.434 1.00 0.00 H new ATOM 0 HA LEU A 53 -1.089 -5.665 -14.128 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.466 -5.356 -12.513 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.389 -5.404 -14.263 1.00 0.00 H new ATOM 0 HG LEU A 53 0.028 -3.293 -12.565 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.857 -1.805 -13.279 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.457 -3.167 -12.302 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.662 -3.181 -14.070 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.143 -2.074 -14.700 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.585 -3.460 -15.545 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.002 -3.631 -14.759 1.00 0.00 H new ATOM 811 N PRO A 54 -0.002 -7.920 -14.623 1.00 0.00 N ATOM 812 CA PRO A 54 -0.189 -7.107 -15.829 1.00 0.00 C ATOM 813 C PRO A 54 -1.641 -6.685 -16.024 1.00 0.00 C ATOM 814 O PRO A 54 -1.925 -5.527 -16.330 1.00 0.00 O ATOM 815 CB PRO A 54 0.253 -8.041 -16.958 1.00 0.00 C ATOM 816 CG PRO A 54 0.044 -9.414 -16.418 1.00 0.00 C ATOM 817 CD PRO A 54 0.313 -9.323 -14.941 1.00 0.00 C ATOM 0 HA PRO A 54 0.374 -6.175 -15.784 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.335 -7.877 -17.861 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.297 -7.875 -17.223 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.972 -9.758 -16.609 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.717 -10.127 -16.894 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.313 -10.014 -14.375 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.349 -9.566 -14.706 1.00 0.00 H new ATOM 825 N ASP A 55 -2.556 -7.631 -15.845 1.00 0.00 N ATOM 826 CA ASP A 55 -3.980 -7.356 -16.000 1.00 0.00 C ATOM 827 C ASP A 55 -4.357 -6.044 -15.320 1.00 0.00 C ATOM 828 O ASP A 55 -4.581 -6.000 -14.110 1.00 0.00 O ATOM 829 CB ASP A 55 -4.809 -8.503 -15.418 1.00 0.00 C ATOM 830 CG ASP A 55 -4.691 -9.774 -16.235 1.00 0.00 C ATOM 831 OD1 ASP A 55 -3.551 -10.168 -16.560 1.00 0.00 O ATOM 832 OD2 ASP A 55 -5.739 -10.377 -16.549 1.00 0.00 O ATOM 0 H ASP A 55 -2.337 -8.595 -15.593 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.194 -7.267 -17.065 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -4.485 -8.700 -14.396 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.856 -8.202 -15.368 1.00 0.00 H new ATOM 837 N LYS A 56 -4.426 -4.974 -16.106 1.00 0.00 N ATOM 838 CA LYS A 56 -4.776 -3.660 -15.582 1.00 0.00 C ATOM 839 C LYS A 56 -6.038 -3.126 -16.251 1.00 0.00 C ATOM 840 O LYS A 56 -6.182 -1.920 -16.453 1.00 0.00 O ATOM 841 CB LYS A 56 -3.620 -2.679 -15.792 1.00 0.00 C ATOM 842 CG LYS A 56 -3.279 -2.447 -17.254 1.00 0.00 C ATOM 843 CD LYS A 56 -2.587 -1.109 -17.459 1.00 0.00 C ATOM 844 CE LYS A 56 -1.075 -1.243 -17.367 1.00 0.00 C ATOM 845 NZ LYS A 56 -0.522 -2.060 -18.483 1.00 0.00 N ATOM 0 H LYS A 56 -4.244 -4.992 -17.109 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.968 -3.762 -14.514 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.876 -1.725 -15.331 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -2.736 -3.055 -15.277 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.634 -3.250 -17.610 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -4.190 -2.482 -17.851 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.859 -0.703 -18.434 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.937 -0.399 -16.710 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -0.621 -0.252 -17.383 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -0.808 -1.701 -16.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 0.476 -1.809 -18.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.592 -3.069 -18.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.063 -1.873 -19.351 1.00 0.00 H new ATOM 859 N ARG A 57 -6.950 -4.030 -16.592 1.00 0.00 N ATOM 860 CA ARG A 57 -8.200 -3.649 -17.239 1.00 0.00 C ATOM 861 C ARG A 57 -8.796 -2.408 -16.581 1.00 0.00 C ATOM 862 O ARG A 57 -9.090 -2.408 -15.385 1.00 0.00 O ATOM 863 CB ARG A 57 -9.203 -4.803 -17.178 1.00 0.00 C ATOM 864 CG ARG A 57 -8.743 -6.049 -17.918 1.00 0.00 C ATOM 865 CD ARG A 57 -9.014 -5.943 -19.410 1.00 0.00 C ATOM 866 NE ARG A 57 -8.868 -7.229 -20.086 1.00 0.00 N ATOM 867 CZ ARG A 57 -9.445 -7.519 -21.246 1.00 0.00 C ATOM 868 NH1 ARG A 57 -10.203 -6.620 -21.857 1.00 0.00 N ATOM 869 NH2 ARG A 57 -9.264 -8.712 -21.799 1.00 0.00 N ATOM 0 H ARG A 57 -6.847 -5.032 -16.431 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.985 -3.418 -18.282 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.388 -5.058 -16.134 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -10.152 -4.471 -17.598 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.677 -6.200 -17.751 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.256 -6.923 -17.515 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -10.023 -5.563 -19.569 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.328 -5.221 -19.853 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.291 -7.944 -19.643 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.345 -5.702 -21.436 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -10.645 -6.846 -22.748 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -8.681 -9.407 -21.333 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -9.708 -8.934 -22.690 1.00 0.00 H new ATOM 883 N ARG A 58 -8.970 -1.353 -17.369 1.00 0.00 N ATOM 884 CA ARG A 58 -9.529 -0.105 -16.863 1.00 0.00 C ATOM 885 C ARG A 58 -11.001 -0.277 -16.499 1.00 0.00 C ATOM 886 O ARG A 58 -11.493 0.342 -15.555 1.00 0.00 O ATOM 887 CB ARG A 58 -9.377 1.006 -17.904 1.00 0.00 C ATOM 888 CG ARG A 58 -10.145 0.746 -19.189 1.00 0.00 C ATOM 889 CD ARG A 58 -11.554 1.315 -19.122 1.00 0.00 C ATOM 890 NE ARG A 58 -12.491 0.557 -19.946 1.00 0.00 N ATOM 891 CZ ARG A 58 -13.724 0.967 -20.223 1.00 0.00 C ATOM 892 NH1 ARG A 58 -14.166 2.121 -19.744 1.00 0.00 N ATOM 893 NH2 ARG A 58 -14.517 0.221 -20.981 1.00 0.00 N ATOM 0 H ARG A 58 -8.732 -1.337 -18.361 1.00 0.00 H new ATOM 0 HA ARG A 58 -8.979 0.172 -15.963 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -9.718 1.947 -17.471 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -8.320 1.128 -18.141 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -9.612 1.191 -20.029 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -10.193 -0.327 -19.374 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -11.897 1.312 -18.087 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -11.541 2.354 -19.451 1.00 0.00 H new ATOM 0 HE ARG A 58 -12.182 -0.336 -20.330 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -13.559 2.697 -19.161 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -15.113 2.433 -19.959 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -14.180 -0.668 -21.351 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -15.464 0.536 -21.193 1.00 0.00 H new ATOM 907 N SER A 59 -11.698 -1.121 -17.253 1.00 0.00 N ATOM 908 CA SER A 59 -13.114 -1.371 -17.012 1.00 0.00 C ATOM 909 C SER A 59 -13.365 -1.706 -15.545 1.00 0.00 C ATOM 910 O SER A 59 -14.281 -1.172 -14.922 1.00 0.00 O ATOM 911 CB SER A 59 -13.610 -2.514 -17.900 1.00 0.00 C ATOM 912 OG SER A 59 -14.999 -2.396 -18.154 1.00 0.00 O ATOM 0 H SER A 59 -11.305 -1.643 -18.036 1.00 0.00 H new ATOM 0 HA SER A 59 -13.665 -0.463 -17.259 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.063 -2.510 -18.843 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.405 -3.469 -17.417 1.00 0.00 H new ATOM 0 HG SER A 59 -15.291 -3.137 -18.725 1.00 0.00 H new ATOM 918 N GLY A 60 -12.542 -2.596 -14.999 1.00 0.00 N ATOM 919 CA GLY A 60 -12.690 -2.989 -13.610 1.00 0.00 C ATOM 920 C GLY A 60 -11.579 -2.446 -12.732 1.00 0.00 C ATOM 921 O GLY A 60 -11.203 -3.069 -11.739 1.00 0.00 O ATOM 0 H GLY A 60 -11.775 -3.052 -15.494 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -13.651 -2.635 -13.236 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.703 -4.077 -13.543 1.00 0.00 H new ATOM 925 N ARG A 61 -11.052 -1.282 -13.100 1.00 0.00 N ATOM 926 CA ARG A 61 -9.976 -0.657 -12.340 1.00 0.00 C ATOM 927 C ARG A 61 -10.368 -0.495 -10.874 1.00 0.00 C ATOM 928 O ARG A 61 -11.548 -0.543 -10.528 1.00 0.00 O ATOM 929 CB ARG A 61 -9.625 0.706 -12.939 1.00 0.00 C ATOM 930 CG ARG A 61 -10.693 1.764 -12.712 1.00 0.00 C ATOM 931 CD ARG A 61 -10.130 3.167 -12.872 1.00 0.00 C ATOM 932 NE ARG A 61 -11.182 4.180 -12.890 1.00 0.00 N ATOM 933 CZ ARG A 61 -11.866 4.510 -13.980 1.00 0.00 C ATOM 934 NH1 ARG A 61 -11.611 3.909 -15.134 1.00 0.00 N ATOM 935 NH2 ARG A 61 -12.809 5.441 -13.916 1.00 0.00 N ATOM 0 H ARG A 61 -11.353 -0.753 -13.919 1.00 0.00 H new ATOM 0 HA ARG A 61 -9.102 -1.306 -12.395 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -8.685 1.052 -12.508 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -9.461 0.591 -14.010 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -11.510 1.616 -13.419 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -11.112 1.651 -11.712 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.440 3.376 -12.055 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -9.556 3.224 -13.797 1.00 0.00 H new ATOM 0 HE ARG A 61 -11.404 4.660 -12.018 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -10.888 3.191 -15.186 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -12.138 4.164 -15.969 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -13.009 5.904 -13.029 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.334 5.694 -14.753 1.00 0.00 H new ATOM 949 N ARG A 62 -9.369 -0.304 -10.018 1.00 0.00 N ATOM 950 CA ARG A 62 -9.609 -0.137 -8.590 1.00 0.00 C ATOM 951 C ARG A 62 -8.838 1.061 -8.046 1.00 0.00 C ATOM 952 O ARG A 62 -7.606 1.074 -8.047 1.00 0.00 O ATOM 953 CB ARG A 62 -9.207 -1.404 -7.832 1.00 0.00 C ATOM 954 CG ARG A 62 -10.079 -2.607 -8.151 1.00 0.00 C ATOM 955 CD ARG A 62 -11.273 -2.694 -7.213 1.00 0.00 C ATOM 956 NE ARG A 62 -12.244 -3.692 -7.655 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.226 -4.151 -6.888 1.00 0.00 C ATOM 958 NH1 ARG A 62 -13.368 -3.703 -5.648 1.00 0.00 N ATOM 959 NH2 ARG A 62 -14.070 -5.059 -7.361 1.00 0.00 N ATOM 0 H ARG A 62 -8.387 -0.261 -10.289 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.674 0.042 -8.444 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.170 -1.645 -8.068 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.253 -1.206 -6.761 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.428 -2.541 -9.181 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.486 -3.518 -8.073 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.928 -2.943 -6.209 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.757 -1.719 -7.151 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.163 -4.056 -8.604 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.722 -3.004 -5.281 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -14.123 -4.057 -5.061 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.965 -5.405 -8.315 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.824 -5.411 -6.771 1.00 0.00 H new ATOM 973 N LYS A 63 -9.569 2.068 -7.580 1.00 0.00 N ATOM 974 CA LYS A 63 -8.955 3.271 -7.032 1.00 0.00 C ATOM 975 C LYS A 63 -9.771 3.813 -5.862 1.00 0.00 C ATOM 976 O LYS A 63 -10.882 3.352 -5.599 1.00 0.00 O ATOM 977 CB LYS A 63 -8.826 4.342 -8.117 1.00 0.00 C ATOM 978 CG LYS A 63 -10.159 4.793 -8.689 1.00 0.00 C ATOM 979 CD LYS A 63 -9.996 5.996 -9.603 1.00 0.00 C ATOM 980 CE LYS A 63 -9.978 7.296 -8.814 1.00 0.00 C ATOM 981 NZ LYS A 63 -11.337 7.674 -8.336 1.00 0.00 N ATOM 0 H LYS A 63 -10.589 2.074 -7.571 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.961 3.009 -6.669 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.307 5.206 -7.703 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.206 3.955 -8.925 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.614 3.973 -9.244 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.839 5.043 -7.875 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.070 5.901 -10.170 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.812 6.019 -10.325 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -9.308 7.193 -7.960 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.578 8.094 -9.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -11.578 8.622 -8.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -12.033 6.986 -8.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.351 7.678 -7.296 1.00 0.00 H new ATOM 995 N THR A 64 -9.213 4.797 -5.163 1.00 0.00 N ATOM 996 CA THR A 64 -9.888 5.403 -4.023 1.00 0.00 C ATOM 997 C THR A 64 -10.463 6.767 -4.384 1.00 0.00 C ATOM 998 O THR A 64 -10.126 7.339 -5.421 1.00 0.00 O ATOM 999 CB THR A 64 -8.934 5.562 -2.824 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.969 6.584 -3.099 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.220 4.252 -2.523 1.00 0.00 C ATOM 0 H THR A 64 -8.295 5.191 -5.367 1.00 0.00 H new ATOM 0 HA THR A 64 -10.701 4.732 -3.745 1.00 0.00 H new ATOM 0 HB THR A 64 -9.525 5.844 -1.953 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.914 7.196 -2.335 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.552 4.389 -1.673 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.955 3.483 -2.287 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.641 3.945 -3.394 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.333 7.285 -3.523 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.954 8.585 -3.752 1.00 0.00 C ATOM 1011 C HIS A 65 -10.898 9.652 -4.023 1.00 0.00 C ATOM 1012 O HIS A 65 -9.727 9.480 -3.686 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.804 8.987 -2.546 1.00 0.00 C ATOM 1014 CG HIS A 65 -13.889 9.965 -2.878 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -15.079 9.598 -3.469 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -13.959 11.305 -2.696 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -15.834 10.669 -3.638 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -15.177 11.718 -3.176 1.00 0.00 N ATOM 0 H HIS A 65 -11.624 6.825 -2.661 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.596 8.504 -4.629 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -13.252 8.093 -2.113 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.157 9.420 -1.783 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -13.198 11.932 -2.255 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -16.820 10.684 -4.079 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -15.519 12.679 -3.176 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.320 10.754 -4.635 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.411 11.848 -4.952 1.00 0.00 C ATOM 1028 C VAL A 66 -10.607 13.019 -3.995 1.00 0.00 C ATOM 1029 O VAL A 66 -11.530 13.817 -4.155 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.608 12.342 -6.397 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.874 13.656 -6.618 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.139 11.288 -7.388 1.00 0.00 C ATOM 0 H VAL A 66 -12.286 10.912 -4.921 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.398 11.459 -4.845 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.672 12.516 -6.561 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.025 13.989 -7.645 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -10.261 14.409 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.809 13.513 -6.436 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.285 11.653 -8.404 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.081 11.081 -7.226 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -10.714 10.373 -7.245 1.00 0.00 H new ATOM 1042 N SER A 67 -9.731 13.117 -3.000 1.00 0.00 N ATOM 1043 CA SER A 67 -9.809 14.189 -2.015 1.00 0.00 C ATOM 1044 C SER A 67 -9.398 15.523 -2.630 1.00 0.00 C ATOM 1045 O SER A 67 -8.426 15.600 -3.382 1.00 0.00 O ATOM 1046 CB SER A 67 -8.917 13.871 -0.813 1.00 0.00 C ATOM 1047 OG SER A 67 -9.380 12.723 -0.123 1.00 0.00 O ATOM 0 H SER A 67 -8.959 12.467 -2.855 1.00 0.00 H new ATOM 0 HA SER A 67 -10.843 14.267 -1.680 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.893 13.709 -1.149 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.898 14.724 -0.135 1.00 0.00 H new ATOM 0 HG SER A 67 -8.792 12.540 0.639 1.00 0.00 H new ATOM 1053 N LYS A 68 -10.145 16.572 -2.305 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.860 17.905 -2.823 1.00 0.00 C ATOM 1055 C LYS A 68 -9.508 18.865 -1.690 1.00 0.00 C ATOM 1056 O LYS A 68 -10.022 18.744 -0.578 1.00 0.00 O ATOM 1057 CB LYS A 68 -11.062 18.439 -3.604 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.467 17.559 -4.774 1.00 0.00 C ATOM 1059 CD LYS A 68 -12.131 18.368 -5.876 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.560 17.482 -7.036 1.00 0.00 C ATOM 1061 NZ LYS A 68 -13.437 18.210 -7.995 1.00 0.00 N ATOM 0 H LYS A 68 -10.953 16.525 -1.685 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.003 17.832 -3.493 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.909 18.540 -2.926 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.829 19.437 -3.975 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.587 17.054 -5.172 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.151 16.784 -4.428 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -13.000 18.889 -5.474 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -11.440 19.131 -6.235 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.677 17.115 -7.558 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -13.088 16.610 -6.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -13.708 17.572 -8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -14.292 18.539 -7.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -12.924 19.028 -8.382 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.631 19.820 -1.981 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.213 20.803 -0.989 1.00 0.00 C ATOM 1077 C LYS A 69 -7.529 20.125 0.194 1.00 0.00 C ATOM 1078 O LYS A 69 -7.898 20.346 1.348 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.418 21.610 -0.501 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.829 22.723 -1.449 1.00 0.00 C ATOM 1081 CD LYS A 69 -10.475 22.172 -2.710 1.00 0.00 C ATOM 1082 CE LYS A 69 -11.889 21.679 -2.442 1.00 0.00 C ATOM 1083 NZ LYS A 69 -12.828 22.805 -2.183 1.00 0.00 N ATOM 0 H LYS A 69 -8.196 19.934 -2.896 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.499 21.478 -1.461 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.262 20.936 -0.358 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -9.186 22.041 0.473 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.526 23.393 -0.945 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -8.954 23.316 -1.716 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -10.498 22.946 -3.477 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -9.871 21.353 -3.102 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -12.241 21.102 -3.297 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -11.883 21.006 -1.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -13.808 22.460 -2.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -12.652 23.192 -1.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -12.681 23.550 -2.894 1.00 0.00 H new ATOM 1097 N THR A 70 -6.529 19.300 -0.100 1.00 0.00 N ATOM 1098 CA THR A 70 -5.793 18.590 0.939 1.00 0.00 C ATOM 1099 C THR A 70 -4.551 17.915 0.370 1.00 0.00 C ATOM 1100 O THR A 70 -4.592 17.327 -0.712 1.00 0.00 O ATOM 1101 CB THR A 70 -6.673 17.527 1.624 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.903 16.801 2.588 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.253 16.563 0.601 1.00 0.00 C ATOM 0 H THR A 70 -6.210 19.107 -1.049 1.00 0.00 H new ATOM 0 HA THR A 70 -5.493 19.333 1.677 1.00 0.00 H new ATOM 0 HB THR A 70 -7.495 18.037 2.126 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.470 16.129 3.020 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.870 15.822 1.109 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.863 17.115 -0.114 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.442 16.060 0.074 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.447 18.001 1.104 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.192 17.397 0.672 1.00 0.00 C ATOM 1113 C LEU A 71 -2.018 16.009 1.279 1.00 0.00 C ATOM 1114 O LEU A 71 -1.284 15.176 0.748 1.00 0.00 O ATOM 1115 CB LEU A 71 -1.012 18.289 1.064 1.00 0.00 C ATOM 1116 CG LEU A 71 -1.028 19.710 0.500 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.165 20.502 1.013 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -1.036 19.679 -1.022 1.00 0.00 C ATOM 0 H LEU A 71 -3.396 18.483 2.001 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.220 17.298 -0.413 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.976 18.352 2.152 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -0.092 17.802 0.742 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.938 20.205 0.839 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.137 21.511 0.601 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.127 20.553 2.101 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.088 20.010 0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.047 20.699 -1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.143 19.166 -1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.923 19.150 -1.370 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.701 15.766 2.394 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.623 14.478 3.072 1.00 0.00 C ATOM 1132 C ASN A 72 -3.959 13.744 3.000 1.00 0.00 C ATOM 1133 O ASN A 72 -4.736 13.722 3.955 1.00 0.00 O ATOM 1134 CB ASN A 72 -2.213 14.671 4.533 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.728 15.976 5.111 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -2.431 17.055 4.597 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -3.504 15.882 6.184 1.00 0.00 N ATOM 0 H ASN A 72 -3.314 16.444 2.846 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.869 13.875 2.567 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.592 13.839 5.127 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -1.126 14.647 4.609 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -3.881 16.726 6.617 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -3.724 14.966 6.576 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.233 13.128 1.841 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.474 12.380 1.616 1.00 0.00 C ATOM 1146 C PRO A 73 -5.529 11.091 2.428 1.00 0.00 C ATOM 1147 O PRO A 73 -4.582 10.304 2.428 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.434 12.068 0.118 1.00 0.00 C ATOM 1149 CG PRO A 73 -3.987 12.082 -0.233 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.353 13.112 0.660 1.00 0.00 C ATOM 0 HA PRO A 73 -6.353 12.947 1.923 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -5.884 11.099 -0.097 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.988 12.811 -0.456 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.538 11.101 -0.077 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -3.843 12.335 -1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.331 12.840 0.924 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.309 14.089 0.178 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.645 10.879 3.120 1.00 0.00 N ATOM 1159 CA VAL A 74 -6.824 9.683 3.935 1.00 0.00 C ATOM 1160 C VAL A 74 -8.122 8.967 3.581 1.00 0.00 C ATOM 1161 O VAL A 74 -9.207 9.539 3.680 1.00 0.00 O ATOM 1162 CB VAL A 74 -6.831 10.024 5.437 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.865 11.099 5.736 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -7.094 8.775 6.265 1.00 0.00 C ATOM 0 H VAL A 74 -7.438 11.520 3.132 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.981 9.026 3.723 1.00 0.00 H new ATOM 0 HB VAL A 74 -5.849 10.413 5.708 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.855 11.327 6.802 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -7.627 12.000 5.170 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -8.854 10.742 5.450 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.096 9.034 7.324 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -8.062 8.355 5.993 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.313 8.040 6.073 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.003 7.709 3.168 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.167 6.912 2.799 1.00 0.00 C ATOM 1176 C PHE A 75 -9.380 5.769 3.787 1.00 0.00 C ATOM 1177 O PHE A 75 -10.495 5.274 3.949 1.00 0.00 O ATOM 1178 CB PHE A 75 -9.002 6.354 1.384 1.00 0.00 C ATOM 1179 CG PHE A 75 -8.175 7.230 0.487 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -6.791 7.150 0.503 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -8.780 8.133 -0.372 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -6.028 7.956 -0.321 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -8.022 8.941 -1.199 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.644 8.851 -1.173 1.00 0.00 C ATOM 0 H PHE A 75 -7.112 7.220 3.081 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.043 7.560 2.827 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.540 5.368 1.442 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.987 6.218 0.938 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.304 6.451 1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -9.857 8.207 -0.396 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -4.951 7.886 -0.298 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -8.506 9.641 -1.864 1.00 0.00 H new ATOM 0 HZ PHE A 75 -6.049 9.480 -1.818 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.302 5.355 4.444 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.369 4.270 5.417 1.00 0.00 C ATOM 1196 C ASP A 76 -9.256 3.138 4.908 1.00 0.00 C ATOM 1197 O ASP A 76 -9.938 2.474 5.688 1.00 0.00 O ATOM 1198 CB ASP A 76 -8.900 4.789 6.754 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.806 3.751 7.855 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.961 2.839 7.741 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.578 3.851 8.832 1.00 0.00 O ATOM 0 H ASP A 76 -7.371 5.754 4.321 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.361 3.881 5.561 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.338 5.676 7.046 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.939 5.095 6.635 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.241 2.926 3.596 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.046 1.875 2.984 1.00 0.00 C ATOM 1208 C GLN A 77 -9.225 0.606 2.786 1.00 0.00 C ATOM 1209 O GLN A 77 -7.994 0.646 2.773 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.606 2.349 1.641 1.00 0.00 C ATOM 1211 CG GLN A 77 -11.967 3.018 1.752 1.00 0.00 C ATOM 1212 CD GLN A 77 -12.554 3.372 0.400 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -13.168 2.534 -0.262 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.369 4.618 -0.018 1.00 0.00 N ATOM 0 H GLN A 77 -8.681 3.467 2.937 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.874 1.649 3.656 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.902 3.048 1.190 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.684 1.496 0.967 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.652 2.354 2.279 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.875 3.923 2.352 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -11.854 5.280 0.563 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.742 4.914 -0.920 1.00 0.00 H new ATOM 1223 N SER A 78 -9.913 -0.521 2.632 1.00 0.00 N ATOM 1224 CA SER A 78 -9.247 -1.804 2.439 1.00 0.00 C ATOM 1225 C SER A 78 -9.844 -2.553 1.252 1.00 0.00 C ATOM 1226 O SER A 78 -11.046 -2.817 1.211 1.00 0.00 O ATOM 1227 CB SER A 78 -9.359 -2.656 3.704 1.00 0.00 C ATOM 1228 OG SER A 78 -8.971 -3.996 3.452 1.00 0.00 O ATOM 0 H SER A 78 -10.932 -0.572 2.637 1.00 0.00 H new ATOM 0 HA SER A 78 -8.194 -1.612 2.232 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.730 -2.233 4.488 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.385 -2.634 4.072 1.00 0.00 H new ATOM 0 HG SER A 78 -9.050 -4.520 4.276 1.00 0.00 H new ATOM 1234 N PHE A 79 -8.996 -2.893 0.287 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.439 -3.611 -0.902 1.00 0.00 C ATOM 1236 C PHE A 79 -9.049 -5.084 -0.825 1.00 0.00 C ATOM 1237 O PHE A 79 -8.279 -5.489 0.046 1.00 0.00 O ATOM 1238 CB PHE A 79 -8.839 -2.978 -2.159 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.139 -1.513 -2.295 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.627 -0.601 -1.386 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -9.932 -1.048 -3.331 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -8.903 0.748 -1.507 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.210 0.300 -3.458 1.00 0.00 C ATOM 1244 CZ PHE A 79 -9.694 1.199 -2.546 1.00 0.00 C ATOM 0 H PHE A 79 -7.998 -2.683 0.305 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.526 -3.543 -0.953 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -7.758 -3.120 -2.147 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.219 -3.501 -3.036 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -8.005 -0.948 -0.574 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.338 -1.747 -4.048 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.501 1.449 -0.790 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -10.830 0.650 -4.270 1.00 0.00 H new ATOM 0 HZ PHE A 79 -9.908 2.253 -2.645 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.587 -5.881 -1.742 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.295 -7.310 -1.779 1.00 0.00 C ATOM 1256 C ASP A 80 -9.449 -7.859 -3.193 1.00 0.00 C ATOM 1257 O ASP A 80 -10.288 -7.393 -3.964 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.219 -8.065 -0.822 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.603 -7.451 -0.747 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -12.459 -7.815 -1.580 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -11.830 -6.608 0.145 1.00 0.00 O ATOM 0 H ASP A 80 -10.227 -5.562 -2.469 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.262 -7.454 -1.463 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.302 -9.103 -1.145 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.775 -8.076 0.174 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.633 -8.853 -3.529 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.676 -9.465 -4.851 1.00 0.00 C ATOM 1268 C PHE A 81 -8.431 -10.968 -4.764 1.00 0.00 C ATOM 1269 O PHE A 81 -7.386 -11.411 -4.285 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.636 -8.820 -5.770 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.525 -7.332 -5.596 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.579 -6.500 -5.938 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.365 -6.765 -5.093 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.479 -5.131 -5.779 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.260 -5.397 -4.931 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.318 -4.578 -5.276 1.00 0.00 C ATOM 0 H PHE A 81 -7.933 -9.252 -2.903 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.670 -9.300 -5.267 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.663 -9.274 -5.580 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.893 -9.039 -6.806 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.489 -6.926 -6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.533 -7.400 -4.825 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.308 -4.494 -6.048 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.351 -4.968 -4.535 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.237 -3.508 -5.153 1.00 0.00 H new ATOM 1286 N SER A 82 -9.401 -11.749 -5.229 1.00 0.00 N ATOM 1287 CA SER A 82 -9.293 -13.203 -5.199 1.00 0.00 C ATOM 1288 C SER A 82 -8.218 -13.687 -6.166 1.00 0.00 C ATOM 1289 O SER A 82 -8.493 -13.957 -7.335 1.00 0.00 O ATOM 1290 CB SER A 82 -10.638 -13.842 -5.552 1.00 0.00 C ATOM 1291 OG SER A 82 -11.135 -13.339 -6.779 1.00 0.00 O ATOM 0 H SER A 82 -10.271 -11.399 -5.631 1.00 0.00 H new ATOM 0 HA SER A 82 -9.010 -13.502 -4.190 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.524 -14.924 -5.619 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.357 -13.646 -4.757 1.00 0.00 H new ATOM 0 HG SER A 82 -10.426 -13.367 -7.455 1.00 0.00 H new ATOM 1297 N VAL A 83 -6.989 -13.796 -5.669 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.871 -14.249 -6.487 1.00 0.00 C ATOM 1299 C VAL A 83 -4.906 -15.104 -5.673 1.00 0.00 C ATOM 1300 O VAL A 83 -4.510 -14.731 -4.569 1.00 0.00 O ATOM 1301 CB VAL A 83 -5.101 -13.060 -7.093 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.634 -12.112 -5.999 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.924 -13.554 -7.920 1.00 0.00 C ATOM 0 H VAL A 83 -6.743 -13.577 -4.704 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.291 -14.849 -7.294 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.774 -12.512 -7.752 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.092 -11.279 -6.446 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.498 -11.732 -5.454 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.977 -12.645 -5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.391 -12.701 -8.341 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.248 -14.127 -7.285 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.288 -14.189 -8.728 1.00 0.00 H new ATOM 1313 N SER A 84 -4.529 -16.252 -6.227 1.00 0.00 N ATOM 1314 CA SER A 84 -3.612 -17.162 -5.552 1.00 0.00 C ATOM 1315 C SER A 84 -2.188 -16.617 -5.578 1.00 0.00 C ATOM 1316 O SER A 84 -1.769 -15.986 -6.550 1.00 0.00 O ATOM 1317 CB SER A 84 -3.654 -18.543 -6.209 1.00 0.00 C ATOM 1318 OG SER A 84 -4.964 -18.860 -6.646 1.00 0.00 O ATOM 0 H SER A 84 -4.845 -16.574 -7.142 1.00 0.00 H new ATOM 0 HA SER A 84 -3.929 -17.252 -4.513 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.969 -18.567 -7.056 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.311 -19.297 -5.500 1.00 0.00 H new ATOM 0 HG SER A 84 -4.964 -19.746 -7.064 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.447 -16.864 -4.503 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.068 -16.398 -4.401 1.00 0.00 C ATOM 1326 C LEU A 85 0.739 -16.811 -5.628 1.00 0.00 C ATOM 1327 O LEU A 85 1.492 -16.023 -6.200 1.00 0.00 O ATOM 1328 CB LEU A 85 0.586 -16.954 -3.135 1.00 0.00 C ATOM 1329 CG LEU A 85 2.112 -17.057 -3.158 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.743 -15.698 -2.898 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.593 -18.075 -2.134 1.00 0.00 C ATOM 0 H LEU A 85 -1.778 -17.384 -3.690 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.081 -15.309 -4.348 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.297 -16.324 -2.294 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.178 -17.947 -2.945 1.00 0.00 H new ATOM 0 HG LEU A 85 2.419 -17.394 -4.148 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.829 -15.791 -2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.425 -14.996 -3.668 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.428 -15.332 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.681 -18.135 -2.164 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.274 -17.768 -1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.169 -19.052 -2.365 1.00 0.00 H new ATOM 1343 N PRO A 86 0.577 -18.075 -6.044 1.00 0.00 N ATOM 1344 CA PRO A 86 1.279 -18.621 -7.209 1.00 0.00 C ATOM 1345 C PRO A 86 1.194 -17.700 -8.422 1.00 0.00 C ATOM 1346 O PRO A 86 2.113 -17.648 -9.238 1.00 0.00 O ATOM 1347 CB PRO A 86 0.544 -19.935 -7.484 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.026 -20.333 -6.166 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.305 -19.070 -5.411 1.00 0.00 C ATOM 0 HA PRO A 86 2.345 -18.745 -7.020 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.239 -19.802 -8.230 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.224 -20.696 -7.868 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.940 -20.912 -6.300 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.674 -20.964 -5.618 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.353 -18.781 -5.489 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.083 -19.182 -4.350 1.00 0.00 H new ATOM 1357 N GLU A 87 0.086 -16.974 -8.531 1.00 0.00 N ATOM 1358 CA GLU A 87 -0.118 -16.055 -9.645 1.00 0.00 C ATOM 1359 C GLU A 87 0.344 -14.648 -9.280 1.00 0.00 C ATOM 1360 O GLU A 87 1.161 -14.049 -9.980 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.593 -16.031 -10.051 1.00 0.00 C ATOM 1362 CG GLU A 87 -1.977 -17.138 -11.018 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.413 -16.920 -12.409 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -1.225 -15.747 -12.795 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -1.159 -17.921 -13.110 1.00 0.00 O ATOM 0 H GLU A 87 -0.684 -17.004 -7.862 1.00 0.00 H new ATOM 0 HA GLU A 87 0.477 -16.407 -10.488 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -2.209 -16.113 -9.155 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.820 -15.067 -10.507 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.621 -18.093 -10.631 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -3.063 -17.203 -11.077 1.00 0.00 H new ATOM 1372 N VAL A 88 -0.185 -14.124 -8.179 1.00 0.00 N ATOM 1373 CA VAL A 88 0.172 -12.787 -7.720 1.00 0.00 C ATOM 1374 C VAL A 88 1.686 -12.612 -7.662 1.00 0.00 C ATOM 1375 O VAL A 88 2.208 -11.539 -7.962 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.421 -12.494 -6.329 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.476 -13.055 -5.237 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.630 -10.998 -6.144 1.00 0.00 C ATOM 0 H VAL A 88 -0.863 -14.605 -7.588 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.245 -12.083 -8.440 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.391 -12.985 -6.256 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.041 -12.838 -4.261 1.00 0.00 H new ATOM 0 HG12 VAL A 88 0.569 -14.134 -5.361 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.462 -12.596 -5.304 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.050 -10.809 -5.156 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.326 -10.483 -6.237 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.316 -10.630 -6.906 1.00 0.00 H new ATOM 1388 N GLN A 89 2.384 -13.675 -7.274 1.00 0.00 N ATOM 1389 CA GLN A 89 3.838 -13.638 -7.177 1.00 0.00 C ATOM 1390 C GLN A 89 4.452 -13.018 -8.427 1.00 0.00 C ATOM 1391 O GLN A 89 5.378 -12.210 -8.341 1.00 0.00 O ATOM 1392 CB GLN A 89 4.392 -15.049 -6.969 1.00 0.00 C ATOM 1393 CG GLN A 89 4.419 -15.484 -5.513 1.00 0.00 C ATOM 1394 CD GLN A 89 5.264 -16.722 -5.288 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.629 -17.888 -5.334 1.00 0.00 O flip ATOM 1396 NE2 GLN A 89 6.473 -16.633 -5.077 1.00 0.00 N flip ATOM 0 H GLN A 89 1.966 -14.571 -7.022 1.00 0.00 H new ATOM 0 HA GLN A 89 4.104 -13.020 -6.319 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.788 -15.755 -7.539 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.404 -15.096 -7.372 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.806 -14.669 -4.902 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.400 -15.678 -5.177 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.920 -15.717 -5.050 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.028 -17.476 -4.929 1.00 0.00 H new ATOM 1405 N ARG A 90 3.931 -13.400 -9.589 1.00 0.00 N ATOM 1406 CA ARG A 90 4.430 -12.882 -10.857 1.00 0.00 C ATOM 1407 C ARG A 90 3.879 -11.485 -11.128 1.00 0.00 C ATOM 1408 O ARG A 90 4.548 -10.650 -11.737 1.00 0.00 O ATOM 1409 CB ARG A 90 4.048 -13.823 -12.002 1.00 0.00 C ATOM 1410 CG ARG A 90 4.613 -15.226 -11.851 1.00 0.00 C ATOM 1411 CD ARG A 90 4.243 -16.106 -13.034 1.00 0.00 C ATOM 1412 NE ARG A 90 4.945 -15.709 -14.252 1.00 0.00 N ATOM 1413 CZ ARG A 90 4.859 -16.372 -15.400 1.00 0.00 C ATOM 1414 NH1 ARG A 90 4.105 -17.459 -15.486 1.00 0.00 N ATOM 1415 NH2 ARG A 90 5.528 -15.948 -16.464 1.00 0.00 N ATOM 0 H ARG A 90 3.164 -14.066 -9.678 1.00 0.00 H new ATOM 0 HA ARG A 90 5.516 -12.820 -10.793 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.961 -13.883 -12.065 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.399 -13.398 -12.943 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.698 -15.175 -11.760 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.237 -15.674 -10.931 1.00 0.00 H new ATOM 0 HD2 ARG A 90 4.479 -17.144 -12.801 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.167 -16.054 -13.202 1.00 0.00 H new ATOM 0 HE ARG A 90 5.534 -14.877 -14.219 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.589 -17.788 -14.670 1.00 0.00 H new ATOM 0 HH12 ARG A 90 4.040 -17.966 -16.368 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.109 -15.112 -16.401 1.00 0.00 H new ATOM 0 HH22 ARG A 90 5.461 -16.458 -17.345 1.00 0.00 H new ATOM 1429 N ARG A 91 2.655 -11.238 -10.672 1.00 0.00 N ATOM 1430 CA ARG A 91 2.014 -9.944 -10.866 1.00 0.00 C ATOM 1431 C ARG A 91 2.746 -8.852 -10.090 1.00 0.00 C ATOM 1432 O ARG A 91 3.761 -9.110 -9.442 1.00 0.00 O ATOM 1433 CB ARG A 91 0.550 -10.004 -10.424 1.00 0.00 C ATOM 1434 CG ARG A 91 -0.371 -10.635 -11.455 1.00 0.00 C ATOM 1435 CD ARG A 91 -0.303 -12.154 -11.408 1.00 0.00 C ATOM 1436 NE ARG A 91 -0.999 -12.768 -12.535 1.00 0.00 N ATOM 1437 CZ ARG A 91 -2.320 -12.751 -12.681 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -3.082 -12.153 -11.776 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -2.880 -13.332 -13.734 1.00 0.00 N ATOM 0 H ARG A 91 2.088 -11.918 -10.166 1.00 0.00 H new ATOM 0 HA ARG A 91 2.056 -9.702 -11.928 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.483 -10.569 -9.494 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.202 -8.994 -10.209 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -1.396 -10.310 -11.276 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.096 -10.288 -12.451 1.00 0.00 H new ATOM 0 HD2 ARG A 91 0.740 -12.470 -11.410 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -0.741 -12.508 -10.475 1.00 0.00 H new ATOM 0 HE ARG A 91 -0.441 -13.236 -13.249 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -2.655 -11.705 -10.966 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.096 -12.141 -11.890 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -2.297 -13.792 -14.433 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -3.894 -13.318 -13.845 1.00 0.00 H new ATOM 1453 N THR A 92 2.224 -7.631 -10.162 1.00 0.00 N ATOM 1454 CA THR A 92 2.828 -6.501 -9.468 1.00 0.00 C ATOM 1455 C THR A 92 1.786 -5.439 -9.137 1.00 0.00 C ATOM 1456 O THR A 92 0.928 -5.119 -9.960 1.00 0.00 O ATOM 1457 CB THR A 92 3.949 -5.860 -10.309 1.00 0.00 C ATOM 1458 OG1 THR A 92 5.078 -6.738 -10.370 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.371 -4.523 -9.718 1.00 0.00 C ATOM 0 H THR A 92 1.385 -7.400 -10.694 1.00 0.00 H new ATOM 0 HA THR A 92 3.254 -6.889 -8.543 1.00 0.00 H new ATOM 0 HB THR A 92 3.567 -5.690 -11.316 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.853 -7.591 -9.943 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.163 -4.089 -10.328 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.516 -3.847 -9.700 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.737 -4.673 -8.702 1.00 0.00 H new ATOM 1467 N LEU A 93 1.867 -4.894 -7.928 1.00 0.00 N ATOM 1468 CA LEU A 93 0.931 -3.866 -7.488 1.00 0.00 C ATOM 1469 C LEU A 93 1.361 -2.489 -7.982 1.00 0.00 C ATOM 1470 O LEU A 93 2.332 -1.916 -7.487 1.00 0.00 O ATOM 1471 CB LEU A 93 0.827 -3.863 -5.961 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.478 -3.319 -5.379 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.544 -4.403 -5.352 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.247 -2.761 -3.982 1.00 0.00 C ATOM 0 H LEU A 93 2.571 -5.147 -7.235 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.046 -4.094 -7.913 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.962 -4.884 -5.605 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.653 -3.274 -5.562 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.829 -2.509 -6.019 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.465 -3.997 -4.935 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.730 -4.756 -6.366 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.202 -5.234 -4.736 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.186 -2.378 -3.583 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.128 -3.551 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.483 -1.953 -4.029 1.00 0.00 H new ATOM 1486 N ASP A 94 0.632 -1.963 -8.960 1.00 0.00 N ATOM 1487 CA ASP A 94 0.937 -0.651 -9.520 1.00 0.00 C ATOM 1488 C ASP A 94 0.311 0.457 -8.679 1.00 0.00 C ATOM 1489 O ASP A 94 -0.874 0.761 -8.816 1.00 0.00 O ATOM 1490 CB ASP A 94 0.434 -0.559 -10.962 1.00 0.00 C ATOM 1491 CG ASP A 94 0.714 0.793 -11.588 1.00 0.00 C ATOM 1492 OD1 ASP A 94 0.959 1.756 -10.832 1.00 0.00 O ATOM 1493 OD2 ASP A 94 0.689 0.888 -12.833 1.00 0.00 O ATOM 0 H ASP A 94 -0.174 -2.425 -9.381 1.00 0.00 H new ATOM 0 HA ASP A 94 2.019 -0.522 -9.512 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.908 -1.338 -11.559 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.639 -0.750 -10.982 1.00 0.00 H new ATOM 1498 N VAL A 95 1.116 1.057 -7.808 1.00 0.00 N ATOM 1499 CA VAL A 95 0.642 2.132 -6.944 1.00 0.00 C ATOM 1500 C VAL A 95 1.202 3.480 -7.385 1.00 0.00 C ATOM 1501 O VAL A 95 2.400 3.735 -7.265 1.00 0.00 O ATOM 1502 CB VAL A 95 1.030 1.884 -5.474 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.247 2.806 -4.552 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.802 0.426 -5.103 1.00 0.00 C ATOM 0 H VAL A 95 2.099 0.817 -7.682 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.445 2.148 -7.028 1.00 0.00 H new ATOM 0 HB VAL A 95 2.091 2.105 -5.353 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.534 2.616 -3.518 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.465 3.844 -4.805 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.820 2.620 -4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.081 0.268 -4.061 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.250 0.176 -5.239 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.412 -0.212 -5.743 1.00 0.00 H new ATOM 1514 N ALA A 96 0.327 4.339 -7.896 1.00 0.00 N ATOM 1515 CA ALA A 96 0.733 5.662 -8.353 1.00 0.00 C ATOM 1516 C ALA A 96 -0.184 6.743 -7.791 1.00 0.00 C ATOM 1517 O ALA A 96 -1.396 6.714 -8.001 1.00 0.00 O ATOM 1518 CB ALA A 96 0.744 5.715 -9.874 1.00 0.00 C ATOM 0 H ALA A 96 -0.668 4.142 -8.004 1.00 0.00 H new ATOM 0 HA ALA A 96 1.742 5.852 -7.986 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.049 6.709 -10.201 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.446 4.975 -10.259 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.255 5.499 -10.253 1.00 0.00 H new ATOM 1524 N VAL A 97 0.403 7.697 -7.075 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.361 8.788 -6.483 1.00 0.00 C ATOM 1526 C VAL A 97 -0.127 10.094 -7.234 1.00 0.00 C ATOM 1527 O VAL A 97 0.983 10.629 -7.242 1.00 0.00 O ATOM 1528 CB VAL A 97 0.004 8.989 -5.000 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.912 10.020 -4.359 1.00 0.00 C ATOM 1530 CG2 VAL A 97 -0.063 7.666 -4.252 1.00 0.00 C ATOM 0 H VAL A 97 1.406 7.736 -6.891 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.413 8.513 -6.557 1.00 0.00 H new ATOM 0 HB VAL A 97 1.027 9.362 -4.943 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.639 10.148 -3.312 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.809 10.972 -4.880 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.945 9.680 -4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.198 7.826 -3.206 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.073 7.262 -4.317 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.639 6.960 -4.697 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.179 10.605 -7.864 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.090 11.850 -8.617 1.00 0.00 C ATOM 1542 C LYS A 98 -2.381 12.655 -8.493 1.00 0.00 C ATOM 1543 O LYS A 98 -3.366 12.181 -7.928 1.00 0.00 O ATOM 1544 CB LYS A 98 -0.798 11.559 -10.091 1.00 0.00 C ATOM 1545 CG LYS A 98 -1.685 10.478 -10.685 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.105 9.093 -10.453 1.00 0.00 C ATOM 1547 CE LYS A 98 -2.079 8.004 -10.876 1.00 0.00 C ATOM 1548 NZ LYS A 98 -2.573 8.211 -12.266 1.00 0.00 N ATOM 0 H LYS A 98 -2.104 10.176 -7.868 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.273 12.440 -8.200 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -0.924 12.477 -10.666 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.245 11.259 -10.194 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.679 10.537 -10.241 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.803 10.650 -11.755 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -0.175 8.988 -11.012 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -0.858 8.973 -9.398 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.590 7.032 -10.805 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.925 7.986 -10.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.788 7.290 -12.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -3.435 8.793 -12.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.842 8.695 -12.826 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.367 13.872 -9.025 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.537 14.742 -8.974 1.00 0.00 C ATOM 1564 C ASN A 99 -4.334 14.658 -10.272 1.00 0.00 C ATOM 1565 O ASN A 99 -3.785 14.823 -11.361 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.112 16.189 -8.715 1.00 0.00 C ATOM 1567 CG ASN A 99 -2.558 16.859 -9.958 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -1.346 17.016 -10.104 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -3.447 17.259 -10.860 1.00 0.00 N ATOM 0 H ASN A 99 -1.559 14.279 -9.496 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.174 14.406 -8.155 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -3.968 16.757 -8.350 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.358 16.208 -7.928 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.134 17.717 -11.716 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -4.442 17.108 -10.697 1.00 0.00 H new ATOM 1576 N SER A 100 -5.632 14.401 -10.148 1.00 0.00 N ATOM 1577 CA SER A 100 -6.505 14.292 -11.311 1.00 0.00 C ATOM 1578 C SER A 100 -6.276 15.455 -12.272 1.00 0.00 C ATOM 1579 O SER A 100 -6.661 16.590 -11.994 1.00 0.00 O ATOM 1580 CB SER A 100 -7.970 14.258 -10.874 1.00 0.00 C ATOM 1581 OG SER A 100 -8.817 14.774 -11.886 1.00 0.00 O ATOM 0 H SER A 100 -6.103 14.264 -9.253 1.00 0.00 H new ATOM 0 HA SER A 100 -6.266 13.363 -11.828 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.259 13.233 -10.641 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.094 14.840 -9.961 1.00 0.00 H new ATOM 0 HG SER A 100 -9.748 14.740 -11.582 1.00 0.00 H new ATOM 1587 N GLY A 101 -5.646 15.163 -13.406 1.00 0.00 N ATOM 1588 CA GLY A 101 -5.376 16.193 -14.391 1.00 0.00 C ATOM 1589 C GLY A 101 -6.645 16.785 -14.973 1.00 0.00 C ATOM 1590 O GLY A 101 -7.342 17.551 -14.309 1.00 0.00 O ATOM 0 H GLY A 101 -5.318 14.231 -13.660 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.786 16.986 -13.931 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -4.772 15.773 -15.196 1.00 0.00 H new ATOM 1594 N GLY A 102 -6.944 16.431 -16.219 1.00 0.00 N ATOM 1595 CA GLY A 102 -8.136 16.943 -16.870 1.00 0.00 C ATOM 1596 C GLY A 102 -8.486 16.174 -18.128 1.00 0.00 C ATOM 1597 O GLY A 102 -9.406 15.356 -18.129 1.00 0.00 O ATOM 0 H GLY A 102 -6.382 15.799 -16.789 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -8.974 16.897 -16.175 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.987 17.993 -17.120 1.00 0.00 H new ATOM 1601 N PHE A 103 -7.751 16.436 -19.204 1.00 0.00 N ATOM 1602 CA PHE A 103 -7.990 15.764 -20.476 1.00 0.00 C ATOM 1603 C PHE A 103 -6.690 15.607 -21.260 1.00 0.00 C ATOM 1604 O PHE A 103 -5.631 16.065 -20.829 1.00 0.00 O ATOM 1605 CB PHE A 103 -9.008 16.547 -21.307 1.00 0.00 C ATOM 1606 CG PHE A 103 -9.786 15.690 -22.265 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -10.839 14.909 -21.818 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -9.463 15.666 -23.612 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -11.555 14.119 -22.697 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -10.176 14.878 -24.496 1.00 0.00 C ATOM 1611 CZ PHE A 103 -11.224 14.104 -24.038 1.00 0.00 C ATOM 0 H PHE A 103 -6.985 17.109 -19.220 1.00 0.00 H new ATOM 0 HA PHE A 103 -8.389 14.772 -20.265 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -9.703 17.050 -20.635 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -8.487 17.324 -21.867 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -11.103 14.918 -20.771 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -8.645 16.270 -23.976 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -12.373 13.514 -22.336 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.914 14.868 -25.544 1.00 0.00 H new ATOM 0 HZ PHE A 103 -11.784 13.488 -24.727 1.00 0.00 H new ATOM 1621 N LEU A 104 -6.778 14.955 -22.414 1.00 0.00 N ATOM 1622 CA LEU A 104 -5.610 14.735 -23.260 1.00 0.00 C ATOM 1623 C LEU A 104 -4.740 15.986 -23.322 1.00 0.00 C ATOM 1624 O LEU A 104 -3.515 15.899 -23.411 1.00 0.00 O ATOM 1625 CB LEU A 104 -6.046 14.333 -24.670 1.00 0.00 C ATOM 1626 CG LEU A 104 -6.363 12.852 -24.878 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -5.082 12.036 -24.946 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -7.265 12.339 -23.765 1.00 0.00 C ATOM 0 H LEU A 104 -7.646 14.569 -22.785 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.022 13.927 -22.824 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.930 14.914 -24.935 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.258 14.617 -25.367 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.890 12.743 -25.826 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.328 10.984 -25.094 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.471 12.387 -25.778 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.527 12.151 -24.015 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.481 11.283 -23.929 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.764 12.462 -22.805 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.197 12.904 -23.763 1.00 0.00 H new ATOM 1640 N SER A 105 -5.381 17.150 -23.272 1.00 0.00 N ATOM 1641 CA SER A 105 -4.665 18.419 -23.324 1.00 0.00 C ATOM 1642 C SER A 105 -3.391 18.360 -22.486 1.00 0.00 C ATOM 1643 O SER A 105 -2.348 18.881 -22.881 1.00 0.00 O ATOM 1644 CB SER A 105 -5.562 19.555 -22.828 1.00 0.00 C ATOM 1645 OG SER A 105 -4.896 20.804 -22.910 1.00 0.00 O ATOM 0 H SER A 105 -6.394 17.240 -23.196 1.00 0.00 H new ATOM 0 HA SER A 105 -4.388 18.609 -24.361 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.476 19.587 -23.422 1.00 0.00 H new ATOM 0 HB3 SER A 105 -5.859 19.364 -21.797 1.00 0.00 H new ATOM 0 HG SER A 105 -5.491 21.514 -22.589 1.00 0.00 H new ATOM 1651 N LYS A 106 -3.484 17.720 -21.325 1.00 0.00 N ATOM 1652 CA LYS A 106 -2.341 17.590 -20.429 1.00 0.00 C ATOM 1653 C LYS A 106 -2.320 16.214 -19.771 1.00 0.00 C ATOM 1654 O LYS A 106 -3.361 15.577 -19.608 1.00 0.00 O ATOM 1655 CB LYS A 106 -2.381 18.680 -19.356 1.00 0.00 C ATOM 1656 CG LYS A 106 -1.783 20.001 -19.809 1.00 0.00 C ATOM 1657 CD LYS A 106 -2.367 21.171 -19.034 1.00 0.00 C ATOM 1658 CE LYS A 106 -1.564 21.462 -17.775 1.00 0.00 C ATOM 1659 NZ LYS A 106 -2.323 22.313 -16.818 1.00 0.00 N ATOM 0 H LYS A 106 -4.340 17.283 -20.983 1.00 0.00 H new ATOM 0 HA LYS A 106 -1.432 17.705 -21.020 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.416 18.843 -19.054 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -1.843 18.331 -18.475 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -0.702 19.977 -19.674 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -1.969 20.140 -20.874 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.384 22.057 -19.669 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -3.400 20.951 -18.765 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -1.294 20.523 -17.291 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -0.633 21.961 -18.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -1.742 22.489 -15.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.559 23.219 -17.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.199 21.826 -16.540 1.00 0.00 H new ATOM 1673 N ASP A 107 -1.129 15.762 -19.392 1.00 0.00 N ATOM 1674 CA ASP A 107 -0.974 14.463 -18.749 1.00 0.00 C ATOM 1675 C ASP A 107 -1.611 14.463 -17.363 1.00 0.00 C ATOM 1676 O ASP A 107 -2.234 15.443 -16.954 1.00 0.00 O ATOM 1677 CB ASP A 107 0.508 14.097 -18.643 1.00 0.00 C ATOM 1678 CG ASP A 107 1.377 15.292 -18.305 1.00 0.00 C ATOM 1679 OD1 ASP A 107 1.455 16.223 -19.134 1.00 0.00 O ATOM 1680 OD2 ASP A 107 1.978 15.298 -17.210 1.00 0.00 O ATOM 0 H ASP A 107 -0.257 16.276 -19.519 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.482 13.718 -19.362 1.00 0.00 H new ATOM 0 HB2 ASP A 107 0.636 13.331 -17.879 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.841 13.665 -19.587 1.00 0.00 H new ATOM 1685 N LYS A 108 -1.451 13.357 -16.644 1.00 0.00 N ATOM 1686 CA LYS A 108 -2.009 13.229 -15.303 1.00 0.00 C ATOM 1687 C LYS A 108 -1.051 13.790 -14.258 1.00 0.00 C ATOM 1688 O LYS A 108 -1.149 13.467 -13.075 1.00 0.00 O ATOM 1689 CB LYS A 108 -2.315 11.761 -14.994 1.00 0.00 C ATOM 1690 CG LYS A 108 -3.423 11.177 -15.853 1.00 0.00 C ATOM 1691 CD LYS A 108 -3.447 9.659 -15.775 1.00 0.00 C ATOM 1692 CE LYS A 108 -2.322 9.041 -16.591 1.00 0.00 C ATOM 1693 NZ LYS A 108 -2.608 9.083 -18.052 1.00 0.00 N ATOM 0 H LYS A 108 -0.939 12.536 -16.968 1.00 0.00 H new ATOM 0 HA LYS A 108 -2.935 13.803 -15.266 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -1.409 11.172 -15.135 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -2.594 11.670 -13.944 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.385 11.574 -15.528 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.284 11.487 -16.889 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -3.358 9.346 -14.735 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -4.406 9.290 -16.138 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.392 9.572 -16.388 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -2.173 8.007 -16.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.877 8.549 -18.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -3.540 8.659 -18.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -2.607 10.071 -18.378 1.00 0.00 H new ATOM 1707 N GLY A 109 -0.125 14.634 -14.703 1.00 0.00 N ATOM 1708 CA GLY A 109 0.837 15.228 -13.793 1.00 0.00 C ATOM 1709 C GLY A 109 1.251 14.278 -12.686 1.00 0.00 C ATOM 1710 O GLY A 109 0.902 14.479 -11.522 1.00 0.00 O ATOM 0 H GLY A 109 -0.024 14.917 -15.678 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.720 15.536 -14.353 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.409 16.129 -13.353 1.00 0.00 H new ATOM 1714 N LEU A 110 1.995 13.239 -13.048 1.00 0.00 N ATOM 1715 CA LEU A 110 2.456 12.253 -12.078 1.00 0.00 C ATOM 1716 C LEU A 110 3.344 12.902 -11.021 1.00 0.00 C ATOM 1717 O LEU A 110 4.420 13.416 -11.330 1.00 0.00 O ATOM 1718 CB LEU A 110 3.221 11.132 -12.784 1.00 0.00 C ATOM 1719 CG LEU A 110 3.541 9.900 -11.936 1.00 0.00 C ATOM 1720 CD1 LEU A 110 2.275 9.114 -11.637 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.564 9.020 -12.640 1.00 0.00 C ATOM 0 H LEU A 110 2.292 13.058 -14.007 1.00 0.00 H new ATOM 0 HA LEU A 110 1.581 11.832 -11.583 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.640 10.812 -13.649 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.158 11.541 -13.163 1.00 0.00 H new ATOM 0 HG LEU A 110 3.968 10.234 -10.990 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.523 8.241 -11.033 1.00 0.00 H new ATOM 0 HD12 LEU A 110 1.575 9.746 -11.091 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.818 8.790 -12.572 1.00 0.00 H new ATOM 0 HD21 LEU A 110 4.780 8.148 -12.023 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.164 8.695 -13.600 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.481 9.586 -12.802 1.00 0.00 H new ATOM 1733 N LEU A 111 2.888 12.874 -9.774 1.00 0.00 N ATOM 1734 CA LEU A 111 3.642 13.458 -8.670 1.00 0.00 C ATOM 1735 C LEU A 111 4.641 12.455 -8.102 1.00 0.00 C ATOM 1736 O LEU A 111 5.799 12.790 -7.856 1.00 0.00 O ATOM 1737 CB LEU A 111 2.690 13.926 -7.568 1.00 0.00 C ATOM 1738 CG LEU A 111 1.431 14.658 -8.034 1.00 0.00 C ATOM 1739 CD1 LEU A 111 0.469 14.858 -6.873 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.793 15.994 -8.666 1.00 0.00 C ATOM 0 H LEU A 111 2.000 12.453 -9.502 1.00 0.00 H new ATOM 0 HA LEU A 111 4.194 14.316 -9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 111 2.386 13.057 -6.985 1.00 0.00 H new ATOM 0 HB3 LEU A 111 3.240 14.584 -6.895 1.00 0.00 H new ATOM 0 HG LEU A 111 0.936 14.045 -8.787 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.421 15.381 -7.224 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.183 13.888 -6.466 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.954 15.449 -6.096 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.884 16.501 -8.992 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.312 16.614 -7.935 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.442 15.826 -9.525 1.00 0.00 H new ATOM 1752 N GLY A 112 4.185 11.223 -7.899 1.00 0.00 N ATOM 1753 CA GLY A 112 5.053 10.190 -7.364 1.00 0.00 C ATOM 1754 C GLY A 112 4.408 8.819 -7.394 1.00 0.00 C ATOM 1755 O GLY A 112 3.271 8.649 -6.951 1.00 0.00 O ATOM 0 H GLY A 112 3.230 10.922 -8.095 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.979 10.165 -7.938 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.320 10.440 -6.337 1.00 0.00 H new ATOM 1759 N LYS A 113 5.133 7.836 -7.918 1.00 0.00 N ATOM 1760 CA LYS A 113 4.625 6.472 -8.005 1.00 0.00 C ATOM 1761 C LYS A 113 5.653 5.475 -7.481 1.00 0.00 C ATOM 1762 O LYS A 113 6.856 5.735 -7.511 1.00 0.00 O ATOM 1763 CB LYS A 113 4.260 6.133 -9.451 1.00 0.00 C ATOM 1764 CG LYS A 113 5.449 6.142 -10.397 1.00 0.00 C ATOM 1765 CD LYS A 113 5.051 5.707 -11.797 1.00 0.00 C ATOM 1766 CE LYS A 113 5.042 4.191 -11.928 1.00 0.00 C ATOM 1767 NZ LYS A 113 4.280 3.743 -13.127 1.00 0.00 N ATOM 0 H LYS A 113 6.075 7.959 -8.289 1.00 0.00 H new ATOM 0 HA LYS A 113 3.730 6.404 -7.386 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.793 5.149 -9.478 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.518 6.848 -9.807 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.878 7.143 -10.434 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.224 5.477 -10.015 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.062 6.100 -12.034 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.745 6.132 -12.522 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.067 3.826 -11.992 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.602 3.752 -11.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 4.297 2.705 -13.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 3.295 4.070 -13.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.715 4.142 -13.984 1.00 0.00 H new ATOM 1781 N VAL A 114 5.172 4.331 -7.003 1.00 0.00 N ATOM 1782 CA VAL A 114 6.051 3.294 -6.476 1.00 0.00 C ATOM 1783 C VAL A 114 5.479 1.905 -6.737 1.00 0.00 C ATOM 1784 O VAL A 114 4.300 1.649 -6.487 1.00 0.00 O ATOM 1785 CB VAL A 114 6.278 3.467 -4.962 1.00 0.00 C ATOM 1786 CG1 VAL A 114 4.977 3.265 -4.200 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.348 2.504 -4.471 1.00 0.00 C ATOM 0 H VAL A 114 4.179 4.099 -6.970 1.00 0.00 H new ATOM 0 HA VAL A 114 7.005 3.394 -6.993 1.00 0.00 H new ATOM 0 HB VAL A 114 6.624 4.484 -4.778 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.157 3.391 -3.132 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.243 3.998 -4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.598 2.261 -4.388 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.496 2.640 -3.400 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.033 1.479 -4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.284 2.702 -4.994 1.00 0.00 H new ATOM 1797 N LEU A 115 6.321 1.010 -7.242 1.00 0.00 N ATOM 1798 CA LEU A 115 5.900 -0.355 -7.538 1.00 0.00 C ATOM 1799 C LEU A 115 6.242 -1.292 -6.384 1.00 0.00 C ATOM 1800 O LEU A 115 7.164 -1.032 -5.611 1.00 0.00 O ATOM 1801 CB LEU A 115 6.566 -0.847 -8.824 1.00 0.00 C ATOM 1802 CG LEU A 115 5.962 -0.333 -10.132 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.458 -0.561 -10.151 1.00 0.00 C ATOM 1804 CD2 LEU A 115 6.282 1.142 -10.323 1.00 0.00 C ATOM 0 H LEU A 115 7.299 1.205 -7.455 1.00 0.00 H new ATOM 0 HA LEU A 115 4.818 -0.355 -7.673 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.618 -0.563 -8.796 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.530 -1.936 -8.834 1.00 0.00 H new ATOM 0 HG LEU A 115 6.404 -0.890 -10.958 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.045 -0.189 -11.089 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.250 -1.627 -10.061 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.999 -0.030 -9.317 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.845 1.491 -11.258 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.868 1.715 -9.493 1.00 0.00 H new ATOM 0 HD23 LEU A 115 7.363 1.279 -10.355 1.00 0.00 H new ATOM 1816 N VAL A 116 5.494 -2.385 -6.275 1.00 0.00 N ATOM 1817 CA VAL A 116 5.720 -3.364 -5.218 1.00 0.00 C ATOM 1818 C VAL A 116 5.600 -4.787 -5.751 1.00 0.00 C ATOM 1819 O VAL A 116 4.536 -5.201 -6.211 1.00 0.00 O ATOM 1820 CB VAL A 116 4.724 -3.177 -4.058 1.00 0.00 C ATOM 1821 CG1 VAL A 116 4.931 -4.248 -2.998 1.00 0.00 C ATOM 1822 CG2 VAL A 116 4.862 -1.786 -3.456 1.00 0.00 C ATOM 0 H VAL A 116 4.726 -2.615 -6.906 1.00 0.00 H new ATOM 0 HA VAL A 116 6.733 -3.202 -4.848 1.00 0.00 H new ATOM 0 HB VAL A 116 3.712 -3.279 -4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.218 -4.099 -2.187 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.777 -5.232 -3.440 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.946 -4.181 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.151 -1.671 -2.638 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.875 -1.652 -3.077 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.659 -1.037 -4.221 1.00 0.00 H new ATOM 1832 N ALA A 117 6.699 -5.531 -5.686 1.00 0.00 N ATOM 1833 CA ALA A 117 6.716 -6.910 -6.160 1.00 0.00 C ATOM 1834 C ALA A 117 6.131 -7.857 -5.118 1.00 0.00 C ATOM 1835 O ALA A 117 6.714 -8.059 -4.052 1.00 0.00 O ATOM 1836 CB ALA A 117 8.135 -7.327 -6.517 1.00 0.00 C ATOM 0 H ALA A 117 7.589 -5.203 -5.310 1.00 0.00 H new ATOM 0 HA ALA A 117 6.095 -6.968 -7.054 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.133 -8.358 -6.869 1.00 0.00 H new ATOM 0 HB2 ALA A 117 8.519 -6.676 -7.302 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.771 -7.246 -5.635 1.00 0.00 H new ATOM 1842 N LEU A 118 4.977 -8.433 -5.432 1.00 0.00 N ATOM 1843 CA LEU A 118 4.311 -9.359 -4.521 1.00 0.00 C ATOM 1844 C LEU A 118 4.859 -10.773 -4.686 1.00 0.00 C ATOM 1845 O LEU A 118 4.182 -11.752 -4.376 1.00 0.00 O ATOM 1846 CB LEU A 118 2.802 -9.353 -4.769 1.00 0.00 C ATOM 1847 CG LEU A 118 2.179 -7.992 -5.080 1.00 0.00 C ATOM 1848 CD1 LEU A 118 0.703 -8.144 -5.414 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.367 -7.039 -3.909 1.00 0.00 C ATOM 0 H LEU A 118 4.482 -8.276 -6.310 1.00 0.00 H new ATOM 0 HA LEU A 118 4.506 -9.030 -3.501 1.00 0.00 H new ATOM 0 HB2 LEU A 118 2.588 -10.027 -5.599 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.308 -9.764 -3.889 1.00 0.00 H new ATOM 0 HG LEU A 118 2.686 -7.572 -5.949 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.277 -7.165 -5.632 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.592 -8.791 -6.284 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.181 -8.586 -4.565 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.917 -6.075 -4.148 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.887 -7.453 -3.022 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.431 -6.905 -3.716 1.00 0.00 H new ATOM 1861 N ALA A 119 6.091 -10.871 -5.175 1.00 0.00 N ATOM 1862 CA ALA A 119 6.732 -12.165 -5.377 1.00 0.00 C ATOM 1863 C ALA A 119 7.462 -12.619 -4.117 1.00 0.00 C ATOM 1864 O ALA A 119 8.389 -13.426 -4.182 1.00 0.00 O ATOM 1865 CB ALA A 119 7.696 -12.099 -6.553 1.00 0.00 C ATOM 0 H ALA A 119 6.665 -10.070 -5.439 1.00 0.00 H new ATOM 0 HA ALA A 119 5.955 -12.897 -5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.167 -13.072 -6.692 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.150 -11.828 -7.456 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.462 -11.350 -6.354 1.00 0.00 H new ATOM 1871 N SER A 120 7.038 -12.094 -2.972 1.00 0.00 N ATOM 1872 CA SER A 120 7.655 -12.442 -1.697 1.00 0.00 C ATOM 1873 C SER A 120 6.845 -13.517 -0.977 1.00 0.00 C ATOM 1874 O SER A 120 5.688 -13.765 -1.313 1.00 0.00 O ATOM 1875 CB SER A 120 7.778 -11.201 -0.811 1.00 0.00 C ATOM 1876 OG SER A 120 8.317 -11.532 0.458 1.00 0.00 O ATOM 0 H SER A 120 6.270 -11.426 -2.901 1.00 0.00 H new ATOM 0 HA SER A 120 8.651 -12.836 -1.899 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.415 -10.463 -1.299 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.798 -10.742 -0.685 1.00 0.00 H new ATOM 0 HG SER A 120 8.578 -10.712 0.927 1.00 0.00 H new ATOM 1882 N GLU A 121 7.464 -14.150 0.014 1.00 0.00 N ATOM 1883 CA GLU A 121 6.801 -15.199 0.781 1.00 0.00 C ATOM 1884 C GLU A 121 6.226 -14.642 2.080 1.00 0.00 C ATOM 1885 O GLU A 121 5.287 -15.201 2.645 1.00 0.00 O ATOM 1886 CB GLU A 121 7.782 -16.332 1.089 1.00 0.00 C ATOM 1887 CG GLU A 121 8.153 -17.164 -0.127 1.00 0.00 C ATOM 1888 CD GLU A 121 9.287 -16.554 -0.927 1.00 0.00 C ATOM 1889 OE1 GLU A 121 10.107 -15.825 -0.330 1.00 0.00 O ATOM 1890 OE2 GLU A 121 9.356 -16.805 -2.148 1.00 0.00 O ATOM 0 H GLU A 121 8.422 -13.956 0.305 1.00 0.00 H new ATOM 0 HA GLU A 121 5.981 -15.591 0.180 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.689 -15.908 1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.345 -16.984 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.439 -18.165 0.196 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.279 -17.273 -0.768 1.00 0.00 H new ATOM 1897 N GLU A 122 6.798 -13.536 2.548 1.00 0.00 N ATOM 1898 CA GLU A 122 6.343 -12.905 3.781 1.00 0.00 C ATOM 1899 C GLU A 122 4.855 -12.576 3.707 1.00 0.00 C ATOM 1900 O GLU A 122 4.192 -12.409 4.732 1.00 0.00 O ATOM 1901 CB GLU A 122 7.145 -11.630 4.053 1.00 0.00 C ATOM 1902 CG GLU A 122 8.624 -11.882 4.293 1.00 0.00 C ATOM 1903 CD GLU A 122 9.467 -10.637 4.092 1.00 0.00 C ATOM 1904 OE1 GLU A 122 9.443 -10.077 2.977 1.00 0.00 O ATOM 1905 OE2 GLU A 122 10.151 -10.224 5.052 1.00 0.00 O ATOM 0 H GLU A 122 7.576 -13.060 2.092 1.00 0.00 H new ATOM 0 HA GLU A 122 6.502 -13.608 4.599 1.00 0.00 H new ATOM 0 HB2 GLU A 122 7.033 -10.953 3.206 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.725 -11.125 4.923 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.766 -12.253 5.308 1.00 0.00 H new ATOM 0 HG3 GLU A 122 8.970 -12.664 3.617 1.00 0.00 H new ATOM 1912 N LEU A 123 4.335 -12.485 2.488 1.00 0.00 N ATOM 1913 CA LEU A 123 2.925 -12.176 2.278 1.00 0.00 C ATOM 1914 C LEU A 123 2.045 -12.976 3.232 1.00 0.00 C ATOM 1915 O LEU A 123 1.131 -12.433 3.853 1.00 0.00 O ATOM 1916 CB LEU A 123 2.528 -12.470 0.830 1.00 0.00 C ATOM 1917 CG LEU A 123 2.830 -11.368 -0.186 1.00 0.00 C ATOM 1918 CD1 LEU A 123 3.031 -11.961 -1.572 1.00 0.00 C ATOM 1919 CD2 LEU A 123 1.712 -10.336 -0.202 1.00 0.00 C ATOM 0 H LEU A 123 4.869 -12.621 1.630 1.00 0.00 H new ATOM 0 HA LEU A 123 2.777 -11.115 2.480 1.00 0.00 H new ATOM 0 HB2 LEU A 123 3.038 -13.379 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.458 -12.678 0.803 1.00 0.00 H new ATOM 0 HG LEU A 123 3.753 -10.869 0.111 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.245 -11.162 -2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.866 -12.661 -1.551 1.00 0.00 H new ATOM 0 HD13 LEU A 123 2.126 -12.486 -1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.944 -9.559 -0.931 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.774 -10.820 -0.474 1.00 0.00 H new ATOM 0 HD23 LEU A 123 1.616 -9.888 0.787 1.00 0.00 H new ATOM 1931 N ALA A 124 2.327 -14.270 3.345 1.00 0.00 N ATOM 1932 CA ALA A 124 1.563 -15.144 4.226 1.00 0.00 C ATOM 1933 C ALA A 124 1.246 -14.451 5.547 1.00 0.00 C ATOM 1934 O ALA A 124 0.140 -14.573 6.073 1.00 0.00 O ATOM 1935 CB ALA A 124 2.326 -16.437 4.476 1.00 0.00 C ATOM 0 H ALA A 124 3.079 -14.736 2.837 1.00 0.00 H new ATOM 0 HA ALA A 124 0.619 -15.380 3.734 1.00 0.00 H new ATOM 0 HB1 ALA A 124 1.744 -17.081 5.136 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.497 -16.948 3.528 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.284 -16.210 4.943 1.00 0.00 H new ATOM 1941 N LYS A 125 2.223 -13.724 6.078 1.00 0.00 N ATOM 1942 CA LYS A 125 2.049 -13.011 7.337 1.00 0.00 C ATOM 1943 C LYS A 125 1.544 -11.592 7.093 1.00 0.00 C ATOM 1944 O LYS A 125 0.500 -11.197 7.610 1.00 0.00 O ATOM 1945 CB LYS A 125 3.369 -12.968 8.110 1.00 0.00 C ATOM 1946 CG LYS A 125 3.587 -14.172 9.009 1.00 0.00 C ATOM 1947 CD LYS A 125 5.061 -14.382 9.313 1.00 0.00 C ATOM 1948 CE LYS A 125 5.718 -15.292 8.287 1.00 0.00 C ATOM 1949 NZ LYS A 125 5.279 -16.707 8.439 1.00 0.00 N ATOM 0 H LYS A 125 3.145 -13.613 5.655 1.00 0.00 H new ATOM 0 HA LYS A 125 1.306 -13.546 7.929 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.194 -12.901 7.400 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.396 -12.063 8.716 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.038 -14.035 9.941 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.183 -15.063 8.529 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.571 -13.419 9.326 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.170 -14.815 10.307 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.476 -14.942 7.283 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.801 -15.235 8.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.959 -17.334 7.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.231 -16.949 9.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.340 -16.827 8.009 1.00 0.00 H new ATOM 1963 N GLY A 126 2.292 -10.831 6.300 1.00 0.00 N ATOM 1964 CA GLY A 126 1.903 -9.465 6.000 1.00 0.00 C ATOM 1965 C GLY A 126 2.857 -8.447 6.594 1.00 0.00 C ATOM 1966 O GLY A 126 3.487 -8.702 7.620 1.00 0.00 O ATOM 0 H GLY A 126 3.160 -11.136 5.860 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.861 -9.331 4.919 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.899 -9.284 6.383 1.00 0.00 H new ATOM 1970 N TRP A 127 2.964 -7.292 5.947 1.00 0.00 N ATOM 1971 CA TRP A 127 3.849 -6.233 6.416 1.00 0.00 C ATOM 1972 C TRP A 127 3.293 -4.859 6.057 1.00 0.00 C ATOM 1973 O TRP A 127 2.402 -4.739 5.215 1.00 0.00 O ATOM 1974 CB TRP A 127 5.246 -6.404 5.816 1.00 0.00 C ATOM 1975 CG TRP A 127 5.319 -6.031 4.366 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.526 -4.783 3.851 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.185 -6.913 3.247 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.528 -4.837 2.477 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.321 -6.132 2.082 1.00 0.00 C ATOM 1980 CE3 TRP A 127 4.964 -8.286 3.114 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.243 -6.680 0.805 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.886 -8.829 1.846 1.00 0.00 C ATOM 1983 CH2 TRP A 127 5.026 -8.028 0.705 1.00 0.00 C ATOM 0 H TRP A 127 2.449 -7.065 5.096 1.00 0.00 H new ATOM 0 HA TRP A 127 3.916 -6.305 7.502 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.952 -5.792 6.377 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.560 -7.441 5.933 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.667 -3.886 4.436 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.662 -4.041 1.853 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.856 -8.912 3.987 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.350 -6.064 -0.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.714 -9.889 1.732 1.00 0.00 H new ATOM 0 HH2 TRP A 127 4.961 -8.483 -0.272 1.00 0.00 H new ATOM 1994 N THR A 128 3.824 -3.824 6.700 1.00 0.00 N ATOM 1995 CA THR A 128 3.380 -2.459 6.448 1.00 0.00 C ATOM 1996 C THR A 128 4.548 -1.481 6.502 1.00 0.00 C ATOM 1997 O THR A 128 5.303 -1.457 7.474 1.00 0.00 O ATOM 1998 CB THR A 128 2.310 -2.019 7.466 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.186 -2.905 7.409 1.00 0.00 O ATOM 2000 CG2 THR A 128 1.854 -0.594 7.191 1.00 0.00 C ATOM 0 H THR A 128 4.562 -3.905 7.399 1.00 0.00 H new ATOM 0 HA THR A 128 2.947 -2.448 5.448 1.00 0.00 H new ATOM 0 HB THR A 128 2.751 -2.056 8.462 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.431 -2.448 6.983 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.099 -0.306 7.922 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.706 0.081 7.264 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.430 -0.535 6.189 1.00 0.00 H new ATOM 2008 N GLN A 129 4.691 -0.677 5.454 1.00 0.00 N ATOM 2009 CA GLN A 129 5.768 0.302 5.383 1.00 0.00 C ATOM 2010 C GLN A 129 5.417 1.429 4.417 1.00 0.00 C ATOM 2011 O GLN A 129 4.562 1.269 3.547 1.00 0.00 O ATOM 2012 CB GLN A 129 7.071 -0.372 4.948 1.00 0.00 C ATOM 2013 CG GLN A 129 7.156 -0.621 3.451 1.00 0.00 C ATOM 2014 CD GLN A 129 8.553 -1.002 3.001 1.00 0.00 C ATOM 2015 OE1 GLN A 129 8.998 -2.131 3.211 1.00 0.00 O ATOM 2016 NE2 GLN A 129 9.252 -0.061 2.378 1.00 0.00 N ATOM 0 H GLN A 129 4.074 -0.684 4.642 1.00 0.00 H new ATOM 0 HA GLN A 129 5.903 0.729 6.377 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.912 0.251 5.253 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.172 -1.322 5.472 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.461 -1.416 3.179 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.839 0.276 2.919 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.843 0.861 2.225 1.00 0.00 H new ATOM 0 HE22 GLN A 129 10.198 -0.260 2.052 1.00 0.00 H new ATOM 2025 N TRP A 130 6.083 2.567 4.577 1.00 0.00 N ATOM 2026 CA TRP A 130 5.841 3.721 3.718 1.00 0.00 C ATOM 2027 C TRP A 130 6.687 3.645 2.452 1.00 0.00 C ATOM 2028 O TRP A 130 7.896 3.879 2.487 1.00 0.00 O ATOM 2029 CB TRP A 130 6.145 5.016 4.472 1.00 0.00 C ATOM 2030 CG TRP A 130 5.129 5.343 5.525 1.00 0.00 C ATOM 2031 CD1 TRP A 130 5.117 4.904 6.818 1.00 0.00 C ATOM 2032 CD2 TRP A 130 3.975 6.178 5.372 1.00 0.00 C ATOM 2033 NE1 TRP A 130 4.026 5.415 7.478 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.310 6.200 6.613 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.441 6.910 4.308 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 2.139 6.925 6.817 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.278 7.628 4.512 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.638 7.632 5.758 1.00 0.00 C ATOM 0 H TRP A 130 6.794 2.716 5.293 1.00 0.00 H new ATOM 0 HA TRP A 130 4.790 3.714 3.430 1.00 0.00 H new ATOM 0 HB2 TRP A 130 7.127 4.935 4.938 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.197 5.839 3.759 1.00 0.00 H new ATOM 0 HD1 TRP A 130 5.857 4.251 7.257 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.788 5.239 8.454 1.00 0.00 H new ATOM 0 HE3 TRP A 130 3.928 6.914 3.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.644 6.929 7.777 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 1.855 8.196 3.697 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.731 8.204 5.885 1.00 0.00 H new ATOM 2049 N TYR A 131 6.046 3.316 1.336 1.00 0.00 N ATOM 2050 CA TYR A 131 6.742 3.207 0.059 1.00 0.00 C ATOM 2051 C TYR A 131 7.036 4.587 -0.520 1.00 0.00 C ATOM 2052 O TYR A 131 6.156 5.235 -1.087 1.00 0.00 O ATOM 2053 CB TYR A 131 5.908 2.393 -0.931 1.00 0.00 C ATOM 2054 CG TYR A 131 5.602 0.990 -0.456 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.591 0.196 0.110 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.323 0.461 -0.571 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.316 -1.086 0.545 1.00 0.00 C ATOM 2058 CE2 TYR A 131 4.038 -0.820 -0.138 1.00 0.00 C ATOM 2059 CZ TYR A 131 5.038 -1.589 0.419 1.00 0.00 C ATOM 2060 OH TYR A 131 4.759 -2.865 0.853 1.00 0.00 O ATOM 0 H TYR A 131 5.046 3.120 1.290 1.00 0.00 H new ATOM 0 HA TYR A 131 7.689 2.696 0.232 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.971 2.916 -1.120 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.439 2.338 -1.881 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.592 0.588 0.212 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.538 1.061 -1.006 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.097 -1.691 0.981 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.038 -1.216 -0.235 1.00 0.00 H new ATOM 0 HH TYR A 131 3.825 -2.914 1.146 1.00 0.00 H new ATOM 2070 N ASP A 132 8.280 5.030 -0.374 1.00 0.00 N ATOM 2071 CA ASP A 132 8.692 6.333 -0.884 1.00 0.00 C ATOM 2072 C ASP A 132 8.411 6.445 -2.379 1.00 0.00 C ATOM 2073 O ASP A 132 8.951 5.683 -3.182 1.00 0.00 O ATOM 2074 CB ASP A 132 10.180 6.562 -0.614 1.00 0.00 C ATOM 2075 CG ASP A 132 10.996 5.292 -0.752 1.00 0.00 C ATOM 2076 OD1 ASP A 132 10.624 4.434 -1.580 1.00 0.00 O ATOM 2077 OD2 ASP A 132 12.008 5.156 -0.033 1.00 0.00 O ATOM 0 H ASP A 132 9.020 4.506 0.093 1.00 0.00 H new ATOM 0 HA ASP A 132 8.114 7.098 -0.366 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.561 7.312 -1.307 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.306 6.964 0.391 1.00 0.00 H new ATOM 2082 N LEU A 133 7.562 7.398 -2.747 1.00 0.00 N ATOM 2083 CA LEU A 133 7.208 7.610 -4.146 1.00 0.00 C ATOM 2084 C LEU A 133 8.404 8.128 -4.938 1.00 0.00 C ATOM 2085 O LEU A 133 9.108 9.038 -4.497 1.00 0.00 O ATOM 2086 CB LEU A 133 6.044 8.596 -4.254 1.00 0.00 C ATOM 2087 CG LEU A 133 4.697 8.106 -3.723 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.735 9.271 -3.550 1.00 0.00 C ATOM 2089 CD2 LEU A 133 4.106 7.057 -4.654 1.00 0.00 C ATOM 0 H LEU A 133 7.106 8.037 -2.096 1.00 0.00 H new ATOM 0 HA LEU A 133 6.904 6.652 -4.568 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.314 9.506 -3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.921 8.868 -5.302 1.00 0.00 H new ATOM 0 HG LEU A 133 4.858 7.647 -2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.782 8.902 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.154 9.987 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.579 9.760 -4.512 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.147 6.720 -4.260 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.960 7.490 -5.644 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.787 6.209 -4.726 1.00 0.00 H new ATOM 2101 N THR A 134 8.628 7.545 -6.112 1.00 0.00 N ATOM 2102 CA THR A 134 9.737 7.949 -6.966 1.00 0.00 C ATOM 2103 C THR A 134 9.239 8.430 -8.324 1.00 0.00 C ATOM 2104 O THR A 134 8.054 8.316 -8.636 1.00 0.00 O ATOM 2105 CB THR A 134 10.732 6.792 -7.178 1.00 0.00 C ATOM 2106 OG1 THR A 134 10.065 5.675 -7.776 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.358 6.368 -5.858 1.00 0.00 C ATOM 0 H THR A 134 8.056 6.791 -6.492 1.00 0.00 H new ATOM 0 HA THR A 134 10.245 8.768 -6.458 1.00 0.00 H new ATOM 0 HB THR A 134 11.523 7.140 -7.842 1.00 0.00 H new ATOM 0 HG1 THR A 134 10.705 4.945 -7.909 1.00 0.00 H new ATOM 0 HG21 THR A 134 12.057 5.550 -6.033 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.890 7.212 -5.420 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.576 6.037 -5.174 1.00 0.00 H new ATOM 2115 N GLU A 135 10.151 8.967 -9.128 1.00 0.00 N ATOM 2116 CA GLU A 135 9.802 9.465 -10.453 1.00 0.00 C ATOM 2117 C GLU A 135 9.548 8.312 -11.419 1.00 0.00 C ATOM 2118 O GLU A 135 9.938 7.173 -11.159 1.00 0.00 O ATOM 2119 CB GLU A 135 10.917 10.362 -10.995 1.00 0.00 C ATOM 2120 CG GLU A 135 11.103 11.647 -10.205 1.00 0.00 C ATOM 2121 CD GLU A 135 11.887 12.694 -10.972 1.00 0.00 C ATOM 2122 OE1 GLU A 135 13.042 12.410 -11.352 1.00 0.00 O ATOM 2123 OE2 GLU A 135 11.346 13.798 -11.191 1.00 0.00 O ATOM 0 H GLU A 135 11.136 9.068 -8.885 1.00 0.00 H new ATOM 0 HA GLU A 135 8.886 10.049 -10.363 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.854 9.805 -10.992 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.698 10.612 -12.033 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.126 12.051 -9.941 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.619 11.424 -9.271 1.00 0.00 H new ATOM 2130 N ASP A 136 8.890 8.615 -12.533 1.00 0.00 N ATOM 2131 CA ASP A 136 8.584 7.604 -13.539 1.00 0.00 C ATOM 2132 C ASP A 136 9.861 7.061 -14.170 1.00 0.00 C ATOM 2133 O ASP A 136 10.043 5.848 -14.283 1.00 0.00 O ATOM 2134 CB ASP A 136 7.674 8.190 -14.620 1.00 0.00 C ATOM 2135 CG ASP A 136 7.558 7.285 -15.831 1.00 0.00 C ATOM 2136 OD1 ASP A 136 8.517 7.237 -16.629 1.00 0.00 O ATOM 2137 OD2 ASP A 136 6.508 6.626 -15.982 1.00 0.00 O ATOM 0 H ASP A 136 8.558 9.552 -12.762 1.00 0.00 H new ATOM 0 HA ASP A 136 8.067 6.781 -13.046 1.00 0.00 H new ATOM 0 HB2 ASP A 136 6.682 8.362 -14.202 1.00 0.00 H new ATOM 0 HB3 ASP A 136 8.062 9.160 -14.931 1.00 0.00 H new ATOM 2142 N SER A 137 10.743 7.966 -14.582 1.00 0.00 N ATOM 2143 CA SER A 137 12.002 7.578 -15.208 1.00 0.00 C ATOM 2144 C SER A 137 12.978 7.031 -14.170 1.00 0.00 C ATOM 2145 O SER A 137 13.352 7.725 -13.226 1.00 0.00 O ATOM 2146 CB SER A 137 12.626 8.772 -15.931 1.00 0.00 C ATOM 2147 OG SER A 137 13.704 8.363 -16.755 1.00 0.00 O ATOM 0 H SER A 137 10.609 8.973 -14.494 1.00 0.00 H new ATOM 0 HA SER A 137 11.792 6.793 -15.934 1.00 0.00 H new ATOM 0 HB2 SER A 137 11.869 9.270 -16.537 1.00 0.00 H new ATOM 0 HB3 SER A 137 12.979 9.500 -15.200 1.00 0.00 H new ATOM 0 HG SER A 137 14.085 9.144 -17.207 1.00 0.00 H new ATOM 2153 N GLY A 138 13.387 5.779 -14.354 1.00 0.00 N ATOM 2154 CA GLY A 138 14.315 5.158 -13.427 1.00 0.00 C ATOM 2155 C GLY A 138 15.610 4.741 -14.095 1.00 0.00 C ATOM 2156 O GLY A 138 15.975 5.245 -15.158 1.00 0.00 O ATOM 0 H GLY A 138 13.092 5.184 -15.128 1.00 0.00 H new ATOM 0 HA2 GLY A 138 14.535 5.854 -12.617 1.00 0.00 H new ATOM 0 HA3 GLY A 138 13.844 4.284 -12.977 1.00 0.00 H new ATOM 2160 N PRO A 139 16.330 3.801 -13.466 1.00 0.00 N ATOM 2161 CA PRO A 139 17.603 3.297 -13.988 1.00 0.00 C ATOM 2162 C PRO A 139 17.421 2.454 -15.246 1.00 0.00 C ATOM 2163 O PRO A 139 16.330 1.955 -15.517 1.00 0.00 O ATOM 2164 CB PRO A 139 18.141 2.437 -12.841 1.00 0.00 C ATOM 2165 CG PRO A 139 16.930 2.017 -12.082 1.00 0.00 C ATOM 2166 CD PRO A 139 15.955 3.157 -12.196 1.00 0.00 C ATOM 0 HA PRO A 139 18.272 4.106 -14.283 1.00 0.00 H new ATOM 0 HB2 PRO A 139 18.691 1.575 -13.217 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.827 3.002 -12.210 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.509 1.100 -12.495 1.00 0.00 H new ATOM 0 HG3 PRO A 139 17.174 1.814 -11.039 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.924 2.804 -12.214 1.00 0.00 H new ATOM 0 HD3 PRO A 139 16.042 3.845 -11.355 1.00 0.00 H new ATOM 2174 N SER A 140 18.498 2.301 -16.010 1.00 0.00 N ATOM 2175 CA SER A 140 18.456 1.521 -17.242 1.00 0.00 C ATOM 2176 C SER A 140 18.671 0.038 -16.954 1.00 0.00 C ATOM 2177 O SER A 140 19.429 -0.327 -16.055 1.00 0.00 O ATOM 2178 CB SER A 140 19.518 2.021 -18.223 1.00 0.00 C ATOM 2179 OG SER A 140 19.325 1.462 -19.511 1.00 0.00 O ATOM 0 H SER A 140 19.410 2.706 -15.798 1.00 0.00 H new ATOM 0 HA SER A 140 17.470 1.647 -17.689 1.00 0.00 H new ATOM 0 HB2 SER A 140 19.477 3.108 -18.285 1.00 0.00 H new ATOM 0 HB3 SER A 140 20.510 1.760 -17.854 1.00 0.00 H new ATOM 0 HG SER A 140 20.015 1.798 -20.120 1.00 0.00 H new ATOM 2185 N SER A 141 17.998 -0.811 -17.724 1.00 0.00 N ATOM 2186 CA SER A 141 18.112 -2.254 -17.550 1.00 0.00 C ATOM 2187 C SER A 141 19.455 -2.760 -18.068 1.00 0.00 C ATOM 2188 O SER A 141 20.218 -3.390 -17.336 1.00 0.00 O ATOM 2189 CB SER A 141 16.971 -2.968 -18.277 1.00 0.00 C ATOM 2190 OG SER A 141 15.723 -2.691 -17.665 1.00 0.00 O ATOM 0 H SER A 141 17.369 -0.525 -18.474 1.00 0.00 H new ATOM 0 HA SER A 141 18.048 -2.472 -16.484 1.00 0.00 H new ATOM 0 HB2 SER A 141 16.946 -2.652 -19.320 1.00 0.00 H new ATOM 0 HB3 SER A 141 17.150 -4.043 -18.274 1.00 0.00 H new ATOM 0 HG SER A 141 15.010 -3.158 -18.150 1.00 0.00 H new ATOM 2196 N GLY A 142 19.737 -2.479 -19.336 1.00 0.00 N ATOM 2197 CA GLY A 142 20.988 -2.912 -19.932 1.00 0.00 C ATOM 2198 C GLY A 142 21.257 -2.243 -21.265 1.00 0.00 C ATOM 2199 O GLY A 142 22.203 -2.602 -21.967 1.00 0.00 O ATOM 0 H GLY A 142 19.122 -1.959 -19.962 1.00 0.00 H new ATOM 0 HA2 GLY A 142 21.808 -2.694 -19.247 1.00 0.00 H new ATOM 0 HA3 GLY A 142 20.967 -3.993 -20.069 1.00 0.00 H new TER 2203 GLY A 142