USER MOD reduce.3.24.130724 H: found=0, std=0, add=1189, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1182 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 NoAdj-H: A 44 HIS HE2 : A 44 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 81 HIS HE2 : A 81 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 85 HIS HE2 : A 85 HIS NE2 : A 401 ZNZN :(H bumps) USER MOD NoAdj-H: A 111 HIS HE2 : A 111 HIS NE2 : A 601 ZNZN :(H bumps) USER MOD NoAdj-H: A 141 HIS HE2 : A 141 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD NoAdj-H: A 145 HIS HE2 : A 145 HIS NE2 : A 801 ZNZN :(H bumps) USER MOD Set 1.1: A 119 LYS NZ :NH3+ 158:sc= -7.7! (180deg=-8.55!) USER MOD Set 1.2: A 122 LYS NZ :NH3+ -151:sc= -0.258 (180deg=-1.58!) USER MOD Set 2.1: A 109 LYS NZ :NH3+ -126:sc= -1.94! (180deg=-1.46!) USER MOD Set 2.2: A 112 LYS NZ :NH3+ -146:sc= -2.45 (180deg=-4.4!) USER MOD Set 3.1: A 17 LYS NZ :NH3+ 158:sc= 1.21 (180deg=0) USER MOD Set 3.2: A 30 SER OG : rot -108:sc= 1.05 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 11:sc= 0.294 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.0986 X(o=0.099,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0065) USER MOD Single : A 12 GLN : amide:sc= -8.47! C(o=-8.5!,f=-13!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -8.68! C(o=-8.7!,f=-8.5!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -62:sc= -0.545 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.615 USER MOD Single : A 38 MET CE :methyl 151:sc= -0.77 (180deg=-1.04) USER MOD Single : A 39 HIS : no HD1:sc= -0.0501 X(o=-0.05,f=-0.052) USER MOD Single : A 43 THR OG1 : rot 84:sc= 0.487 USER MOD Single : A 46 THR OG1 : rot 70:sc= 1.18 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HD1:sc= -11! C(o=-11!,f=-11!) USER MOD Single : A 55 GLN :FLIP amide:sc= -0.0105 F(o=-1.2,f=-0.01) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 ASN : amide:sc= -0.755 K(o=-0.75,f=-1.6) USER MOD Single : A 58 HIS : no HD1:sc= -3.25! K(o=-3.2!,f=-4) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= -1.09 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 157:sc= 0.00137 (180deg=-0.0114) USER MOD Single : A 76 TYR OH : rot 180:sc= -0.414 USER MOD Single : A 77 LYS NZ :NH3+ -160:sc= -0.117 (180deg=-0.598) USER MOD Single : A 80 ASN : amide:sc= -4.33! C(o=-4.3!,f=-6.5!) USER MOD Single : A 86 THR OG1 : rot -67:sc= 0.582 USER MOD Single : A 89 LYS NZ :NH3+ 144:sc= -1.25! (180deg=-2.8!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0.00475 USER MOD Single : A 107 ASN : amide:sc=-0.00279 K(o=-0.0028,f=-1.2) USER MOD Single : A 114 THR OG1 : rot -41:sc= 0.00171 USER MOD Single : A 115 HIS : no HE2:sc= -9.25! C(o=-9.3!,f=-14!) USER MOD Single : A 116 THR OG1 : rot -170:sc= -0.199 USER MOD Single : A 134 ASN : amide:sc= -5.35! C(o=-5.3!,f=-9.3!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 MET CE :methyl -132:sc= -3.62 (180deg=-6.46!) USER MOD Single : A 143 HIS : no HD1:sc= -7.56! C(o=-7.6!,f=-9.1!) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 180:sc= -0.0399 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0.0645 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.196 20.111 -56.407 1.00 0.00 N ATOM 2 CA GLY A 1 -16.720 19.055 -57.253 1.00 0.00 C ATOM 3 C GLY A 1 -15.766 17.884 -57.378 1.00 0.00 C ATOM 4 O GLY A 1 -14.655 18.032 -57.888 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.886 20.888 -56.354 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.022 19.737 -55.452 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.304 20.466 -56.807 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.669 18.705 -56.846 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.928 19.458 -58.244 1.00 0.00 H new ATOM 8 N SER A 2 -16.198 16.718 -56.908 1.00 0.00 N ATOM 9 CA SER A 2 -15.371 15.518 -56.965 1.00 0.00 C ATOM 10 C SER A 2 -16.236 14.268 -57.094 1.00 0.00 C ATOM 11 O SER A 2 -17.364 14.227 -56.603 1.00 0.00 O ATOM 12 CB SER A 2 -14.495 15.418 -55.715 1.00 0.00 C ATOM 13 OG SER A 2 -13.391 16.304 -55.793 1.00 0.00 O ATOM 0 H SER A 2 -17.115 16.579 -56.484 1.00 0.00 H new ATOM 0 HA SER A 2 -14.731 15.589 -57.845 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.089 15.650 -54.831 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.137 14.395 -55.599 1.00 0.00 H new ATOM 0 HG SER A 2 -13.513 16.912 -56.551 1.00 0.00 H new ATOM 19 N SER A 3 -15.699 13.251 -57.761 1.00 0.00 N ATOM 20 CA SER A 3 -16.422 12.001 -57.959 1.00 0.00 C ATOM 21 C SER A 3 -15.602 10.814 -57.464 1.00 0.00 C ATOM 22 O SER A 3 -14.389 10.916 -57.282 1.00 0.00 O ATOM 23 CB SER A 3 -16.766 11.815 -59.439 1.00 0.00 C ATOM 24 OG SER A 3 -17.595 12.866 -59.905 1.00 0.00 O ATOM 0 H SER A 3 -14.766 13.269 -58.173 1.00 0.00 H new ATOM 0 HA SER A 3 -17.345 12.049 -57.381 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.849 11.782 -60.028 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.270 10.859 -59.581 1.00 0.00 H new ATOM 0 HG SER A 3 -17.799 12.726 -60.853 1.00 0.00 H new ATOM 30 N GLY A 4 -16.273 9.687 -57.247 1.00 0.00 N ATOM 31 CA GLY A 4 -15.592 8.496 -56.774 1.00 0.00 C ATOM 32 C GLY A 4 -16.171 7.974 -55.474 1.00 0.00 C ATOM 33 O GLY A 4 -17.158 8.507 -54.968 1.00 0.00 O ATOM 0 H GLY A 4 -17.277 9.578 -57.390 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.656 7.718 -57.535 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.534 8.718 -56.634 1.00 0.00 H new ATOM 37 N SER A 5 -15.557 6.927 -54.933 1.00 0.00 N ATOM 38 CA SER A 5 -16.022 6.328 -53.687 1.00 0.00 C ATOM 39 C SER A 5 -14.844 5.954 -52.792 1.00 0.00 C ATOM 40 O SER A 5 -14.080 5.040 -53.102 1.00 0.00 O ATOM 41 CB SER A 5 -16.870 5.088 -53.977 1.00 0.00 C ATOM 42 OG SER A 5 -17.566 5.222 -55.205 1.00 0.00 O ATOM 0 H SER A 5 -14.737 6.476 -55.338 1.00 0.00 H new ATOM 0 HA SER A 5 -16.634 7.064 -53.165 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.230 4.206 -54.012 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.582 4.933 -53.167 1.00 0.00 H new ATOM 0 HG SER A 5 -18.099 4.416 -55.368 1.00 0.00 H new ATOM 48 N SER A 6 -14.705 6.669 -51.680 1.00 0.00 N ATOM 49 CA SER A 6 -13.619 6.416 -50.740 1.00 0.00 C ATOM 50 C SER A 6 -14.163 6.148 -49.340 1.00 0.00 C ATOM 51 O SER A 6 -14.860 6.981 -48.763 1.00 0.00 O ATOM 52 CB SER A 6 -12.657 7.606 -50.707 1.00 0.00 C ATOM 53 OG SER A 6 -11.832 7.563 -49.556 1.00 0.00 O ATOM 0 H SER A 6 -15.330 7.428 -51.408 1.00 0.00 H new ATOM 0 HA SER A 6 -13.079 5.531 -51.076 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.037 7.601 -51.603 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.224 8.537 -50.717 1.00 0.00 H new ATOM 0 HG SER A 6 -11.226 8.333 -49.559 1.00 0.00 H new ATOM 59 N GLY A 7 -13.838 4.977 -48.800 1.00 0.00 N ATOM 60 CA GLY A 7 -14.302 4.619 -47.472 1.00 0.00 C ATOM 61 C GLY A 7 -13.653 5.454 -46.386 1.00 0.00 C ATOM 62 O GLY A 7 -12.728 6.221 -46.654 1.00 0.00 O ATOM 0 H GLY A 7 -13.262 4.271 -49.258 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.384 4.742 -47.423 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.093 3.565 -47.289 1.00 0.00 H new ATOM 66 N GLN A 8 -14.139 5.306 -45.158 1.00 0.00 N ATOM 67 CA GLN A 8 -13.601 6.056 -44.029 1.00 0.00 C ATOM 68 C GLN A 8 -12.658 5.189 -43.200 1.00 0.00 C ATOM 69 O GLN A 8 -12.878 3.992 -43.014 1.00 0.00 O ATOM 70 CB GLN A 8 -14.738 6.579 -43.149 1.00 0.00 C ATOM 71 CG GLN A 8 -14.264 7.172 -41.832 1.00 0.00 C ATOM 72 CD GLN A 8 -15.331 7.132 -40.756 1.00 0.00 C ATOM 73 OE1 GLN A 8 -16.306 7.883 -40.804 1.00 0.00 O ATOM 74 NE2 GLN A 8 -15.153 6.252 -39.778 1.00 0.00 N ATOM 0 H GLN A 8 -14.904 4.674 -44.919 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.037 6.902 -44.422 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -15.294 7.337 -43.700 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -15.431 5.763 -42.942 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -13.386 6.626 -41.488 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -13.955 8.205 -41.993 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -14.330 5.649 -39.778 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -15.839 6.179 -39.027 1.00 0.00 H new ATOM 83 N PRO A 9 -11.582 5.806 -42.689 1.00 0.00 N ATOM 84 CA PRO A 9 -10.585 5.109 -41.871 1.00 0.00 C ATOM 85 C PRO A 9 -11.130 4.715 -40.503 1.00 0.00 C ATOM 86 O PRO A 9 -12.337 4.773 -40.265 1.00 0.00 O ATOM 87 CB PRO A 9 -9.464 6.142 -41.723 1.00 0.00 C ATOM 88 CG PRO A 9 -10.139 7.459 -41.891 1.00 0.00 C ATOM 89 CD PRO A 9 -11.257 7.231 -42.870 1.00 0.00 C ATOM 0 HA PRO A 9 -10.264 4.173 -42.329 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.981 6.066 -40.749 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.689 5.996 -42.475 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -10.523 7.825 -40.939 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -9.442 8.210 -42.263 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -12.115 7.869 -42.657 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -10.946 7.446 -43.892 1.00 0.00 H new ATOM 97 N ILE A 10 -10.234 4.314 -39.608 1.00 0.00 N ATOM 98 CA ILE A 10 -10.626 3.912 -38.263 1.00 0.00 C ATOM 99 C ILE A 10 -10.597 5.097 -37.304 1.00 0.00 C ATOM 100 O ILE A 10 -9.625 5.852 -37.262 1.00 0.00 O ATOM 101 CB ILE A 10 -9.709 2.801 -37.717 1.00 0.00 C ATOM 102 CG1 ILE A 10 -9.489 1.723 -38.780 1.00 0.00 C ATOM 103 CG2 ILE A 10 -10.304 2.195 -36.455 1.00 0.00 C ATOM 104 CD1 ILE A 10 -8.219 0.926 -38.580 1.00 0.00 C ATOM 0 H ILE A 10 -9.232 4.259 -39.790 1.00 0.00 H new ATOM 0 HA ILE A 10 -11.644 3.529 -38.333 1.00 0.00 H new ATOM 0 HB ILE A 10 -8.743 3.239 -37.465 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -10.340 1.042 -38.776 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -9.462 2.194 -39.763 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -9.644 1.412 -36.082 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -10.413 2.970 -35.696 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -11.281 1.769 -36.682 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.129 0.181 -39.370 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -7.360 1.596 -38.614 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -8.252 0.426 -37.612 1.00 0.00 H new ATOM 116 N LYS A 11 -11.667 5.253 -36.532 1.00 0.00 N ATOM 117 CA LYS A 11 -11.764 6.344 -35.570 1.00 0.00 C ATOM 118 C LYS A 11 -11.324 5.887 -34.183 1.00 0.00 C ATOM 119 O LYS A 11 -12.044 5.157 -33.503 1.00 0.00 O ATOM 120 CB LYS A 11 -13.198 6.875 -35.512 1.00 0.00 C ATOM 121 CG LYS A 11 -13.501 7.925 -36.567 1.00 0.00 C ATOM 122 CD LYS A 11 -14.726 8.747 -36.200 1.00 0.00 C ATOM 123 CE LYS A 11 -14.747 10.076 -36.939 1.00 0.00 C ATOM 124 NZ LYS A 11 -14.883 9.891 -38.410 1.00 0.00 N ATOM 0 H LYS A 11 -12.480 4.637 -36.554 1.00 0.00 H new ATOM 0 HA LYS A 11 -11.100 7.144 -35.898 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -13.890 6.042 -35.632 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -13.379 7.301 -34.525 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -12.641 8.584 -36.683 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -13.663 7.439 -37.529 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -15.628 8.183 -36.437 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -14.736 8.927 -35.125 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -15.574 10.683 -36.571 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -13.830 10.625 -36.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -14.910 10.820 -38.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -14.071 9.348 -38.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -15.762 9.375 -38.615 1.00 0.00 H new ATOM 138 N GLN A 12 -10.138 6.323 -33.770 1.00 0.00 N ATOM 139 CA GLN A 12 -9.603 5.958 -32.463 1.00 0.00 C ATOM 140 C GLN A 12 -9.984 6.993 -31.410 1.00 0.00 C ATOM 141 O GLN A 12 -10.053 8.188 -31.698 1.00 0.00 O ATOM 142 CB GLN A 12 -8.081 5.819 -32.532 1.00 0.00 C ATOM 143 CG GLN A 12 -7.336 7.071 -32.097 1.00 0.00 C ATOM 144 CD GLN A 12 -7.541 8.232 -33.050 1.00 0.00 C ATOM 145 OE1 GLN A 12 -8.269 8.120 -34.036 1.00 0.00 O ATOM 146 NE2 GLN A 12 -6.899 9.358 -32.758 1.00 0.00 N ATOM 0 H GLN A 12 -9.530 6.929 -34.321 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.036 4.999 -32.176 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.772 4.985 -31.902 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -7.793 5.571 -33.554 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.670 7.360 -31.101 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.271 6.849 -32.024 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -6.305 9.407 -31.930 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -7.000 10.174 -33.362 1.00 0.00 H new ATOM 155 N GLU A 13 -10.231 6.527 -30.190 1.00 0.00 N ATOM 156 CA GLU A 13 -10.606 7.414 -29.095 1.00 0.00 C ATOM 157 C GLU A 13 -9.369 7.951 -28.382 1.00 0.00 C ATOM 158 O GLU A 13 -8.362 7.254 -28.251 1.00 0.00 O ATOM 159 CB GLU A 13 -11.504 6.678 -28.099 1.00 0.00 C ATOM 160 CG GLU A 13 -10.736 5.847 -27.085 1.00 0.00 C ATOM 161 CD GLU A 13 -11.588 4.765 -26.451 1.00 0.00 C ATOM 162 OE1 GLU A 13 -12.743 5.062 -26.081 1.00 0.00 O ATOM 163 OE2 GLU A 13 -11.100 3.623 -26.325 1.00 0.00 O ATOM 0 H GLU A 13 -10.178 5.541 -29.935 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.156 8.256 -29.515 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.118 7.406 -27.569 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.185 6.028 -28.648 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.877 5.388 -27.574 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -10.347 6.501 -26.305 1.00 0.00 H new ATOM 170 N LEU A 14 -9.452 9.194 -27.922 1.00 0.00 N ATOM 171 CA LEU A 14 -8.340 9.827 -27.222 1.00 0.00 C ATOM 172 C LEU A 14 -8.656 9.998 -25.739 1.00 0.00 C ATOM 173 O LEU A 14 -9.799 9.830 -25.315 1.00 0.00 O ATOM 174 CB LEU A 14 -8.025 11.187 -27.847 1.00 0.00 C ATOM 175 CG LEU A 14 -8.089 11.254 -29.373 1.00 0.00 C ATOM 176 CD1 LEU A 14 -7.631 12.618 -29.867 1.00 0.00 C ATOM 177 CD2 LEU A 14 -7.244 10.150 -29.992 1.00 0.00 C ATOM 0 H LEU A 14 -10.278 9.784 -28.021 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.468 9.179 -27.317 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.721 11.921 -27.441 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -7.026 11.487 -27.531 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.124 11.107 -29.680 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.683 12.647 -30.955 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.277 13.391 -29.452 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.604 12.794 -29.548 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -7.302 10.213 -31.079 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -6.207 10.265 -29.676 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.617 9.179 -29.665 1.00 0.00 H new ATOM 189 N SER A 15 -7.636 10.334 -24.956 1.00 0.00 N ATOM 190 CA SER A 15 -7.804 10.526 -23.521 1.00 0.00 C ATOM 191 C SER A 15 -6.985 11.717 -23.032 1.00 0.00 C ATOM 192 O SER A 15 -5.786 11.810 -23.294 1.00 0.00 O ATOM 193 CB SER A 15 -7.390 9.263 -22.764 1.00 0.00 C ATOM 194 OG SER A 15 -7.959 8.106 -23.352 1.00 0.00 O ATOM 0 H SER A 15 -6.684 10.479 -25.292 1.00 0.00 H new ATOM 0 HA SER A 15 -8.858 10.728 -23.328 1.00 0.00 H new ATOM 0 HB2 SER A 15 -6.303 9.177 -22.762 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.706 9.339 -21.724 1.00 0.00 H new ATOM 0 HG SER A 15 -7.678 7.312 -22.851 1.00 0.00 H new ATOM 200 N CYS A 16 -7.642 12.626 -22.320 1.00 0.00 N ATOM 201 CA CYS A 16 -6.978 13.813 -21.794 1.00 0.00 C ATOM 202 C CYS A 16 -7.133 13.896 -20.279 1.00 0.00 C ATOM 203 O CYS A 16 -8.161 14.345 -19.772 1.00 0.00 O ATOM 204 CB CYS A 16 -7.549 15.074 -22.446 1.00 0.00 C ATOM 205 SG CYS A 16 -7.200 16.608 -21.528 1.00 0.00 S ATOM 0 H CYS A 16 -8.635 12.563 -22.094 1.00 0.00 H new ATOM 0 HA CYS A 16 -5.916 13.739 -22.030 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -7.142 15.165 -23.453 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -8.628 14.961 -22.547 1.00 0.00 H new ATOM 210 N LYS A 17 -6.104 13.459 -19.560 1.00 0.00 N ATOM 211 CA LYS A 17 -6.123 13.485 -18.102 1.00 0.00 C ATOM 212 C LYS A 17 -5.479 14.762 -17.572 1.00 0.00 C ATOM 213 O LYS A 17 -4.255 14.855 -17.471 1.00 0.00 O ATOM 214 CB LYS A 17 -5.394 12.262 -17.540 1.00 0.00 C ATOM 215 CG LYS A 17 -5.733 10.968 -18.260 1.00 0.00 C ATOM 216 CD LYS A 17 -7.225 10.685 -18.226 1.00 0.00 C ATOM 217 CE LYS A 17 -7.626 9.964 -16.948 1.00 0.00 C ATOM 218 NZ LYS A 17 -9.105 9.850 -16.816 1.00 0.00 N ATOM 0 H LYS A 17 -5.246 13.083 -19.964 1.00 0.00 H new ATOM 0 HA LYS A 17 -7.163 13.462 -17.777 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.319 12.431 -17.600 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.641 12.156 -16.484 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -5.397 11.028 -19.295 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -5.194 10.141 -17.797 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -7.776 11.622 -18.305 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.501 10.079 -19.089 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -7.183 8.968 -16.938 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -7.225 10.500 -16.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -9.337 9.066 -16.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.489 10.737 -16.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -9.524 9.667 -17.750 1.00 0.00 H new ATOM 232 N TRP A 18 -6.309 15.742 -17.234 1.00 0.00 N ATOM 233 CA TRP A 18 -5.819 17.013 -16.713 1.00 0.00 C ATOM 234 C TRP A 18 -6.116 17.141 -15.223 1.00 0.00 C ATOM 235 O TRP A 18 -7.270 17.059 -14.802 1.00 0.00 O ATOM 236 CB TRP A 18 -6.454 18.178 -17.474 1.00 0.00 C ATOM 237 CG TRP A 18 -5.770 19.489 -17.231 1.00 0.00 C ATOM 238 CD1 TRP A 18 -5.787 20.221 -16.078 1.00 0.00 C ATOM 239 CD2 TRP A 18 -4.969 20.224 -18.163 1.00 0.00 C ATOM 240 NE1 TRP A 18 -5.046 21.367 -16.237 1.00 0.00 N ATOM 241 CE2 TRP A 18 -4.533 21.392 -17.507 1.00 0.00 C ATOM 242 CE3 TRP A 18 -4.577 20.009 -19.486 1.00 0.00 C ATOM 243 CZ2 TRP A 18 -3.726 22.339 -18.132 1.00 0.00 C ATOM 244 CZ3 TRP A 18 -3.776 20.950 -20.105 1.00 0.00 C ATOM 245 CH2 TRP A 18 -3.356 22.103 -19.428 1.00 0.00 C ATOM 0 H TRP A 18 -7.324 15.681 -17.311 1.00 0.00 H new ATOM 0 HA TRP A 18 -4.738 17.043 -16.853 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -6.435 17.959 -18.542 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -7.501 18.264 -17.185 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.307 19.940 -15.174 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -4.901 22.083 -15.525 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -4.894 19.123 -20.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.403 23.229 -17.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.468 20.794 -21.128 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -2.729 22.819 -19.939 1.00 0.00 H new ATOM 256 N ILE A 19 -5.069 17.342 -14.431 1.00 0.00 N ATOM 257 CA ILE A 19 -5.219 17.483 -12.988 1.00 0.00 C ATOM 258 C ILE A 19 -4.614 18.794 -12.497 1.00 0.00 C ATOM 259 O ILE A 19 -3.401 18.900 -12.315 1.00 0.00 O ATOM 260 CB ILE A 19 -4.558 16.312 -12.236 1.00 0.00 C ATOM 261 CG1 ILE A 19 -5.033 14.976 -12.811 1.00 0.00 C ATOM 262 CG2 ILE A 19 -4.867 16.395 -10.749 1.00 0.00 C ATOM 263 CD1 ILE A 19 -4.807 13.804 -11.881 1.00 0.00 C ATOM 0 H ILE A 19 -4.107 17.411 -14.764 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.289 17.480 -12.781 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.478 16.379 -12.366 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.096 15.046 -13.042 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -4.514 14.789 -13.751 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.393 15.561 -10.232 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.484 17.334 -10.350 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.946 16.350 -10.598 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.167 12.890 -12.353 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -3.742 13.708 -11.669 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.349 13.969 -10.950 1.00 0.00 H new ATOM 275 N ASP A 20 -5.468 19.789 -12.283 1.00 0.00 N ATOM 276 CA ASP A 20 -5.018 21.093 -11.810 1.00 0.00 C ATOM 277 C ASP A 20 -4.857 21.095 -10.293 1.00 0.00 C ATOM 278 O ASP A 20 -5.831 20.948 -9.556 1.00 0.00 O ATOM 279 CB ASP A 20 -6.007 22.181 -12.231 1.00 0.00 C ATOM 280 CG ASP A 20 -5.440 23.576 -12.062 1.00 0.00 C ATOM 281 OD1 ASP A 20 -4.452 23.729 -11.313 1.00 0.00 O ATOM 282 OD2 ASP A 20 -5.983 24.516 -12.680 1.00 0.00 O ATOM 0 H ASP A 20 -6.475 19.718 -12.429 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.048 21.300 -12.261 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.287 22.030 -13.274 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.918 22.088 -11.640 1.00 0.00 H new ATOM 287 N GLU A 21 -3.620 21.261 -9.834 1.00 0.00 N ATOM 288 CA GLU A 21 -3.332 21.280 -8.405 1.00 0.00 C ATOM 289 C GLU A 21 -4.420 22.028 -7.640 1.00 0.00 C ATOM 290 O GLU A 21 -4.718 21.707 -6.491 1.00 0.00 O ATOM 291 CB GLU A 21 -1.972 21.930 -8.145 1.00 0.00 C ATOM 292 CG GLU A 21 -0.824 21.256 -8.878 1.00 0.00 C ATOM 293 CD GLU A 21 -0.154 20.179 -8.048 1.00 0.00 C ATOM 294 OE1 GLU A 21 -0.322 20.194 -6.810 1.00 0.00 O ATOM 295 OE2 GLU A 21 0.540 19.322 -8.634 1.00 0.00 O ATOM 0 H GLU A 21 -2.802 21.384 -10.431 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.307 20.249 -8.052 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.017 22.978 -8.443 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.769 21.911 -7.074 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.197 20.817 -9.803 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.085 22.007 -9.157 1.00 0.00 H new ATOM 302 N ALA A 22 -5.009 23.028 -8.288 1.00 0.00 N ATOM 303 CA ALA A 22 -6.065 23.822 -7.671 1.00 0.00 C ATOM 304 C ALA A 22 -7.429 23.466 -8.252 1.00 0.00 C ATOM 305 O ALA A 22 -8.257 24.344 -8.494 1.00 0.00 O ATOM 306 CB ALA A 22 -5.783 25.306 -7.850 1.00 0.00 C ATOM 0 H ALA A 22 -4.773 23.308 -9.240 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.082 23.594 -6.605 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.580 25.886 -7.384 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.831 25.555 -7.381 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.736 25.542 -8.913 1.00 0.00 H new ATOM 312 N GLN A 23 -7.655 22.176 -8.472 1.00 0.00 N ATOM 313 CA GLN A 23 -8.920 21.706 -9.026 1.00 0.00 C ATOM 314 C GLN A 23 -10.100 22.389 -8.344 1.00 0.00 C ATOM 315 O GLN A 23 -9.936 23.070 -7.331 1.00 0.00 O ATOM 316 CB GLN A 23 -9.036 20.188 -8.874 1.00 0.00 C ATOM 317 CG GLN A 23 -8.302 19.641 -7.659 1.00 0.00 C ATOM 318 CD GLN A 23 -6.881 19.222 -7.976 1.00 0.00 C ATOM 319 OE1 GLN A 23 -5.941 19.591 -7.272 1.00 0.00 O ATOM 320 NE2 GLN A 23 -6.715 18.446 -9.041 1.00 0.00 N ATOM 0 H GLN A 23 -6.980 21.437 -8.276 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.940 21.960 -10.086 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -10.090 19.917 -8.804 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.643 19.710 -9.771 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -8.287 20.400 -6.876 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -8.849 18.785 -7.263 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -7.522 18.163 -9.597 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -5.780 18.133 -9.303 1.00 0.00 H new ATOM 329 N LEU A 24 -11.290 22.204 -8.905 1.00 0.00 N ATOM 330 CA LEU A 24 -12.499 22.802 -8.351 1.00 0.00 C ATOM 331 C LEU A 24 -13.298 21.777 -7.553 1.00 0.00 C ATOM 332 O LEU A 24 -14.200 22.132 -6.794 1.00 0.00 O ATOM 333 CB LEU A 24 -13.366 23.380 -9.472 1.00 0.00 C ATOM 334 CG LEU A 24 -14.378 24.448 -9.055 1.00 0.00 C ATOM 335 CD1 LEU A 24 -13.671 25.754 -8.726 1.00 0.00 C ATOM 336 CD2 LEU A 24 -15.411 24.660 -10.151 1.00 0.00 C ATOM 0 H LEU A 24 -11.443 21.644 -9.744 1.00 0.00 H new ATOM 0 HA LEU A 24 -12.201 23.606 -7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.708 23.807 -10.229 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.907 22.560 -9.945 1.00 0.00 H new ATOM 0 HG LEU A 24 -14.894 24.103 -8.159 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -14.407 26.502 -8.431 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -12.970 25.592 -7.907 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -13.128 26.105 -9.604 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -16.123 25.423 -9.837 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -14.911 24.983 -11.064 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -15.940 23.725 -10.338 1.00 0.00 H new ATOM 348 N SER A 25 -12.958 20.504 -7.727 1.00 0.00 N ATOM 349 CA SER A 25 -13.645 19.426 -7.024 1.00 0.00 C ATOM 350 C SER A 25 -12.701 18.725 -6.052 1.00 0.00 C ATOM 351 O SER A 25 -11.509 19.027 -6.000 1.00 0.00 O ATOM 352 CB SER A 25 -14.209 18.415 -8.024 1.00 0.00 C ATOM 353 OG SER A 25 -15.392 17.812 -7.526 1.00 0.00 O ATOM 0 H SER A 25 -12.211 20.194 -8.348 1.00 0.00 H new ATOM 0 HA SER A 25 -14.467 19.861 -6.456 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.421 18.914 -8.970 1.00 0.00 H new ATOM 0 HB3 SER A 25 -13.464 17.647 -8.229 1.00 0.00 H new ATOM 0 HG SER A 25 -15.734 17.171 -8.184 1.00 0.00 H new ATOM 359 N ARG A 26 -13.245 17.787 -5.282 1.00 0.00 N ATOM 360 CA ARG A 26 -12.453 17.043 -4.310 1.00 0.00 C ATOM 361 C ARG A 26 -13.026 15.645 -4.099 1.00 0.00 C ATOM 362 O ARG A 26 -14.234 15.458 -3.952 1.00 0.00 O ATOM 363 CB ARG A 26 -12.406 17.793 -2.978 1.00 0.00 C ATOM 364 CG ARG A 26 -11.301 17.316 -2.049 1.00 0.00 C ATOM 365 CD ARG A 26 -9.928 17.724 -2.561 1.00 0.00 C ATOM 366 NE ARG A 26 -9.557 19.066 -2.119 1.00 0.00 N ATOM 367 CZ ARG A 26 -9.840 20.169 -2.802 1.00 0.00 C ATOM 368 NH1 ARG A 26 -10.496 20.091 -3.952 1.00 0.00 N ATOM 369 NH2 ARG A 26 -9.469 21.354 -2.334 1.00 0.00 N ATOM 0 H ARG A 26 -14.230 17.525 -5.313 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.440 16.947 -4.701 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -12.270 18.857 -3.174 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -13.366 17.682 -2.474 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.457 17.731 -1.053 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.347 16.231 -1.954 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.183 17.008 -2.212 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -9.921 17.686 -3.650 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.053 19.161 -1.237 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -10.785 19.182 -4.314 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -10.712 20.940 -4.474 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -8.966 21.418 -1.449 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -9.687 22.201 -2.859 1.00 0.00 H new ATOM 383 N PRO A 27 -12.140 14.638 -4.084 1.00 0.00 N ATOM 384 CA PRO A 27 -10.700 14.848 -4.258 1.00 0.00 C ATOM 385 C PRO A 27 -10.344 15.270 -5.680 1.00 0.00 C ATOM 386 O PRO A 27 -11.216 15.638 -6.466 1.00 0.00 O ATOM 387 CB PRO A 27 -10.100 13.476 -3.942 1.00 0.00 C ATOM 388 CG PRO A 27 -11.194 12.508 -4.234 1.00 0.00 C ATOM 389 CD PRO A 27 -12.476 13.216 -3.895 1.00 0.00 C ATOM 0 HA PRO A 27 -10.325 15.649 -3.621 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.221 13.277 -4.556 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.783 13.413 -2.901 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -11.180 12.208 -5.282 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -11.081 11.601 -3.641 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -13.292 12.905 -4.548 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -12.791 13.010 -2.872 1.00 0.00 H new ATOM 397 N LYS A 28 -9.056 15.214 -6.004 1.00 0.00 N ATOM 398 CA LYS A 28 -8.584 15.588 -7.331 1.00 0.00 C ATOM 399 C LYS A 28 -9.016 14.560 -8.372 1.00 0.00 C ATOM 400 O LYS A 28 -8.868 13.355 -8.169 1.00 0.00 O ATOM 401 CB LYS A 28 -7.059 15.722 -7.333 1.00 0.00 C ATOM 402 CG LYS A 28 -6.500 16.334 -6.060 1.00 0.00 C ATOM 403 CD LYS A 28 -5.061 16.785 -6.244 1.00 0.00 C ATOM 404 CE LYS A 28 -4.647 17.778 -5.168 1.00 0.00 C ATOM 405 NZ LYS A 28 -4.369 17.104 -3.869 1.00 0.00 N ATOM 0 H LYS A 28 -8.321 14.913 -5.365 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.028 16.549 -7.590 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.616 14.736 -7.477 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.758 16.334 -8.183 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.114 17.185 -5.764 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.553 15.606 -5.251 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.400 15.919 -6.215 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -4.944 17.242 -7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.758 18.318 -5.495 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -5.437 18.517 -5.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.090 17.814 -3.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.224 16.610 -3.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.598 16.417 -3.992 1.00 0.00 H new ATOM 419 N LYS A 29 -9.549 15.044 -9.489 1.00 0.00 N ATOM 420 CA LYS A 29 -10.000 14.169 -10.564 1.00 0.00 C ATOM 421 C LYS A 29 -9.506 14.670 -11.917 1.00 0.00 C ATOM 422 O LYS A 29 -9.104 15.825 -12.053 1.00 0.00 O ATOM 423 CB LYS A 29 -11.528 14.078 -10.568 1.00 0.00 C ATOM 424 CG LYS A 29 -12.149 14.211 -9.188 1.00 0.00 C ATOM 425 CD LYS A 29 -13.614 13.806 -9.195 1.00 0.00 C ATOM 426 CE LYS A 29 -13.778 12.306 -9.005 1.00 0.00 C ATOM 427 NZ LYS A 29 -15.140 11.955 -8.515 1.00 0.00 N ATOM 0 H LYS A 29 -9.679 16.039 -9.673 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.584 13.177 -10.390 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.928 14.859 -11.214 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -11.826 13.123 -11.001 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -11.602 13.589 -8.480 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -12.057 15.241 -8.844 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -14.143 14.334 -8.401 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -14.071 14.107 -10.138 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -13.590 11.797 -9.951 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.033 11.946 -8.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -15.212 10.924 -8.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -15.310 12.420 -7.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -15.850 12.276 -9.204 1.00 0.00 H new ATOM 441 N SER A 30 -9.541 13.793 -12.916 1.00 0.00 N ATOM 442 CA SER A 30 -9.094 14.147 -14.259 1.00 0.00 C ATOM 443 C SER A 30 -10.242 14.730 -15.077 1.00 0.00 C ATOM 444 O SER A 30 -11.386 14.286 -14.969 1.00 0.00 O ATOM 445 CB SER A 30 -8.520 12.919 -14.968 1.00 0.00 C ATOM 446 OG SER A 30 -9.518 11.932 -15.168 1.00 0.00 O ATOM 0 H SER A 30 -9.874 12.833 -12.821 1.00 0.00 H new ATOM 0 HA SER A 30 -8.314 14.903 -14.169 1.00 0.00 H new ATOM 0 HB2 SER A 30 -8.098 13.214 -15.929 1.00 0.00 H new ATOM 0 HB3 SER A 30 -7.705 12.502 -14.377 1.00 0.00 H new ATOM 0 HG SER A 30 -9.358 11.177 -14.564 1.00 0.00 H new ATOM 452 N CYS A 31 -9.929 15.728 -15.896 1.00 0.00 N ATOM 453 CA CYS A 31 -10.932 16.374 -16.734 1.00 0.00 C ATOM 454 C CYS A 31 -11.876 15.343 -17.346 1.00 0.00 C ATOM 455 O CYS A 31 -13.023 15.651 -17.670 1.00 0.00 O ATOM 456 CB CYS A 31 -10.257 17.185 -17.841 1.00 0.00 C ATOM 457 SG CYS A 31 -10.141 16.312 -19.436 1.00 0.00 S ATOM 0 H CYS A 31 -8.988 16.107 -15.997 1.00 0.00 H new ATOM 0 HA CYS A 31 -11.516 17.046 -16.105 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -10.810 18.113 -17.986 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -9.254 17.460 -17.515 1.00 0.00 H new ATOM 462 N ASP A 32 -11.385 14.119 -17.501 1.00 0.00 N ATOM 463 CA ASP A 32 -12.183 13.041 -18.073 1.00 0.00 C ATOM 464 C ASP A 32 -12.723 13.433 -19.445 1.00 0.00 C ATOM 465 O ASP A 32 -13.924 13.346 -19.699 1.00 0.00 O ATOM 466 CB ASP A 32 -13.341 12.685 -17.139 1.00 0.00 C ATOM 467 CG ASP A 32 -13.785 11.243 -17.290 1.00 0.00 C ATOM 468 OD1 ASP A 32 -14.671 10.979 -18.129 1.00 0.00 O ATOM 469 OD2 ASP A 32 -13.244 10.378 -16.570 1.00 0.00 O ATOM 0 H ASP A 32 -10.437 13.848 -17.238 1.00 0.00 H new ATOM 0 HA ASP A 32 -11.539 12.169 -18.191 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -13.039 12.863 -16.107 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -14.184 13.345 -17.343 1.00 0.00 H new ATOM 474 N ARG A 33 -11.826 13.866 -20.325 1.00 0.00 N ATOM 475 CA ARG A 33 -12.212 14.274 -21.671 1.00 0.00 C ATOM 476 C ARG A 33 -11.679 13.293 -22.711 1.00 0.00 C ATOM 477 O ARG A 33 -10.643 12.658 -22.508 1.00 0.00 O ATOM 478 CB ARG A 33 -11.692 15.682 -21.969 1.00 0.00 C ATOM 479 CG ARG A 33 -12.141 16.224 -23.316 1.00 0.00 C ATOM 480 CD ARG A 33 -13.480 16.937 -23.212 1.00 0.00 C ATOM 481 NE ARG A 33 -14.603 16.006 -23.292 1.00 0.00 N ATOM 482 CZ ARG A 33 -15.857 16.342 -23.010 1.00 0.00 C ATOM 483 NH1 ARG A 33 -16.146 17.579 -22.632 1.00 0.00 N ATOM 484 NH2 ARG A 33 -16.824 15.439 -23.107 1.00 0.00 N ATOM 0 H ARG A 33 -10.828 13.943 -20.130 1.00 0.00 H new ATOM 0 HA ARG A 33 -13.301 14.277 -21.724 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.029 16.359 -21.184 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -10.603 15.673 -21.935 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.389 16.913 -23.701 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.218 15.405 -24.031 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -13.528 17.483 -22.270 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.562 17.673 -24.011 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.414 15.046 -23.580 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.405 18.276 -22.557 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -17.110 17.834 -22.416 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -16.605 14.486 -23.398 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -17.787 15.697 -22.890 1.00 0.00 H new ATOM 498 N THR A 34 -12.394 13.173 -23.825 1.00 0.00 N ATOM 499 CA THR A 34 -11.995 12.268 -24.896 1.00 0.00 C ATOM 500 C THR A 34 -12.430 12.800 -26.256 1.00 0.00 C ATOM 501 O THR A 34 -13.304 13.663 -26.346 1.00 0.00 O ATOM 502 CB THR A 34 -12.589 10.862 -24.693 1.00 0.00 C ATOM 503 OG1 THR A 34 -13.956 10.962 -24.280 1.00 0.00 O ATOM 504 CG2 THR A 34 -11.795 10.084 -23.654 1.00 0.00 C ATOM 0 H THR A 34 -13.253 13.691 -24.009 1.00 0.00 H new ATOM 0 HA THR A 34 -10.907 12.203 -24.866 1.00 0.00 H new ATOM 0 HB THR A 34 -12.535 10.329 -25.642 1.00 0.00 H new ATOM 0 HG1 THR A 34 -14.326 10.063 -24.155 1.00 0.00 H new ATOM 0 HG21 THR A 34 -12.233 9.094 -23.528 1.00 0.00 H new ATOM 0 HG22 THR A 34 -10.762 9.984 -23.986 1.00 0.00 H new ATOM 0 HG23 THR A 34 -11.821 10.616 -22.703 1.00 0.00 H new ATOM 512 N PHE A 35 -11.817 12.280 -27.314 1.00 0.00 N ATOM 513 CA PHE A 35 -12.141 12.703 -28.671 1.00 0.00 C ATOM 514 C PHE A 35 -11.872 11.582 -29.670 1.00 0.00 C ATOM 515 O PHE A 35 -11.288 10.555 -29.324 1.00 0.00 O ATOM 516 CB PHE A 35 -11.329 13.944 -29.049 1.00 0.00 C ATOM 517 CG PHE A 35 -11.475 15.076 -28.072 1.00 0.00 C ATOM 518 CD1 PHE A 35 -12.501 15.998 -28.208 1.00 0.00 C ATOM 519 CD2 PHE A 35 -10.587 15.218 -27.018 1.00 0.00 C ATOM 520 CE1 PHE A 35 -12.636 17.041 -27.312 1.00 0.00 C ATOM 521 CE2 PHE A 35 -10.718 16.259 -26.118 1.00 0.00 C ATOM 522 CZ PHE A 35 -11.745 17.171 -26.265 1.00 0.00 C ATOM 0 H PHE A 35 -11.092 11.564 -27.257 1.00 0.00 H new ATOM 0 HA PHE A 35 -13.203 12.948 -28.704 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -10.276 13.671 -29.122 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -11.639 14.285 -30.037 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -13.203 15.900 -29.023 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -9.783 14.507 -26.898 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -13.438 17.754 -27.430 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -10.019 16.359 -25.301 1.00 0.00 H new ATOM 0 HZ PHE A 35 -11.851 17.984 -25.562 1.00 0.00 H new ATOM 532 N SER A 36 -12.302 11.786 -30.910 1.00 0.00 N ATOM 533 CA SER A 36 -12.112 10.791 -31.959 1.00 0.00 C ATOM 534 C SER A 36 -10.854 11.090 -32.770 1.00 0.00 C ATOM 535 O SER A 36 -10.113 10.182 -33.147 1.00 0.00 O ATOM 536 CB SER A 36 -13.331 10.754 -32.883 1.00 0.00 C ATOM 537 OG SER A 36 -13.294 11.817 -33.820 1.00 0.00 O ATOM 0 H SER A 36 -12.785 12.632 -31.214 1.00 0.00 H new ATOM 0 HA SER A 36 -11.995 9.817 -31.485 1.00 0.00 H new ATOM 0 HB2 SER A 36 -13.362 9.801 -33.411 1.00 0.00 H new ATOM 0 HB3 SER A 36 -14.243 10.820 -32.290 1.00 0.00 H new ATOM 0 HG SER A 36 -13.326 12.673 -33.345 1.00 0.00 H new ATOM 543 N THR A 37 -10.619 12.372 -33.035 1.00 0.00 N ATOM 544 CA THR A 37 -9.453 12.792 -33.801 1.00 0.00 C ATOM 545 C THR A 37 -8.463 13.550 -32.924 1.00 0.00 C ATOM 546 O THR A 37 -8.833 14.101 -31.888 1.00 0.00 O ATOM 547 CB THR A 37 -9.854 13.684 -34.991 1.00 0.00 C ATOM 548 OG1 THR A 37 -9.892 15.056 -34.584 1.00 0.00 O ATOM 549 CG2 THR A 37 -11.213 13.274 -35.540 1.00 0.00 C ATOM 0 H THR A 37 -11.221 13.137 -32.730 1.00 0.00 H new ATOM 0 HA THR A 37 -8.980 11.886 -34.179 1.00 0.00 H new ATOM 0 HB THR A 37 -9.109 13.560 -35.777 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.146 15.617 -35.347 1.00 0.00 H new ATOM 0 HG21 THR A 37 -11.475 13.918 -36.380 1.00 0.00 H new ATOM 0 HG22 THR A 37 -11.172 12.238 -35.876 1.00 0.00 H new ATOM 0 HG23 THR A 37 -11.966 13.372 -34.758 1.00 0.00 H new ATOM 557 N MET A 38 -7.203 13.574 -33.346 1.00 0.00 N ATOM 558 CA MET A 38 -6.160 14.267 -32.599 1.00 0.00 C ATOM 559 C MET A 38 -6.496 15.746 -32.441 1.00 0.00 C ATOM 560 O MET A 38 -6.549 16.265 -31.325 1.00 0.00 O ATOM 561 CB MET A 38 -4.810 14.111 -33.301 1.00 0.00 C ATOM 562 CG MET A 38 -3.645 14.691 -32.516 1.00 0.00 C ATOM 563 SD MET A 38 -3.647 14.176 -30.788 1.00 0.00 S ATOM 564 CE MET A 38 -3.846 12.405 -30.963 1.00 0.00 C ATOM 0 H MET A 38 -6.880 13.122 -34.201 1.00 0.00 H new ATOM 0 HA MET A 38 -6.099 13.818 -31.607 1.00 0.00 H new ATOM 0 HB2 MET A 38 -4.624 13.052 -33.482 1.00 0.00 H new ATOM 0 HB3 MET A 38 -4.858 14.597 -34.275 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.709 14.383 -32.982 1.00 0.00 H new ATOM 0 HG3 MET A 38 -3.683 15.779 -32.567 1.00 0.00 H new ATOM 0 HE1 MET A 38 -3.373 11.901 -30.120 1.00 0.00 H new ATOM 0 HE2 MET A 38 -4.908 12.159 -30.984 1.00 0.00 H new ATOM 0 HE3 MET A 38 -3.378 12.076 -31.891 1.00 0.00 H new ATOM 574 N HIS A 39 -6.723 16.420 -33.564 1.00 0.00 N ATOM 575 CA HIS A 39 -7.054 17.841 -33.549 1.00 0.00 C ATOM 576 C HIS A 39 -8.054 18.154 -32.440 1.00 0.00 C ATOM 577 O HIS A 39 -7.958 19.188 -31.780 1.00 0.00 O ATOM 578 CB HIS A 39 -7.625 18.267 -34.902 1.00 0.00 C ATOM 579 CG HIS A 39 -6.700 18.008 -36.051 1.00 0.00 C ATOM 580 ND1 HIS A 39 -7.057 17.258 -37.151 1.00 0.00 N ATOM 581 CD2 HIS A 39 -5.424 18.407 -36.267 1.00 0.00 C ATOM 582 CE1 HIS A 39 -6.041 17.205 -37.994 1.00 0.00 C ATOM 583 NE2 HIS A 39 -5.038 17.895 -37.482 1.00 0.00 N ATOM 0 H HIS A 39 -6.684 16.006 -34.495 1.00 0.00 H new ATOM 0 HA HIS A 39 -6.138 18.401 -33.357 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -8.562 17.738 -35.074 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -7.861 19.331 -34.869 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -4.822 19.014 -35.607 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -6.032 16.686 -38.941 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -4.125 18.026 -37.918 1.00 0.00 H new ATOM 591 N GLU A 40 -9.012 17.254 -32.242 1.00 0.00 N ATOM 592 CA GLU A 40 -10.030 17.436 -31.214 1.00 0.00 C ATOM 593 C GLU A 40 -9.401 17.456 -29.823 1.00 0.00 C ATOM 594 O GLU A 40 -9.761 18.276 -28.978 1.00 0.00 O ATOM 595 CB GLU A 40 -11.076 16.323 -31.297 1.00 0.00 C ATOM 596 CG GLU A 40 -12.027 16.468 -32.473 1.00 0.00 C ATOM 597 CD GLU A 40 -13.275 15.620 -32.322 1.00 0.00 C ATOM 598 OE1 GLU A 40 -13.143 14.380 -32.246 1.00 0.00 O ATOM 599 OE2 GLU A 40 -14.382 16.195 -32.281 1.00 0.00 O ATOM 0 H GLU A 40 -9.104 16.392 -32.780 1.00 0.00 H new ATOM 0 HA GLU A 40 -10.517 18.395 -31.388 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -10.567 15.362 -31.369 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.654 16.309 -30.373 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -12.314 17.514 -32.577 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -11.510 16.187 -33.390 1.00 0.00 H new ATOM 606 N LEU A 41 -8.460 16.547 -29.593 1.00 0.00 N ATOM 607 CA LEU A 41 -7.781 16.458 -28.305 1.00 0.00 C ATOM 608 C LEU A 41 -6.889 17.674 -28.075 1.00 0.00 C ATOM 609 O LEU A 41 -6.940 18.303 -27.018 1.00 0.00 O ATOM 610 CB LEU A 41 -6.946 15.178 -28.234 1.00 0.00 C ATOM 611 CG LEU A 41 -5.862 15.143 -27.156 1.00 0.00 C ATOM 612 CD1 LEU A 41 -6.473 15.347 -25.778 1.00 0.00 C ATOM 613 CD2 LEU A 41 -5.096 13.829 -27.213 1.00 0.00 C ATOM 0 H LEU A 41 -8.150 15.861 -30.281 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.540 16.434 -27.523 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.620 14.337 -28.071 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.472 15.023 -29.203 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.162 15.957 -27.344 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.687 15.319 -25.024 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.976 16.313 -25.742 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.195 14.555 -25.579 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.329 13.821 -26.439 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.784 12.999 -27.050 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.626 13.724 -28.191 1.00 0.00 H new ATOM 625 N VAL A 42 -6.073 18.001 -29.073 1.00 0.00 N ATOM 626 CA VAL A 42 -5.172 19.143 -28.981 1.00 0.00 C ATOM 627 C VAL A 42 -5.945 20.434 -28.731 1.00 0.00 C ATOM 628 O VAL A 42 -5.669 21.162 -27.778 1.00 0.00 O ATOM 629 CB VAL A 42 -4.332 19.300 -30.262 1.00 0.00 C ATOM 630 CG1 VAL A 42 -3.468 20.550 -30.184 1.00 0.00 C ATOM 631 CG2 VAL A 42 -3.477 18.064 -30.492 1.00 0.00 C ATOM 0 H VAL A 42 -6.018 17.491 -29.954 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.505 18.953 -28.140 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.009 19.408 -31.109 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.881 20.644 -31.098 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.106 21.427 -30.070 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -2.797 20.476 -29.328 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.890 18.192 -31.401 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.807 17.922 -29.644 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.121 17.190 -30.596 1.00 0.00 H new ATOM 641 N THR A 43 -6.917 20.711 -29.595 1.00 0.00 N ATOM 642 CA THR A 43 -7.731 21.914 -29.470 1.00 0.00 C ATOM 643 C THR A 43 -8.322 22.034 -28.070 1.00 0.00 C ATOM 644 O THR A 43 -8.564 23.138 -27.580 1.00 0.00 O ATOM 645 CB THR A 43 -8.874 21.929 -30.501 1.00 0.00 C ATOM 646 OG1 THR A 43 -8.340 22.054 -31.824 1.00 0.00 O ATOM 647 CG2 THR A 43 -9.836 23.075 -30.227 1.00 0.00 C ATOM 0 H THR A 43 -7.160 20.118 -30.389 1.00 0.00 H new ATOM 0 HA THR A 43 -7.073 22.762 -29.658 1.00 0.00 H new ATOM 0 HB THR A 43 -9.420 20.989 -30.417 1.00 0.00 H new ATOM 0 HG1 THR A 43 -8.077 21.170 -32.155 1.00 0.00 H new ATOM 0 HG21 THR A 43 -10.635 23.065 -30.969 1.00 0.00 H new ATOM 0 HG22 THR A 43 -10.264 22.961 -29.231 1.00 0.00 H new ATOM 0 HG23 THR A 43 -9.300 24.022 -30.285 1.00 0.00 H new ATOM 655 N HIS A 44 -8.553 20.892 -27.430 1.00 0.00 N ATOM 656 CA HIS A 44 -9.115 20.870 -26.084 1.00 0.00 C ATOM 657 C HIS A 44 -8.032 21.114 -25.038 1.00 0.00 C ATOM 658 O HIS A 44 -8.073 22.102 -24.305 1.00 0.00 O ATOM 659 CB HIS A 44 -9.805 19.531 -25.819 1.00 0.00 C ATOM 660 CG HIS A 44 -10.121 19.297 -24.374 1.00 0.00 C ATOM 661 ND1 HIS A 44 -11.310 19.683 -23.792 1.00 0.00 N ATOM 662 CD2 HIS A 44 -9.397 18.709 -23.393 1.00 0.00 C ATOM 663 CE1 HIS A 44 -11.302 19.346 -22.515 1.00 0.00 C ATOM 664 NE2 HIS A 44 -10.152 18.752 -22.247 1.00 0.00 N ATOM 0 H HIS A 44 -8.360 19.970 -27.822 1.00 0.00 H new ATOM 0 HA HIS A 44 -9.851 21.671 -26.011 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -10.728 19.487 -26.396 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -9.166 18.725 -26.178 1.00 0.00 H new ATOM 0 HD1 HIS A 44 -12.076 20.155 -24.273 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.409 18.285 -23.493 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -12.100 19.525 -21.809 1.00 0.00 H new ATOM 672 N VAL A 45 -7.063 20.206 -24.975 1.00 0.00 N ATOM 673 CA VAL A 45 -5.968 20.323 -24.019 1.00 0.00 C ATOM 674 C VAL A 45 -5.266 21.669 -24.149 1.00 0.00 C ATOM 675 O VAL A 45 -4.603 22.130 -23.218 1.00 0.00 O ATOM 676 CB VAL A 45 -4.934 19.197 -24.209 1.00 0.00 C ATOM 677 CG1 VAL A 45 -3.902 19.224 -23.092 1.00 0.00 C ATOM 678 CG2 VAL A 45 -5.626 17.844 -24.273 1.00 0.00 C ATOM 0 H VAL A 45 -7.014 19.382 -25.574 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.407 20.240 -23.025 1.00 0.00 H new ATOM 0 HB VAL A 45 -4.415 19.360 -25.154 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.180 18.421 -23.244 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -3.384 20.183 -23.098 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -4.401 19.087 -22.133 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.881 17.060 -24.407 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -6.172 17.670 -23.346 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.322 17.831 -25.112 1.00 0.00 H new ATOM 688 N THR A 46 -5.416 22.299 -25.310 1.00 0.00 N ATOM 689 CA THR A 46 -4.796 23.594 -25.563 1.00 0.00 C ATOM 690 C THR A 46 -5.748 24.735 -25.224 1.00 0.00 C ATOM 691 O THR A 46 -5.427 25.604 -24.414 1.00 0.00 O ATOM 692 CB THR A 46 -4.354 23.728 -27.032 1.00 0.00 C ATOM 693 OG1 THR A 46 -3.623 22.563 -27.432 1.00 0.00 O ATOM 694 CG2 THR A 46 -3.492 24.966 -27.228 1.00 0.00 C ATOM 0 H THR A 46 -5.962 21.933 -26.090 1.00 0.00 H new ATOM 0 HA THR A 46 -3.918 23.655 -24.920 1.00 0.00 H new ATOM 0 HB THR A 46 -5.247 23.826 -27.649 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.233 21.798 -27.491 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.192 25.039 -28.273 1.00 0.00 H new ATOM 0 HG22 THR A 46 -4.061 25.853 -26.951 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.604 24.894 -26.600 1.00 0.00 H new ATOM 702 N MET A 47 -6.921 24.726 -25.849 1.00 0.00 N ATOM 703 CA MET A 47 -7.921 25.760 -25.611 1.00 0.00 C ATOM 704 C MET A 47 -8.817 25.390 -24.433 1.00 0.00 C ATOM 705 O MET A 47 -9.027 26.195 -23.526 1.00 0.00 O ATOM 706 CB MET A 47 -8.771 25.975 -26.865 1.00 0.00 C ATOM 707 CG MET A 47 -7.961 26.002 -28.151 1.00 0.00 C ATOM 708 SD MET A 47 -8.877 26.710 -29.534 1.00 0.00 S ATOM 709 CE MET A 47 -7.618 27.745 -30.279 1.00 0.00 C ATOM 0 H MET A 47 -7.202 24.014 -26.524 1.00 0.00 H new ATOM 0 HA MET A 47 -7.399 26.686 -25.371 1.00 0.00 H new ATOM 0 HB2 MET A 47 -9.515 25.181 -26.930 1.00 0.00 H new ATOM 0 HB3 MET A 47 -9.315 26.914 -26.768 1.00 0.00 H new ATOM 0 HG2 MET A 47 -7.050 26.579 -27.990 1.00 0.00 H new ATOM 0 HG3 MET A 47 -7.655 24.987 -28.404 1.00 0.00 H new ATOM 0 HE1 MET A 47 -8.032 28.252 -31.150 1.00 0.00 H new ATOM 0 HE2 MET A 47 -7.281 28.486 -29.554 1.00 0.00 H new ATOM 0 HE3 MET A 47 -6.774 27.127 -30.586 1.00 0.00 H new ATOM 719 N GLU A 48 -9.342 24.169 -24.455 1.00 0.00 N ATOM 720 CA GLU A 48 -10.215 23.695 -23.388 1.00 0.00 C ATOM 721 C GLU A 48 -9.426 23.457 -22.104 1.00 0.00 C ATOM 722 O GLU A 48 -9.971 22.984 -21.106 1.00 0.00 O ATOM 723 CB GLU A 48 -10.921 22.405 -23.812 1.00 0.00 C ATOM 724 CG GLU A 48 -11.826 22.575 -25.020 1.00 0.00 C ATOM 725 CD GLU A 48 -13.244 22.951 -24.639 1.00 0.00 C ATOM 726 OE1 GLU A 48 -13.913 22.139 -23.966 1.00 0.00 O ATOM 727 OE2 GLU A 48 -13.685 24.058 -25.013 1.00 0.00 O ATOM 0 H GLU A 48 -9.178 23.491 -25.199 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.963 24.465 -23.197 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -10.171 21.647 -24.035 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -11.512 22.033 -22.975 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -11.413 23.344 -25.673 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -11.841 21.647 -25.591 1.00 0.00 H new ATOM 734 N HIS A 49 -8.140 23.790 -22.137 1.00 0.00 N ATOM 735 CA HIS A 49 -7.275 23.613 -20.975 1.00 0.00 C ATOM 736 C HIS A 49 -6.266 24.753 -20.871 1.00 0.00 C ATOM 737 O HIS A 49 -6.393 25.632 -20.019 1.00 0.00 O ATOM 738 CB HIS A 49 -6.542 22.273 -21.058 1.00 0.00 C ATOM 739 CG HIS A 49 -7.226 21.169 -20.312 1.00 0.00 C ATOM 740 ND1 HIS A 49 -8.029 21.389 -19.213 1.00 0.00 N ATOM 741 CD2 HIS A 49 -7.224 19.831 -20.514 1.00 0.00 C ATOM 742 CE1 HIS A 49 -8.490 20.233 -18.770 1.00 0.00 C ATOM 743 NE2 HIS A 49 -8.017 19.272 -19.543 1.00 0.00 N ATOM 0 H HIS A 49 -7.674 24.183 -22.954 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.900 23.622 -20.082 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.444 21.986 -22.105 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.533 22.395 -20.665 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -6.697 19.302 -21.294 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.143 20.097 -17.920 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -8.210 18.276 -19.436 1.00 0.00 H new ATOM 751 N VAL A 50 -5.263 24.730 -21.743 1.00 0.00 N ATOM 752 CA VAL A 50 -4.232 25.762 -21.750 1.00 0.00 C ATOM 753 C VAL A 50 -4.796 27.099 -22.217 1.00 0.00 C ATOM 754 O VAL A 50 -4.092 28.108 -22.238 1.00 0.00 O ATOM 755 CB VAL A 50 -3.051 25.369 -22.657 1.00 0.00 C ATOM 756 CG1 VAL A 50 -2.108 26.548 -22.846 1.00 0.00 C ATOM 757 CG2 VAL A 50 -2.312 24.171 -22.081 1.00 0.00 C ATOM 0 H VAL A 50 -5.142 24.008 -22.454 1.00 0.00 H new ATOM 0 HA VAL A 50 -3.875 25.860 -20.725 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.444 25.088 -23.634 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.280 26.252 -23.490 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.648 27.375 -23.307 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.720 26.863 -21.877 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.481 23.907 -22.735 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.930 24.421 -21.091 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.995 23.325 -22.003 1.00 0.00 H new ATOM 767 N GLY A 51 -6.072 27.099 -22.591 1.00 0.00 N ATOM 768 CA GLY A 51 -6.709 28.318 -23.053 1.00 0.00 C ATOM 769 C GLY A 51 -6.147 28.801 -24.375 1.00 0.00 C ATOM 770 O GLY A 51 -5.536 28.032 -25.116 1.00 0.00 O ATOM 0 H GLY A 51 -6.675 26.277 -22.582 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -7.780 28.147 -23.158 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.583 29.097 -22.302 1.00 0.00 H new ATOM 774 N GLY A 52 -6.357 30.080 -24.674 1.00 0.00 N ATOM 775 CA GLY A 52 -5.862 30.641 -25.918 1.00 0.00 C ATOM 776 C GLY A 52 -4.664 31.546 -25.709 1.00 0.00 C ATOM 777 O GLY A 52 -4.032 31.541 -24.653 1.00 0.00 O ATOM 0 H GLY A 52 -6.860 30.737 -24.078 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.588 29.831 -26.595 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.660 31.205 -26.402 1.00 0.00 H new ATOM 781 N PRO A 53 -4.336 32.345 -26.735 1.00 0.00 N ATOM 782 CA PRO A 53 -3.203 33.274 -26.683 1.00 0.00 C ATOM 783 C PRO A 53 -3.449 34.437 -25.729 1.00 0.00 C ATOM 784 O PRO A 53 -2.601 35.315 -25.575 1.00 0.00 O ATOM 785 CB PRO A 53 -3.092 33.779 -28.124 1.00 0.00 C ATOM 786 CG PRO A 53 -4.462 33.621 -28.687 1.00 0.00 C ATOM 787 CD PRO A 53 -5.045 32.404 -28.024 1.00 0.00 C ATOM 0 HA PRO A 53 -2.298 32.792 -26.314 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.769 34.819 -28.155 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -2.362 33.201 -28.691 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -5.070 34.503 -28.487 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -4.427 33.497 -29.769 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -6.122 32.499 -27.886 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -4.877 31.505 -28.616 1.00 0.00 H new ATOM 795 N GLU A 54 -4.615 34.436 -25.090 1.00 0.00 N ATOM 796 CA GLU A 54 -4.972 35.493 -24.151 1.00 0.00 C ATOM 797 C GLU A 54 -4.382 35.216 -22.771 1.00 0.00 C ATOM 798 O GLU A 54 -3.687 36.058 -22.203 1.00 0.00 O ATOM 799 CB GLU A 54 -6.494 35.623 -24.050 1.00 0.00 C ATOM 800 CG GLU A 54 -7.120 36.361 -25.222 1.00 0.00 C ATOM 801 CD GLU A 54 -8.635 36.297 -25.209 1.00 0.00 C ATOM 802 OE1 GLU A 54 -9.181 35.195 -24.992 1.00 0.00 O ATOM 803 OE2 GLU A 54 -9.274 37.350 -25.415 1.00 0.00 O ATOM 0 H GLU A 54 -5.328 33.716 -25.205 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.558 36.430 -24.523 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.932 34.627 -23.983 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.745 36.145 -23.127 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -6.804 37.404 -25.201 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -6.750 35.935 -26.154 1.00 0.00 H new ATOM 810 N GLN A 55 -4.666 34.032 -22.239 1.00 0.00 N ATOM 811 CA GLN A 55 -4.165 33.645 -20.926 1.00 0.00 C ATOM 812 C GLN A 55 -2.742 34.152 -20.716 1.00 0.00 C ATOM 813 O GLN A 55 -1.960 34.245 -21.661 1.00 0.00 O ATOM 814 CB GLN A 55 -4.206 32.124 -20.769 1.00 0.00 C ATOM 815 CG GLN A 55 -5.566 31.592 -20.346 1.00 0.00 C ATOM 816 CD GLN A 55 -5.712 31.494 -18.840 1.00 0.00 C ATOM 817 OE1 GLN A 55 -4.934 32.291 -18.117 1.00 0.00 O flip ATOM 818 NE2 GLN A 55 -6.514 30.710 -18.333 1.00 0.00 N flip ATOM 0 H GLN A 55 -5.240 33.324 -22.697 1.00 0.00 H new ATOM 0 HA GLN A 55 -4.808 34.098 -20.171 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -3.922 31.662 -21.715 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -3.462 31.823 -20.031 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -6.346 32.243 -20.741 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.720 30.607 -20.787 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -7.092 30.116 -18.928 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -6.601 30.654 -17.318 1.00 0.00 H new ATOM 827 N ASN A 56 -2.413 34.478 -19.470 1.00 0.00 N ATOM 828 CA ASN A 56 -1.084 34.977 -19.136 1.00 0.00 C ATOM 829 C ASN A 56 -0.112 33.823 -18.909 1.00 0.00 C ATOM 830 O ASN A 56 0.810 33.612 -19.695 1.00 0.00 O ATOM 831 CB ASN A 56 -1.146 35.859 -17.887 1.00 0.00 C ATOM 832 CG ASN A 56 -1.977 37.109 -18.103 1.00 0.00 C ATOM 833 OD1 ASN A 56 -1.452 38.162 -18.466 1.00 0.00 O ATOM 834 ND2 ASN A 56 -3.282 36.999 -17.880 1.00 0.00 N ATOM 0 H ASN A 56 -3.048 34.406 -18.675 1.00 0.00 H new ATOM 0 HA ASN A 56 -0.725 35.573 -19.975 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -1.566 35.285 -17.061 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -0.135 36.144 -17.596 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -3.891 37.807 -18.009 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -3.675 36.107 -17.580 1.00 0.00 H new ATOM 841 N ASN A 57 -0.325 33.080 -17.828 1.00 0.00 N ATOM 842 CA ASN A 57 0.532 31.948 -17.497 1.00 0.00 C ATOM 843 C ASN A 57 -0.009 30.659 -18.108 1.00 0.00 C ATOM 844 O ASN A 57 -1.139 30.255 -17.832 1.00 0.00 O ATOM 845 CB ASN A 57 0.649 31.796 -15.979 1.00 0.00 C ATOM 846 CG ASN A 57 -0.527 31.047 -15.381 1.00 0.00 C ATOM 847 OD1 ASN A 57 -1.673 31.485 -15.483 1.00 0.00 O ATOM 848 ND2 ASN A 57 -0.246 29.911 -14.752 1.00 0.00 N ATOM 0 H ASN A 57 -1.084 33.242 -17.166 1.00 0.00 H new ATOM 0 HA ASN A 57 1.521 32.140 -17.913 1.00 0.00 H new ATOM 0 HB2 ASN A 57 1.572 31.268 -15.739 1.00 0.00 H new ATOM 0 HB3 ASN A 57 0.718 32.783 -15.522 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -0.995 29.363 -14.329 1.00 0.00 H new ATOM 0 HD22 ASN A 57 0.719 29.586 -14.692 1.00 0.00 H new ATOM 855 N HIS A 58 0.805 30.018 -18.940 1.00 0.00 N ATOM 856 CA HIS A 58 0.409 28.773 -19.590 1.00 0.00 C ATOM 857 C HIS A 58 1.167 27.587 -19.002 1.00 0.00 C ATOM 858 O HIS A 58 2.357 27.407 -19.262 1.00 0.00 O ATOM 859 CB HIS A 58 0.660 28.857 -21.096 1.00 0.00 C ATOM 860 CG HIS A 58 0.092 30.090 -21.730 1.00 0.00 C ATOM 861 ND1 HIS A 58 0.848 30.967 -22.479 1.00 0.00 N ATOM 862 CD2 HIS A 58 -1.166 30.589 -21.725 1.00 0.00 C ATOM 863 CE1 HIS A 58 0.079 31.954 -22.905 1.00 0.00 C ATOM 864 NE2 HIS A 58 -1.148 31.748 -22.462 1.00 0.00 N ATOM 0 H HIS A 58 1.743 30.340 -19.180 1.00 0.00 H new ATOM 0 HA HIS A 58 -0.656 28.624 -19.414 1.00 0.00 H new ATOM 0 HB2 HIS A 58 1.734 28.826 -21.279 1.00 0.00 H new ATOM 0 HB3 HIS A 58 0.229 27.979 -21.577 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -2.025 30.156 -21.233 1.00 0.00 H new ATOM 0 HE1 HIS A 58 0.400 32.788 -23.512 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -1.951 32.351 -22.638 1.00 0.00 H new ATOM 872 N VAL A 59 0.471 26.782 -18.206 1.00 0.00 N ATOM 873 CA VAL A 59 1.078 25.613 -17.581 1.00 0.00 C ATOM 874 C VAL A 59 0.108 24.438 -17.553 1.00 0.00 C ATOM 875 O VAL A 59 -0.955 24.510 -16.935 1.00 0.00 O ATOM 876 CB VAL A 59 1.536 25.920 -16.143 1.00 0.00 C ATOM 877 CG1 VAL A 59 2.141 24.682 -15.499 1.00 0.00 C ATOM 878 CG2 VAL A 59 2.529 27.073 -16.135 1.00 0.00 C ATOM 0 H VAL A 59 -0.514 26.918 -17.979 1.00 0.00 H new ATOM 0 HA VAL A 59 1.947 25.348 -18.183 1.00 0.00 H new ATOM 0 HB VAL A 59 0.665 26.216 -15.559 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.459 24.919 -14.484 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.397 23.886 -15.470 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.002 24.353 -16.081 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.842 27.276 -15.111 1.00 0.00 H new ATOM 0 HG22 VAL A 59 3.400 26.808 -16.735 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.058 27.962 -16.554 1.00 0.00 H new ATOM 888 N CYS A 60 0.480 23.354 -18.226 1.00 0.00 N ATOM 889 CA CYS A 60 -0.357 22.162 -18.280 1.00 0.00 C ATOM 890 C CYS A 60 -0.050 21.229 -17.112 1.00 0.00 C ATOM 891 O CYS A 60 1.069 20.733 -16.977 1.00 0.00 O ATOM 892 CB CYS A 60 -0.147 21.425 -19.604 1.00 0.00 C ATOM 893 SG CYS A 60 -0.049 19.613 -19.440 1.00 0.00 S ATOM 0 H CYS A 60 1.357 23.277 -18.742 1.00 0.00 H new ATOM 0 HA CYS A 60 -1.398 22.476 -18.208 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -0.965 21.674 -20.280 1.00 0.00 H new ATOM 0 HB3 CYS A 60 0.771 21.787 -20.067 1.00 0.00 H new ATOM 898 N TYR A 61 -1.051 20.994 -16.271 1.00 0.00 N ATOM 899 CA TYR A 61 -0.888 20.123 -15.113 1.00 0.00 C ATOM 900 C TYR A 61 -1.397 18.716 -15.414 1.00 0.00 C ATOM 901 O TYR A 61 -2.593 18.444 -15.318 1.00 0.00 O ATOM 902 CB TYR A 61 -1.631 20.699 -13.906 1.00 0.00 C ATOM 903 CG TYR A 61 -1.274 22.137 -13.606 1.00 0.00 C ATOM 904 CD1 TYR A 61 -1.687 23.166 -14.444 1.00 0.00 C ATOM 905 CD2 TYR A 61 -0.523 22.467 -12.485 1.00 0.00 C ATOM 906 CE1 TYR A 61 -1.363 24.481 -14.173 1.00 0.00 C ATOM 907 CE2 TYR A 61 -0.195 23.780 -12.206 1.00 0.00 C ATOM 908 CZ TYR A 61 -0.617 24.783 -13.053 1.00 0.00 C ATOM 909 OH TYR A 61 -0.292 26.092 -12.779 1.00 0.00 O ATOM 0 H TYR A 61 -1.984 21.394 -16.369 1.00 0.00 H new ATOM 0 HA TYR A 61 0.176 20.064 -14.882 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -2.704 20.629 -14.083 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -1.412 20.089 -13.030 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -2.271 22.933 -15.322 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -0.190 21.684 -11.820 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -1.692 25.269 -14.835 1.00 0.00 H new ATOM 0 HE2 TYR A 61 0.389 24.019 -11.329 1.00 0.00 H new ATOM 0 HH TYR A 61 0.235 26.132 -11.954 1.00 0.00 H new ATOM 919 N TRP A 62 -0.479 17.828 -15.777 1.00 0.00 N ATOM 920 CA TRP A 62 -0.834 16.448 -16.092 1.00 0.00 C ATOM 921 C TRP A 62 -0.767 15.572 -14.846 1.00 0.00 C ATOM 922 O TRP A 62 0.074 15.782 -13.974 1.00 0.00 O ATOM 923 CB TRP A 62 0.098 15.894 -17.171 1.00 0.00 C ATOM 924 CG TRP A 62 -0.571 14.913 -18.086 1.00 0.00 C ATOM 925 CD1 TRP A 62 -0.530 13.551 -17.998 1.00 0.00 C ATOM 926 CD2 TRP A 62 -1.378 15.219 -19.228 1.00 0.00 C ATOM 927 NE1 TRP A 62 -1.263 12.992 -19.016 1.00 0.00 N ATOM 928 CE2 TRP A 62 -1.794 13.994 -19.784 1.00 0.00 C ATOM 929 CE3 TRP A 62 -1.791 16.409 -19.834 1.00 0.00 C ATOM 930 CZ2 TRP A 62 -2.602 13.927 -20.917 1.00 0.00 C ATOM 931 CZ3 TRP A 62 -2.592 16.340 -20.958 1.00 0.00 C ATOM 932 CH2 TRP A 62 -2.991 15.107 -21.490 1.00 0.00 C ATOM 0 H TRP A 62 0.516 18.038 -15.861 1.00 0.00 H new ATOM 0 HA TRP A 62 -1.858 16.438 -16.466 1.00 0.00 H new ATOM 0 HB2 TRP A 62 0.491 16.722 -17.762 1.00 0.00 H new ATOM 0 HB3 TRP A 62 0.950 15.411 -16.692 1.00 0.00 H new ATOM 0 HD1 TRP A 62 0.001 12.995 -17.239 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -1.391 11.993 -19.174 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -1.490 17.365 -19.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -2.910 12.977 -21.328 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -2.916 17.253 -21.435 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -3.618 15.087 -22.369 1.00 0.00 H new ATOM 943 N GLU A 63 -1.659 14.588 -14.771 1.00 0.00 N ATOM 944 CA GLU A 63 -1.700 13.681 -13.631 1.00 0.00 C ATOM 945 C GLU A 63 -0.307 13.145 -13.311 1.00 0.00 C ATOM 946 O GLU A 63 -0.058 12.650 -12.213 1.00 0.00 O ATOM 947 CB GLU A 63 -2.653 12.517 -13.910 1.00 0.00 C ATOM 948 CG GLU A 63 -2.423 11.312 -13.014 1.00 0.00 C ATOM 949 CD GLU A 63 -1.313 10.412 -13.521 1.00 0.00 C ATOM 950 OE1 GLU A 63 -1.219 10.219 -14.751 1.00 0.00 O ATOM 951 OE2 GLU A 63 -0.537 9.901 -12.686 1.00 0.00 O ATOM 0 H GLU A 63 -2.362 14.400 -15.486 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.063 14.240 -12.769 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.680 12.861 -13.785 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.544 12.211 -14.951 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.178 11.653 -12.008 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.346 10.737 -12.940 1.00 0.00 H new ATOM 958 N GLU A 64 0.597 13.249 -14.281 1.00 0.00 N ATOM 959 CA GLU A 64 1.964 12.774 -14.103 1.00 0.00 C ATOM 960 C GLU A 64 2.919 13.498 -15.048 1.00 0.00 C ATOM 961 O GLU A 64 3.889 12.916 -15.535 1.00 0.00 O ATOM 962 CB GLU A 64 2.039 11.264 -14.343 1.00 0.00 C ATOM 963 CG GLU A 64 1.623 10.850 -15.745 1.00 0.00 C ATOM 964 CD GLU A 64 1.883 9.382 -16.020 1.00 0.00 C ATOM 965 OE1 GLU A 64 2.178 8.641 -15.059 1.00 0.00 O ATOM 966 OE2 GLU A 64 1.793 8.973 -17.197 1.00 0.00 O ATOM 0 H GLU A 64 0.407 13.657 -15.196 1.00 0.00 H new ATOM 0 HA GLU A 64 2.264 12.987 -13.077 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.059 10.926 -14.161 1.00 0.00 H new ATOM 0 HB3 GLU A 64 1.401 10.757 -13.619 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.562 11.059 -15.882 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.164 11.454 -16.474 1.00 0.00 H new ATOM 973 N CYS A 65 2.636 14.770 -15.304 1.00 0.00 N ATOM 974 CA CYS A 65 3.467 15.575 -16.192 1.00 0.00 C ATOM 975 C CYS A 65 4.921 15.570 -15.728 1.00 0.00 C ATOM 976 O CYS A 65 5.222 15.705 -14.542 1.00 0.00 O ATOM 977 CB CYS A 65 2.945 17.012 -16.250 1.00 0.00 C ATOM 978 SG CYS A 65 3.180 17.824 -17.864 1.00 0.00 S ATOM 0 H CYS A 65 1.837 15.266 -14.909 1.00 0.00 H new ATOM 0 HA CYS A 65 3.419 15.137 -17.189 1.00 0.00 H new ATOM 0 HB2 CYS A 65 1.882 17.011 -16.007 1.00 0.00 H new ATOM 0 HB3 CYS A 65 3.447 17.601 -15.482 1.00 0.00 H new ATOM 983 N PRO A 66 5.847 15.409 -16.686 1.00 0.00 N ATOM 984 CA PRO A 66 7.284 15.383 -16.401 1.00 0.00 C ATOM 985 C PRO A 66 7.817 16.748 -15.979 1.00 0.00 C ATOM 986 O PRO A 66 8.720 16.842 -15.148 1.00 0.00 O ATOM 987 CB PRO A 66 7.903 14.957 -17.736 1.00 0.00 C ATOM 988 CG PRO A 66 6.912 15.382 -18.764 1.00 0.00 C ATOM 989 CD PRO A 66 5.560 15.242 -18.121 1.00 0.00 C ATOM 0 HA PRO A 66 7.523 14.716 -15.572 1.00 0.00 H new ATOM 0 HB2 PRO A 66 8.869 15.436 -17.895 1.00 0.00 H new ATOM 0 HB3 PRO A 66 8.071 13.881 -17.769 1.00 0.00 H new ATOM 0 HG2 PRO A 66 7.091 16.411 -19.076 1.00 0.00 H new ATOM 0 HG3 PRO A 66 6.985 14.761 -19.657 1.00 0.00 H new ATOM 0 HD2 PRO A 66 4.863 15.998 -18.482 1.00 0.00 H new ATOM 0 HD3 PRO A 66 5.113 14.270 -18.331 1.00 0.00 H new ATOM 997 N ARG A 67 7.251 17.803 -16.557 1.00 0.00 N ATOM 998 CA ARG A 67 7.670 19.163 -16.240 1.00 0.00 C ATOM 999 C ARG A 67 7.304 19.524 -14.804 1.00 0.00 C ATOM 1000 O ARG A 67 7.653 20.599 -14.316 1.00 0.00 O ATOM 1001 CB ARG A 67 7.025 20.156 -17.208 1.00 0.00 C ATOM 1002 CG ARG A 67 5.535 19.930 -17.409 1.00 0.00 C ATOM 1003 CD ARG A 67 4.716 21.082 -16.847 1.00 0.00 C ATOM 1004 NE ARG A 67 4.780 22.266 -17.700 1.00 0.00 N ATOM 1005 CZ ARG A 67 4.048 22.421 -18.798 1.00 0.00 C ATOM 1006 NH1 ARG A 67 3.201 21.472 -19.174 1.00 0.00 N ATOM 1007 NH2 ARG A 67 4.162 23.527 -19.522 1.00 0.00 N ATOM 0 H ARG A 67 6.502 17.742 -17.247 1.00 0.00 H new ATOM 0 HA ARG A 67 8.754 19.217 -16.344 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.183 21.168 -16.836 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.528 20.089 -18.173 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.323 19.816 -18.472 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.238 19.000 -16.924 1.00 0.00 H new ATOM 0 HD2 ARG A 67 3.678 20.769 -16.738 1.00 0.00 H new ATOM 0 HD3 ARG A 67 5.079 21.333 -15.850 1.00 0.00 H new ATOM 0 HE ARG A 67 5.422 23.015 -17.439 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.110 20.621 -18.620 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.640 21.594 -20.017 1.00 0.00 H new ATOM 0 HH21 ARG A 67 4.812 24.259 -19.236 1.00 0.00 H new ATOM 0 HH22 ARG A 67 3.600 23.645 -20.365 1.00 0.00 H new ATOM 1021 N GLU A 68 6.597 18.620 -14.133 1.00 0.00 N ATOM 1022 CA GLU A 68 6.183 18.844 -12.753 1.00 0.00 C ATOM 1023 C GLU A 68 5.757 20.295 -12.543 1.00 0.00 C ATOM 1024 O GLU A 68 6.129 20.925 -11.554 1.00 0.00 O ATOM 1025 CB GLU A 68 7.319 18.490 -11.792 1.00 0.00 C ATOM 1026 CG GLU A 68 7.582 16.998 -11.684 1.00 0.00 C ATOM 1027 CD GLU A 68 8.659 16.667 -10.670 1.00 0.00 C ATOM 1028 OE1 GLU A 68 9.791 17.173 -10.819 1.00 0.00 O ATOM 1029 OE2 GLU A 68 8.370 15.902 -9.726 1.00 0.00 O ATOM 0 H GLU A 68 6.299 17.726 -14.523 1.00 0.00 H new ATOM 0 HA GLU A 68 5.329 18.198 -12.547 1.00 0.00 H new ATOM 0 HB2 GLU A 68 8.231 18.988 -12.121 1.00 0.00 H new ATOM 0 HB3 GLU A 68 7.082 18.881 -10.803 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.659 16.489 -11.407 1.00 0.00 H new ATOM 0 HG3 GLU A 68 7.877 16.613 -12.660 1.00 0.00 H new ATOM 1036 N GLY A 69 4.974 20.818 -13.481 1.00 0.00 N ATOM 1037 CA GLY A 69 4.511 22.190 -13.381 1.00 0.00 C ATOM 1038 C GLY A 69 5.632 23.194 -13.558 1.00 0.00 C ATOM 1039 O GLY A 69 5.619 24.265 -12.949 1.00 0.00 O ATOM 0 H GLY A 69 4.652 20.316 -14.309 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.745 22.368 -14.136 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.041 22.342 -12.409 1.00 0.00 H new ATOM 1043 N LYS A 70 6.606 22.850 -14.393 1.00 0.00 N ATOM 1044 CA LYS A 70 7.741 23.729 -14.649 1.00 0.00 C ATOM 1045 C LYS A 70 7.418 24.727 -15.757 1.00 0.00 C ATOM 1046 O LYS A 70 7.805 24.536 -16.910 1.00 0.00 O ATOM 1047 CB LYS A 70 8.973 22.906 -15.033 1.00 0.00 C ATOM 1048 CG LYS A 70 10.016 23.697 -15.804 1.00 0.00 C ATOM 1049 CD LYS A 70 11.400 23.533 -15.198 1.00 0.00 C ATOM 1050 CE LYS A 70 12.072 22.256 -15.680 1.00 0.00 C ATOM 1051 NZ LYS A 70 13.554 22.325 -15.548 1.00 0.00 N ATOM 0 H LYS A 70 6.632 21.968 -14.905 1.00 0.00 H new ATOM 0 HA LYS A 70 7.952 24.284 -13.735 1.00 0.00 H new ATOM 0 HB2 LYS A 70 9.429 22.506 -14.128 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.657 22.054 -15.635 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.031 23.366 -16.842 1.00 0.00 H new ATOM 0 HG3 LYS A 70 9.743 24.752 -15.810 1.00 0.00 H new ATOM 0 HD2 LYS A 70 12.018 24.392 -15.461 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.323 23.517 -14.111 1.00 0.00 H new ATOM 0 HE2 LYS A 70 11.695 21.409 -15.107 1.00 0.00 H new ATOM 0 HE3 LYS A 70 11.808 22.078 -16.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 13.974 21.436 -15.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 13.917 23.118 -16.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.807 22.469 -14.550 1.00 0.00 H new ATOM 1065 N SER A 71 6.708 25.792 -15.399 1.00 0.00 N ATOM 1066 CA SER A 71 6.331 26.818 -16.363 1.00 0.00 C ATOM 1067 C SER A 71 7.423 27.007 -17.411 1.00 0.00 C ATOM 1068 O SER A 71 8.605 27.107 -17.082 1.00 0.00 O ATOM 1069 CB SER A 71 6.059 28.144 -15.649 1.00 0.00 C ATOM 1070 OG SER A 71 4.932 28.043 -14.797 1.00 0.00 O ATOM 0 H SER A 71 6.382 25.967 -14.448 1.00 0.00 H new ATOM 0 HA SER A 71 5.421 26.491 -16.866 1.00 0.00 H new ATOM 0 HB2 SER A 71 6.934 28.433 -15.067 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.892 28.930 -16.386 1.00 0.00 H new ATOM 0 HG SER A 71 4.781 28.903 -14.351 1.00 0.00 H new ATOM 1076 N PHE A 72 7.019 27.053 -18.676 1.00 0.00 N ATOM 1077 CA PHE A 72 7.962 27.228 -19.775 1.00 0.00 C ATOM 1078 C PHE A 72 8.016 28.687 -20.218 1.00 0.00 C ATOM 1079 O PHE A 72 7.028 29.415 -20.120 1.00 0.00 O ATOM 1080 CB PHE A 72 7.573 26.338 -20.957 1.00 0.00 C ATOM 1081 CG PHE A 72 7.635 24.870 -20.648 1.00 0.00 C ATOM 1082 CD1 PHE A 72 8.829 24.279 -20.264 1.00 0.00 C ATOM 1083 CD2 PHE A 72 6.501 24.080 -20.741 1.00 0.00 C ATOM 1084 CE1 PHE A 72 8.890 22.928 -19.979 1.00 0.00 C ATOM 1085 CE2 PHE A 72 6.556 22.728 -20.457 1.00 0.00 C ATOM 1086 CZ PHE A 72 7.752 22.152 -20.076 1.00 0.00 C ATOM 0 H PHE A 72 6.044 26.972 -18.966 1.00 0.00 H new ATOM 0 HA PHE A 72 8.951 26.937 -19.421 1.00 0.00 H new ATOM 0 HB2 PHE A 72 6.562 26.592 -21.275 1.00 0.00 H new ATOM 0 HB3 PHE A 72 8.235 26.553 -21.796 1.00 0.00 H new ATOM 0 HD1 PHE A 72 9.722 24.882 -20.187 1.00 0.00 H new ATOM 0 HD2 PHE A 72 5.563 24.525 -21.039 1.00 0.00 H new ATOM 0 HE1 PHE A 72 9.826 22.480 -19.681 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.665 22.123 -20.533 1.00 0.00 H new ATOM 0 HZ PHE A 72 7.797 21.096 -19.854 1.00 0.00 H new ATOM 1096 N LYS A 73 9.178 29.109 -20.706 1.00 0.00 N ATOM 1097 CA LYS A 73 9.363 30.480 -21.165 1.00 0.00 C ATOM 1098 C LYS A 73 9.032 30.606 -22.649 1.00 0.00 C ATOM 1099 O LYS A 73 9.700 31.333 -23.384 1.00 0.00 O ATOM 1100 CB LYS A 73 10.803 30.934 -20.913 1.00 0.00 C ATOM 1101 CG LYS A 73 10.917 32.392 -20.501 1.00 0.00 C ATOM 1102 CD LYS A 73 11.030 33.305 -21.709 1.00 0.00 C ATOM 1103 CE LYS A 73 12.226 32.939 -22.575 1.00 0.00 C ATOM 1104 NZ LYS A 73 12.734 34.110 -23.343 1.00 0.00 N ATOM 0 H LYS A 73 10.006 28.520 -20.794 1.00 0.00 H new ATOM 0 HA LYS A 73 8.683 31.120 -20.603 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.241 30.310 -20.134 1.00 0.00 H new ATOM 0 HB3 LYS A 73 11.389 30.774 -21.818 1.00 0.00 H new ATOM 0 HG2 LYS A 73 10.045 32.674 -19.911 1.00 0.00 H new ATOM 0 HG3 LYS A 73 11.790 32.523 -19.862 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.117 33.241 -22.301 1.00 0.00 H new ATOM 0 HD3 LYS A 73 11.123 34.339 -21.377 1.00 0.00 H new ATOM 0 HE2 LYS A 73 13.023 32.544 -21.945 1.00 0.00 H new ATOM 0 HE3 LYS A 73 11.944 32.145 -23.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 13.549 33.819 -23.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 11.981 34.471 -23.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 13.027 34.858 -22.682 1.00 0.00 H new ATOM 1118 N ALA A 74 7.997 29.894 -23.082 1.00 0.00 N ATOM 1119 CA ALA A 74 7.576 29.929 -24.477 1.00 0.00 C ATOM 1120 C ALA A 74 6.236 29.226 -24.664 1.00 0.00 C ATOM 1121 O ALA A 74 6.131 28.011 -24.494 1.00 0.00 O ATOM 1122 CB ALA A 74 8.636 29.294 -25.365 1.00 0.00 C ATOM 0 H ALA A 74 7.435 29.286 -22.487 1.00 0.00 H new ATOM 0 HA ALA A 74 7.453 30.972 -24.767 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.308 29.327 -26.404 1.00 0.00 H new ATOM 0 HB2 ALA A 74 9.573 29.842 -25.263 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.788 28.257 -25.066 1.00 0.00 H new ATOM 1128 N LYS A 75 5.212 29.997 -25.014 1.00 0.00 N ATOM 1129 CA LYS A 75 3.878 29.449 -25.225 1.00 0.00 C ATOM 1130 C LYS A 75 3.921 28.266 -26.187 1.00 0.00 C ATOM 1131 O LYS A 75 3.108 27.346 -26.092 1.00 0.00 O ATOM 1132 CB LYS A 75 2.940 30.529 -25.769 1.00 0.00 C ATOM 1133 CG LYS A 75 1.818 29.981 -26.634 1.00 0.00 C ATOM 1134 CD LYS A 75 0.854 29.131 -25.823 1.00 0.00 C ATOM 1135 CE LYS A 75 -0.281 29.967 -25.251 1.00 0.00 C ATOM 1136 NZ LYS A 75 -1.433 30.054 -26.191 1.00 0.00 N ATOM 0 H LYS A 75 5.281 31.004 -25.158 1.00 0.00 H new ATOM 0 HA LYS A 75 3.500 29.099 -24.264 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.508 31.078 -24.932 1.00 0.00 H new ATOM 0 HB3 LYS A 75 3.521 31.243 -26.352 1.00 0.00 H new ATOM 0 HG2 LYS A 75 1.277 30.807 -27.096 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.239 29.384 -27.443 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.444 28.342 -26.453 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.393 28.643 -25.011 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -0.613 29.532 -24.308 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.083 30.970 -25.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.299 30.273 -25.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.256 30.805 -26.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -1.549 29.145 -26.683 1.00 0.00 H new ATOM 1150 N TYR A 76 4.874 28.296 -27.112 1.00 0.00 N ATOM 1151 CA TYR A 76 5.022 27.227 -28.092 1.00 0.00 C ATOM 1152 C TYR A 76 5.616 25.977 -27.449 1.00 0.00 C ATOM 1153 O TYR A 76 5.283 24.853 -27.824 1.00 0.00 O ATOM 1154 CB TYR A 76 5.909 27.688 -29.250 1.00 0.00 C ATOM 1155 CG TYR A 76 7.387 27.652 -28.933 1.00 0.00 C ATOM 1156 CD1 TYR A 76 8.075 26.447 -28.870 1.00 0.00 C ATOM 1157 CD2 TYR A 76 8.095 28.824 -28.697 1.00 0.00 C ATOM 1158 CE1 TYR A 76 9.425 26.409 -28.579 1.00 0.00 C ATOM 1159 CE2 TYR A 76 9.446 28.796 -28.408 1.00 0.00 C ATOM 1160 CZ TYR A 76 10.106 27.586 -28.350 1.00 0.00 C ATOM 1161 OH TYR A 76 11.451 27.554 -28.062 1.00 0.00 O ATOM 0 H TYR A 76 5.556 29.049 -27.204 1.00 0.00 H new ATOM 0 HA TYR A 76 4.032 26.981 -28.476 1.00 0.00 H new ATOM 0 HB2 TYR A 76 5.717 27.057 -30.117 1.00 0.00 H new ATOM 0 HB3 TYR A 76 5.630 28.705 -29.528 1.00 0.00 H new ATOM 0 HD1 TYR A 76 7.545 25.524 -29.052 1.00 0.00 H new ATOM 0 HD2 TYR A 76 7.581 29.773 -28.740 1.00 0.00 H new ATOM 0 HE1 TYR A 76 9.944 25.463 -28.531 1.00 0.00 H new ATOM 0 HE2 TYR A 76 9.982 29.716 -28.229 1.00 0.00 H new ATOM 0 HH TYR A 76 11.779 28.468 -27.929 1.00 0.00 H new ATOM 1171 N LYS A 77 6.497 26.182 -26.476 1.00 0.00 N ATOM 1172 CA LYS A 77 7.137 25.074 -25.777 1.00 0.00 C ATOM 1173 C LYS A 77 6.109 24.249 -25.008 1.00 0.00 C ATOM 1174 O LYS A 77 6.189 23.020 -24.968 1.00 0.00 O ATOM 1175 CB LYS A 77 8.206 25.599 -24.816 1.00 0.00 C ATOM 1176 CG LYS A 77 9.398 26.226 -25.517 1.00 0.00 C ATOM 1177 CD LYS A 77 10.296 25.171 -26.142 1.00 0.00 C ATOM 1178 CE LYS A 77 11.061 24.392 -25.082 1.00 0.00 C ATOM 1179 NZ LYS A 77 11.912 25.283 -24.245 1.00 0.00 N ATOM 0 H LYS A 77 6.784 27.106 -26.153 1.00 0.00 H new ATOM 0 HA LYS A 77 7.609 24.433 -26.521 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.755 26.337 -24.153 1.00 0.00 H new ATOM 0 HB3 LYS A 77 8.554 24.778 -24.189 1.00 0.00 H new ATOM 0 HG2 LYS A 77 9.048 26.911 -26.289 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.972 26.817 -24.803 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.693 24.484 -26.736 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.000 25.648 -26.824 1.00 0.00 H new ATOM 0 HE2 LYS A 77 10.356 23.859 -24.444 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.686 23.641 -25.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.653 24.720 -23.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.354 26.007 -24.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 11.324 25.745 -23.522 1.00 0.00 H new ATOM 1193 N LEU A 78 5.144 24.931 -24.401 1.00 0.00 N ATOM 1194 CA LEU A 78 4.099 24.260 -23.635 1.00 0.00 C ATOM 1195 C LEU A 78 3.110 23.560 -24.561 1.00 0.00 C ATOM 1196 O LEU A 78 2.664 22.447 -24.283 1.00 0.00 O ATOM 1197 CB LEU A 78 3.363 25.268 -22.750 1.00 0.00 C ATOM 1198 CG LEU A 78 1.930 24.899 -22.363 1.00 0.00 C ATOM 1199 CD1 LEU A 78 1.858 23.452 -21.900 1.00 0.00 C ATOM 1200 CD2 LEU A 78 1.414 25.834 -21.279 1.00 0.00 C ATOM 0 H LEU A 78 5.063 25.948 -24.424 1.00 0.00 H new ATOM 0 HA LEU A 78 4.571 23.507 -23.003 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.940 25.409 -21.836 1.00 0.00 H new ATOM 0 HB3 LEU A 78 3.343 26.228 -23.266 1.00 0.00 H new ATOM 0 HG LEU A 78 1.296 25.009 -23.243 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.831 23.207 -21.629 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.187 22.795 -22.706 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.505 23.315 -21.033 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.393 25.557 -21.016 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.050 25.755 -20.397 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.428 26.860 -21.646 1.00 0.00 H new ATOM 1212 N VAL A 79 2.771 24.220 -25.664 1.00 0.00 N ATOM 1213 CA VAL A 79 1.837 23.660 -26.634 1.00 0.00 C ATOM 1214 C VAL A 79 2.369 22.358 -27.221 1.00 0.00 C ATOM 1215 O VAL A 79 1.710 21.321 -27.155 1.00 0.00 O ATOM 1216 CB VAL A 79 1.556 24.650 -27.779 1.00 0.00 C ATOM 1217 CG1 VAL A 79 1.039 23.915 -29.006 1.00 0.00 C ATOM 1218 CG2 VAL A 79 0.568 25.717 -27.331 1.00 0.00 C ATOM 0 H VAL A 79 3.129 25.143 -25.908 1.00 0.00 H new ATOM 0 HA VAL A 79 0.908 23.461 -26.100 1.00 0.00 H new ATOM 0 HB VAL A 79 2.491 25.143 -28.047 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.846 24.631 -29.805 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.785 23.193 -29.339 1.00 0.00 H new ATOM 0 HG13 VAL A 79 0.115 23.393 -28.755 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.381 26.408 -28.153 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.368 25.244 -27.034 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.982 26.264 -26.484 1.00 0.00 H new ATOM 1228 N ASN A 80 3.566 22.419 -27.794 1.00 0.00 N ATOM 1229 CA ASN A 80 4.188 21.244 -28.394 1.00 0.00 C ATOM 1230 C ASN A 80 4.300 20.110 -27.380 1.00 0.00 C ATOM 1231 O ASN A 80 4.155 18.937 -27.725 1.00 0.00 O ATOM 1232 CB ASN A 80 5.574 21.596 -28.937 1.00 0.00 C ATOM 1233 CG ASN A 80 6.670 21.375 -27.913 1.00 0.00 C ATOM 1234 OD1 ASN A 80 6.842 20.268 -27.401 1.00 0.00 O ATOM 1235 ND2 ASN A 80 7.417 22.429 -27.608 1.00 0.00 N ATOM 0 H ASN A 80 4.125 23.270 -27.856 1.00 0.00 H new ATOM 0 HA ASN A 80 3.556 20.910 -29.217 1.00 0.00 H new ATOM 0 HB2 ASN A 80 5.779 20.992 -29.821 1.00 0.00 H new ATOM 0 HB3 ASN A 80 5.583 22.639 -29.255 1.00 0.00 H new ATOM 0 HD21 ASN A 80 8.169 22.341 -26.925 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.239 23.327 -28.057 1.00 0.00 H new ATOM 1242 N HIS A 81 4.557 20.469 -26.126 1.00 0.00 N ATOM 1243 CA HIS A 81 4.687 19.482 -25.060 1.00 0.00 C ATOM 1244 C HIS A 81 3.429 18.625 -24.956 1.00 0.00 C ATOM 1245 O HIS A 81 3.508 17.406 -24.800 1.00 0.00 O ATOM 1246 CB HIS A 81 4.958 20.175 -23.724 1.00 0.00 C ATOM 1247 CG HIS A 81 4.225 19.561 -22.571 1.00 0.00 C ATOM 1248 ND1 HIS A 81 4.642 18.407 -21.942 1.00 0.00 N ATOM 1249 CD2 HIS A 81 3.096 19.949 -21.932 1.00 0.00 C ATOM 1250 CE1 HIS A 81 3.801 18.110 -20.968 1.00 0.00 C ATOM 1251 NE2 HIS A 81 2.854 19.030 -20.940 1.00 0.00 N ATOM 0 H HIS A 81 4.679 21.435 -25.823 1.00 0.00 H new ATOM 0 HA HIS A 81 5.529 18.833 -25.301 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.028 20.147 -23.520 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.677 21.225 -23.805 1.00 0.00 H new ATOM 0 HD1 HIS A 81 5.471 17.867 -22.190 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.497 20.819 -22.160 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.875 17.259 -20.307 1.00 0.00 H new ATOM 1259 N ILE A 82 2.271 19.271 -25.042 1.00 0.00 N ATOM 1260 CA ILE A 82 0.997 18.568 -24.958 1.00 0.00 C ATOM 1261 C ILE A 82 0.905 17.469 -26.012 1.00 0.00 C ATOM 1262 O ILE A 82 0.080 16.561 -25.906 1.00 0.00 O ATOM 1263 CB ILE A 82 -0.191 19.532 -25.133 1.00 0.00 C ATOM 1264 CG1 ILE A 82 0.048 20.819 -24.341 1.00 0.00 C ATOM 1265 CG2 ILE A 82 -1.485 18.864 -24.692 1.00 0.00 C ATOM 1266 CD1 ILE A 82 -1.207 21.635 -24.121 1.00 0.00 C ATOM 0 H ILE A 82 2.189 20.280 -25.170 1.00 0.00 H new ATOM 0 HA ILE A 82 0.948 18.121 -23.965 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.280 19.789 -26.189 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.481 20.565 -23.373 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.781 21.430 -24.868 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.315 19.558 -24.822 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.659 17.973 -25.296 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -1.409 18.581 -23.642 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.962 22.533 -23.553 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -1.630 21.919 -25.085 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.934 21.042 -23.567 1.00 0.00 H new ATOM 1278 N ARG A 83 1.757 17.558 -27.027 1.00 0.00 N ATOM 1279 CA ARG A 83 1.773 16.571 -28.101 1.00 0.00 C ATOM 1280 C ARG A 83 2.299 15.230 -27.598 1.00 0.00 C ATOM 1281 O ARG A 83 1.953 14.176 -28.132 1.00 0.00 O ATOM 1282 CB ARG A 83 2.633 17.066 -29.265 1.00 0.00 C ATOM 1283 CG ARG A 83 2.365 18.512 -29.648 1.00 0.00 C ATOM 1284 CD ARG A 83 1.247 18.619 -30.673 1.00 0.00 C ATOM 1285 NE ARG A 83 1.396 19.795 -31.525 1.00 0.00 N ATOM 1286 CZ ARG A 83 2.292 19.887 -32.502 1.00 0.00 C ATOM 1287 NH1 ARG A 83 3.114 18.877 -32.749 1.00 0.00 N ATOM 1288 NH2 ARG A 83 2.366 20.991 -33.234 1.00 0.00 N ATOM 0 H ARG A 83 2.446 18.303 -27.129 1.00 0.00 H new ATOM 0 HA ARG A 83 0.749 16.432 -28.449 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.685 16.958 -29.000 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.456 16.430 -30.133 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.100 19.082 -28.758 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.274 18.957 -30.052 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.236 17.722 -31.292 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.287 18.663 -30.159 1.00 0.00 H new ATOM 0 HE ARG A 83 0.778 20.590 -31.361 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.060 18.026 -32.189 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.801 18.950 -33.500 1.00 0.00 H new ATOM 0 HH21 ARG A 83 1.735 21.770 -33.047 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.054 21.061 -33.984 1.00 0.00 H new ATOM 1302 N VAL A 84 3.140 15.278 -26.570 1.00 0.00 N ATOM 1303 CA VAL A 84 3.714 14.067 -25.995 1.00 0.00 C ATOM 1304 C VAL A 84 2.714 13.362 -25.086 1.00 0.00 C ATOM 1305 O VAL A 84 2.826 12.162 -24.835 1.00 0.00 O ATOM 1306 CB VAL A 84 4.991 14.379 -25.191 1.00 0.00 C ATOM 1307 CG1 VAL A 84 5.885 15.339 -25.960 1.00 0.00 C ATOM 1308 CG2 VAL A 84 4.635 14.947 -23.825 1.00 0.00 C ATOM 0 H VAL A 84 3.439 16.142 -26.118 1.00 0.00 H new ATOM 0 HA VAL A 84 3.968 13.411 -26.828 1.00 0.00 H new ATOM 0 HB VAL A 84 5.541 13.450 -25.041 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.782 15.548 -25.377 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.168 14.889 -26.912 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.347 16.269 -26.144 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.549 15.162 -23.271 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.063 15.866 -23.951 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.038 14.221 -23.273 1.00 0.00 H new ATOM 1318 N HIS A 85 1.735 14.116 -24.595 1.00 0.00 N ATOM 1319 CA HIS A 85 0.713 13.562 -23.714 1.00 0.00 C ATOM 1320 C HIS A 85 -0.203 12.609 -24.476 1.00 0.00 C ATOM 1321 O HIS A 85 -1.033 11.920 -23.882 1.00 0.00 O ATOM 1322 CB HIS A 85 -0.112 14.686 -23.086 1.00 0.00 C ATOM 1323 CG HIS A 85 0.536 15.305 -21.885 1.00 0.00 C ATOM 1324 ND1 HIS A 85 1.421 14.627 -21.074 1.00 0.00 N ATOM 1325 CD2 HIS A 85 0.424 16.548 -21.361 1.00 0.00 C ATOM 1326 CE1 HIS A 85 1.825 15.425 -20.102 1.00 0.00 C ATOM 1327 NE2 HIS A 85 1.235 16.597 -20.254 1.00 0.00 N ATOM 0 H HIS A 85 1.628 15.111 -24.792 1.00 0.00 H new ATOM 0 HA HIS A 85 1.214 13.003 -22.924 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.286 15.459 -23.834 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -1.088 14.293 -22.800 1.00 0.00 H new ATOM 0 HD1 HIS A 85 1.718 13.660 -21.204 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -0.189 17.351 -21.742 1.00 0.00 H new ATOM 0 HE1 HIS A 85 2.519 15.164 -19.317 1.00 0.00 H new ATOM 1335 N THR A 86 -0.046 12.574 -25.796 1.00 0.00 N ATOM 1336 CA THR A 86 -0.860 11.707 -26.639 1.00 0.00 C ATOM 1337 C THR A 86 -0.085 10.462 -27.056 1.00 0.00 C ATOM 1338 O THR A 86 -0.478 9.339 -26.741 1.00 0.00 O ATOM 1339 CB THR A 86 -1.343 12.444 -27.902 1.00 0.00 C ATOM 1340 OG1 THR A 86 -0.253 12.619 -28.814 1.00 0.00 O ATOM 1341 CG2 THR A 86 -1.935 13.799 -27.544 1.00 0.00 C ATOM 0 H THR A 86 0.637 13.136 -26.304 1.00 0.00 H new ATOM 0 HA THR A 86 -1.726 11.412 -26.046 1.00 0.00 H new ATOM 0 HB THR A 86 -2.118 11.840 -28.375 1.00 0.00 H new ATOM 0 HG1 THR A 86 0.404 13.233 -28.425 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.269 14.301 -28.452 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.783 13.660 -26.873 1.00 0.00 H new ATOM 0 HG23 THR A 86 -1.178 14.408 -27.050 1.00 0.00 H new ATOM 1349 N GLY A 87 1.019 10.668 -27.768 1.00 0.00 N ATOM 1350 CA GLY A 87 1.832 9.553 -28.216 1.00 0.00 C ATOM 1351 C GLY A 87 0.996 8.382 -28.694 1.00 0.00 C ATOM 1352 O GLY A 87 1.150 7.262 -28.207 1.00 0.00 O ATOM 0 H GLY A 87 1.365 11.588 -28.042 1.00 0.00 H new ATOM 0 HA2 GLY A 87 2.484 9.884 -29.024 1.00 0.00 H new ATOM 0 HA3 GLY A 87 2.477 9.226 -27.400 1.00 0.00 H new ATOM 1356 N GLU A 88 0.109 8.641 -29.650 1.00 0.00 N ATOM 1357 CA GLU A 88 -0.755 7.599 -30.191 1.00 0.00 C ATOM 1358 C GLU A 88 0.020 6.685 -31.136 1.00 0.00 C ATOM 1359 O GLU A 88 0.485 7.115 -32.192 1.00 0.00 O ATOM 1360 CB GLU A 88 -1.943 8.223 -30.928 1.00 0.00 C ATOM 1361 CG GLU A 88 -3.201 7.372 -30.884 1.00 0.00 C ATOM 1362 CD GLU A 88 -4.438 8.137 -31.311 1.00 0.00 C ATOM 1363 OE1 GLU A 88 -4.672 8.256 -32.532 1.00 0.00 O ATOM 1364 OE2 GLU A 88 -5.174 8.617 -30.423 1.00 0.00 O ATOM 0 H GLU A 88 -0.030 9.562 -30.065 1.00 0.00 H new ATOM 0 HA GLU A 88 -1.126 7.001 -29.358 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.159 9.198 -30.492 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.666 8.393 -31.968 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -3.072 6.506 -31.533 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.344 6.993 -29.872 1.00 0.00 H new ATOM 1371 N LYS A 89 0.155 5.422 -30.749 1.00 0.00 N ATOM 1372 CA LYS A 89 0.873 4.445 -31.559 1.00 0.00 C ATOM 1373 C LYS A 89 -0.099 3.521 -32.286 1.00 0.00 C ATOM 1374 O LYS A 89 -1.265 3.391 -31.913 1.00 0.00 O ATOM 1375 CB LYS A 89 1.818 3.620 -30.683 1.00 0.00 C ATOM 1376 CG LYS A 89 3.277 4.022 -30.816 1.00 0.00 C ATOM 1377 CD LYS A 89 3.920 4.247 -29.458 1.00 0.00 C ATOM 1378 CE LYS A 89 5.368 3.782 -29.442 1.00 0.00 C ATOM 1379 NZ LYS A 89 5.964 3.870 -28.080 1.00 0.00 N ATOM 0 H LYS A 89 -0.224 5.050 -29.878 1.00 0.00 H new ATOM 0 HA LYS A 89 1.457 4.987 -32.303 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.515 3.722 -29.641 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.715 2.567 -30.944 1.00 0.00 H new ATOM 0 HG2 LYS A 89 3.822 3.246 -31.353 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.352 4.933 -31.410 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.874 5.306 -29.204 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.356 3.711 -28.694 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.423 2.753 -29.797 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.952 4.389 -30.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 6.615 3.072 -27.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.486 4.765 -27.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 5.208 3.834 -27.367 1.00 0.00 H new ATOM 1393 N PRO A 90 0.390 2.863 -33.348 1.00 0.00 N ATOM 1394 CA PRO A 90 -0.419 1.938 -34.147 1.00 0.00 C ATOM 1395 C PRO A 90 -0.759 0.660 -33.388 1.00 0.00 C ATOM 1396 O PRO A 90 -1.924 0.272 -33.296 1.00 0.00 O ATOM 1397 CB PRO A 90 0.480 1.625 -35.346 1.00 0.00 C ATOM 1398 CG PRO A 90 1.866 1.851 -34.848 1.00 0.00 C ATOM 1399 CD PRO A 90 1.770 2.970 -33.849 1.00 0.00 C ATOM 0 HA PRO A 90 -1.382 2.370 -34.420 1.00 0.00 H new ATOM 0 HB2 PRO A 90 0.344 0.598 -35.686 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.252 2.274 -36.192 1.00 0.00 H new ATOM 0 HG2 PRO A 90 2.267 0.949 -34.386 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.536 2.115 -35.666 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.499 2.856 -33.047 1.00 0.00 H new ATOM 0 HD3 PRO A 90 1.955 3.939 -34.312 1.00 0.00 H new ATOM 1407 N PHE A 91 0.265 0.010 -32.845 1.00 0.00 N ATOM 1408 CA PHE A 91 0.074 -1.225 -32.094 1.00 0.00 C ATOM 1409 C PHE A 91 1.230 -1.456 -31.125 1.00 0.00 C ATOM 1410 O PHE A 91 2.403 -1.360 -31.484 1.00 0.00 O ATOM 1411 CB PHE A 91 -0.051 -2.414 -33.049 1.00 0.00 C ATOM 1412 CG PHE A 91 0.677 -2.218 -34.348 1.00 0.00 C ATOM 1413 CD1 PHE A 91 2.062 -2.188 -34.385 1.00 0.00 C ATOM 1414 CD2 PHE A 91 -0.024 -2.063 -35.534 1.00 0.00 C ATOM 1415 CE1 PHE A 91 2.734 -2.008 -35.579 1.00 0.00 C ATOM 1416 CE2 PHE A 91 0.643 -1.883 -36.730 1.00 0.00 C ATOM 1417 CZ PHE A 91 2.024 -1.854 -36.753 1.00 0.00 C ATOM 0 H PHE A 91 1.235 0.318 -32.911 1.00 0.00 H new ATOM 0 HA PHE A 91 -0.847 -1.132 -31.518 1.00 0.00 H new ATOM 0 HB2 PHE A 91 0.334 -3.307 -32.557 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -1.106 -2.594 -33.256 1.00 0.00 H new ATOM 0 HD1 PHE A 91 2.623 -2.307 -33.470 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -1.104 -2.083 -35.523 1.00 0.00 H new ATOM 0 HE1 PHE A 91 3.814 -1.988 -35.594 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.085 -1.765 -37.647 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.547 -1.711 -37.687 1.00 0.00 H new ATOM 1427 N PRO A 92 0.891 -1.768 -29.865 1.00 0.00 N ATOM 1428 CA PRO A 92 1.885 -2.019 -28.817 1.00 0.00 C ATOM 1429 C PRO A 92 2.645 -3.322 -29.039 1.00 0.00 C ATOM 1430 O PRO A 92 2.626 -3.885 -30.134 1.00 0.00 O ATOM 1431 CB PRO A 92 1.043 -2.101 -27.541 1.00 0.00 C ATOM 1432 CG PRO A 92 -0.309 -2.517 -28.007 1.00 0.00 C ATOM 1433 CD PRO A 92 -0.488 -1.899 -29.366 1.00 0.00 C ATOM 0 HA PRO A 92 2.652 -1.245 -28.789 1.00 0.00 H new ATOM 0 HB2 PRO A 92 1.459 -2.822 -26.838 1.00 0.00 H new ATOM 0 HB3 PRO A 92 1.007 -1.140 -27.028 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -0.387 -3.603 -28.059 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -1.081 -2.175 -27.318 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -1.093 -2.529 -30.018 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -0.987 -0.932 -29.305 1.00 0.00 H new ATOM 1441 N CYS A 93 3.313 -3.798 -27.993 1.00 0.00 N ATOM 1442 CA CYS A 93 4.080 -5.035 -28.074 1.00 0.00 C ATOM 1443 C CYS A 93 3.219 -6.234 -27.687 1.00 0.00 C ATOM 1444 O CYS A 93 2.460 -6.199 -26.718 1.00 0.00 O ATOM 1445 CB CYS A 93 5.307 -4.959 -27.163 1.00 0.00 C ATOM 1446 SG CYS A 93 6.319 -6.474 -27.152 1.00 0.00 S ATOM 0 H CYS A 93 3.338 -3.345 -27.079 1.00 0.00 H new ATOM 0 HA CYS A 93 4.409 -5.163 -29.105 1.00 0.00 H new ATOM 0 HB2 CYS A 93 5.929 -4.121 -27.478 1.00 0.00 H new ATOM 0 HB3 CYS A 93 4.978 -4.747 -26.146 1.00 0.00 H new ATOM 1451 N PRO A 94 3.338 -7.323 -28.462 1.00 0.00 N ATOM 1452 CA PRO A 94 2.580 -8.554 -28.220 1.00 0.00 C ATOM 1453 C PRO A 94 3.039 -9.280 -26.960 1.00 0.00 C ATOM 1454 O PRO A 94 2.557 -10.369 -26.649 1.00 0.00 O ATOM 1455 CB PRO A 94 2.871 -9.400 -29.462 1.00 0.00 C ATOM 1456 CG PRO A 94 4.185 -8.903 -29.958 1.00 0.00 C ATOM 1457 CD PRO A 94 4.223 -7.436 -29.633 1.00 0.00 C ATOM 0 HA PRO A 94 1.520 -8.355 -28.062 1.00 0.00 H new ATOM 0 HB2 PRO A 94 2.916 -10.461 -29.217 1.00 0.00 H new ATOM 0 HB3 PRO A 94 2.092 -9.279 -30.215 1.00 0.00 H new ATOM 0 HG2 PRO A 94 5.008 -9.431 -29.477 1.00 0.00 H new ATOM 0 HG3 PRO A 94 4.285 -9.068 -31.031 1.00 0.00 H new ATOM 0 HD2 PRO A 94 5.235 -7.101 -29.406 1.00 0.00 H new ATOM 0 HD3 PRO A 94 3.866 -6.830 -30.466 1.00 0.00 H new ATOM 1465 N PHE A 95 3.974 -8.670 -26.239 1.00 0.00 N ATOM 1466 CA PHE A 95 4.499 -9.259 -25.013 1.00 0.00 C ATOM 1467 C PHE A 95 3.839 -8.638 -23.785 1.00 0.00 C ATOM 1468 O PHE A 95 3.691 -7.420 -23.677 1.00 0.00 O ATOM 1469 CB PHE A 95 6.016 -9.071 -24.940 1.00 0.00 C ATOM 1470 CG PHE A 95 6.706 -10.093 -24.083 1.00 0.00 C ATOM 1471 CD1 PHE A 95 6.572 -10.064 -22.704 1.00 0.00 C ATOM 1472 CD2 PHE A 95 7.489 -11.082 -24.656 1.00 0.00 C ATOM 1473 CE1 PHE A 95 7.206 -11.003 -21.912 1.00 0.00 C ATOM 1474 CE2 PHE A 95 8.125 -12.024 -23.869 1.00 0.00 C ATOM 1475 CZ PHE A 95 7.984 -11.983 -22.495 1.00 0.00 C ATOM 0 H PHE A 95 4.384 -7.768 -26.483 1.00 0.00 H new ATOM 0 HA PHE A 95 4.272 -10.325 -25.026 1.00 0.00 H new ATOM 0 HB2 PHE A 95 6.429 -9.116 -25.948 1.00 0.00 H new ATOM 0 HB3 PHE A 95 6.232 -8.076 -24.551 1.00 0.00 H new ATOM 0 HD1 PHE A 95 5.965 -9.299 -22.243 1.00 0.00 H new ATOM 0 HD2 PHE A 95 7.604 -11.117 -25.729 1.00 0.00 H new ATOM 0 HE1 PHE A 95 7.093 -10.970 -20.838 1.00 0.00 H new ATOM 0 HE2 PHE A 95 8.731 -12.791 -24.328 1.00 0.00 H new ATOM 0 HZ PHE A 95 8.482 -12.717 -21.878 1.00 0.00 H new ATOM 1485 N PRO A 96 3.432 -9.494 -22.836 1.00 0.00 N ATOM 1486 CA PRO A 96 2.782 -9.053 -21.598 1.00 0.00 C ATOM 1487 C PRO A 96 3.743 -8.323 -20.666 1.00 0.00 C ATOM 1488 O PRO A 96 3.478 -7.199 -20.242 1.00 0.00 O ATOM 1489 CB PRO A 96 2.308 -10.362 -20.961 1.00 0.00 C ATOM 1490 CG PRO A 96 3.227 -11.401 -21.504 1.00 0.00 C ATOM 1491 CD PRO A 96 3.576 -10.958 -22.897 1.00 0.00 C ATOM 0 HA PRO A 96 1.979 -8.341 -21.790 1.00 0.00 H new ATOM 0 HB2 PRO A 96 2.362 -10.315 -19.873 1.00 0.00 H new ATOM 0 HB3 PRO A 96 1.271 -10.576 -21.220 1.00 0.00 H new ATOM 0 HG2 PRO A 96 4.121 -11.491 -20.888 1.00 0.00 H new ATOM 0 HG3 PRO A 96 2.747 -12.380 -21.514 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.590 -11.251 -23.170 1.00 0.00 H new ATOM 0 HD3 PRO A 96 2.907 -11.397 -23.638 1.00 0.00 H new ATOM 1499 N GLY A 97 4.860 -8.971 -20.351 1.00 0.00 N ATOM 1500 CA GLY A 97 5.844 -8.368 -19.471 1.00 0.00 C ATOM 1501 C GLY A 97 6.828 -7.489 -20.217 1.00 0.00 C ATOM 1502 O GLY A 97 8.035 -7.557 -19.983 1.00 0.00 O ATOM 0 H GLY A 97 5.101 -9.903 -20.689 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.333 -7.774 -18.713 1.00 0.00 H new ATOM 0 HA3 GLY A 97 6.388 -9.154 -18.947 1.00 0.00 H new ATOM 1506 N CYS A 98 6.313 -6.660 -21.119 1.00 0.00 N ATOM 1507 CA CYS A 98 7.153 -5.765 -21.905 1.00 0.00 C ATOM 1508 C CYS A 98 6.559 -4.360 -21.949 1.00 0.00 C ATOM 1509 O CYS A 98 7.256 -3.373 -21.720 1.00 0.00 O ATOM 1510 CB CYS A 98 7.320 -6.305 -23.327 1.00 0.00 C ATOM 1511 SG CYS A 98 8.596 -5.446 -24.303 1.00 0.00 S ATOM 0 H CYS A 98 5.316 -6.590 -21.324 1.00 0.00 H new ATOM 0 HA CYS A 98 8.131 -5.712 -21.427 1.00 0.00 H new ATOM 0 HB2 CYS A 98 7.570 -7.365 -23.275 1.00 0.00 H new ATOM 0 HB3 CYS A 98 6.366 -6.228 -23.848 1.00 0.00 H new ATOM 1516 N GLY A 99 5.266 -4.279 -22.245 1.00 0.00 N ATOM 1517 CA GLY A 99 4.599 -2.992 -22.313 1.00 0.00 C ATOM 1518 C GLY A 99 5.325 -2.010 -23.212 1.00 0.00 C ATOM 1519 O GLY A 99 5.244 -0.798 -23.014 1.00 0.00 O ATOM 0 H GLY A 99 4.668 -5.082 -22.439 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.582 -3.132 -22.679 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.521 -2.573 -21.310 1.00 0.00 H new ATOM 1523 N LYS A 100 6.039 -2.534 -24.202 1.00 0.00 N ATOM 1524 CA LYS A 100 6.784 -1.697 -25.135 1.00 0.00 C ATOM 1525 C LYS A 100 5.974 -1.441 -26.403 1.00 0.00 C ATOM 1526 O LYS A 100 5.116 -2.243 -26.774 1.00 0.00 O ATOM 1527 CB LYS A 100 8.117 -2.358 -25.494 1.00 0.00 C ATOM 1528 CG LYS A 100 8.827 -1.700 -26.664 1.00 0.00 C ATOM 1529 CD LYS A 100 9.462 -0.380 -26.260 1.00 0.00 C ATOM 1530 CE LYS A 100 10.841 -0.212 -26.878 1.00 0.00 C ATOM 1531 NZ LYS A 100 11.908 -0.798 -26.021 1.00 0.00 N ATOM 0 H LYS A 100 6.118 -3.535 -24.379 1.00 0.00 H new ATOM 0 HA LYS A 100 6.979 -0.741 -24.650 1.00 0.00 H new ATOM 0 HB2 LYS A 100 8.771 -2.333 -24.623 1.00 0.00 H new ATOM 0 HB3 LYS A 100 7.940 -3.407 -25.731 1.00 0.00 H new ATOM 0 HG2 LYS A 100 9.595 -2.371 -27.049 1.00 0.00 H new ATOM 0 HG3 LYS A 100 8.117 -1.531 -27.473 1.00 0.00 H new ATOM 0 HD2 LYS A 100 8.820 0.444 -26.571 1.00 0.00 H new ATOM 0 HD3 LYS A 100 9.540 -0.330 -25.174 1.00 0.00 H new ATOM 0 HE2 LYS A 100 10.860 -0.688 -27.858 1.00 0.00 H new ATOM 0 HE3 LYS A 100 11.042 0.848 -27.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 12.833 -0.663 -26.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 11.907 -0.326 -25.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 11.731 -1.815 -25.892 1.00 0.00 H new ATOM 1545 N ILE A 101 6.253 -0.322 -27.062 1.00 0.00 N ATOM 1546 CA ILE A 101 5.552 0.036 -28.289 1.00 0.00 C ATOM 1547 C ILE A 101 6.486 0.732 -29.272 1.00 0.00 C ATOM 1548 O ILE A 101 7.516 1.284 -28.883 1.00 0.00 O ATOM 1549 CB ILE A 101 4.350 0.955 -28.002 1.00 0.00 C ATOM 1550 CG1 ILE A 101 3.603 0.480 -26.754 1.00 0.00 C ATOM 1551 CG2 ILE A 101 3.415 0.995 -29.202 1.00 0.00 C ATOM 1552 CD1 ILE A 101 2.343 1.267 -26.467 1.00 0.00 C ATOM 0 H ILE A 101 6.959 0.352 -26.767 1.00 0.00 H new ATOM 0 HA ILE A 101 5.192 -0.893 -28.730 1.00 0.00 H new ATOM 0 HB ILE A 101 4.719 1.964 -27.820 1.00 0.00 H new ATOM 0 HG12 ILE A 101 3.345 -0.572 -26.874 1.00 0.00 H new ATOM 0 HG13 ILE A 101 4.269 0.549 -25.894 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.570 1.649 -28.984 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.953 1.375 -30.070 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.051 -0.010 -29.413 1.00 0.00 H new ATOM 0 HD11 ILE A 101 1.866 0.875 -25.569 1.00 0.00 H new ATOM 0 HD12 ILE A 101 2.596 2.316 -26.315 1.00 0.00 H new ATOM 0 HD13 ILE A 101 1.658 1.177 -27.310 1.00 0.00 H new ATOM 1564 N PHE A 102 6.119 0.705 -30.549 1.00 0.00 N ATOM 1565 CA PHE A 102 6.924 1.334 -31.590 1.00 0.00 C ATOM 1566 C PHE A 102 6.035 2.001 -32.636 1.00 0.00 C ATOM 1567 O PHE A 102 5.077 1.403 -33.124 1.00 0.00 O ATOM 1568 CB PHE A 102 7.830 0.299 -32.259 1.00 0.00 C ATOM 1569 CG PHE A 102 8.456 -0.664 -31.292 1.00 0.00 C ATOM 1570 CD1 PHE A 102 7.669 -1.521 -30.540 1.00 0.00 C ATOM 1571 CD2 PHE A 102 9.832 -0.712 -31.134 1.00 0.00 C ATOM 1572 CE1 PHE A 102 8.241 -2.410 -29.649 1.00 0.00 C ATOM 1573 CE2 PHE A 102 10.410 -1.598 -30.245 1.00 0.00 C ATOM 1574 CZ PHE A 102 9.614 -2.447 -29.500 1.00 0.00 C ATOM 0 H PHE A 102 5.269 0.254 -30.888 1.00 0.00 H new ATOM 0 HA PHE A 102 7.543 2.100 -31.123 1.00 0.00 H new ATOM 0 HB2 PHE A 102 7.249 -0.261 -32.992 1.00 0.00 H new ATOM 0 HB3 PHE A 102 8.618 0.817 -32.805 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.595 -1.494 -30.651 1.00 0.00 H new ATOM 0 HD2 PHE A 102 10.459 -0.050 -31.712 1.00 0.00 H new ATOM 0 HE1 PHE A 102 7.616 -3.074 -29.071 1.00 0.00 H new ATOM 0 HE2 PHE A 102 11.484 -1.627 -30.132 1.00 0.00 H new ATOM 0 HZ PHE A 102 10.064 -3.138 -28.803 1.00 0.00 H new ATOM 1584 N ALA A 103 6.360 3.244 -32.974 1.00 0.00 N ATOM 1585 CA ALA A 103 5.594 3.992 -33.963 1.00 0.00 C ATOM 1586 C ALA A 103 5.805 3.428 -35.364 1.00 0.00 C ATOM 1587 O ALA A 103 5.059 3.745 -36.290 1.00 0.00 O ATOM 1588 CB ALA A 103 5.974 5.465 -33.922 1.00 0.00 C ATOM 0 H ALA A 103 7.149 3.755 -32.577 1.00 0.00 H new ATOM 0 HA ALA A 103 4.537 3.894 -33.716 1.00 0.00 H new ATOM 0 HB1 ALA A 103 5.394 6.011 -34.666 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.764 5.867 -32.931 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.037 5.573 -34.140 1.00 0.00 H new ATOM 1594 N ARG A 104 6.827 2.591 -35.511 1.00 0.00 N ATOM 1595 CA ARG A 104 7.138 1.985 -36.800 1.00 0.00 C ATOM 1596 C ARG A 104 6.829 0.490 -36.786 1.00 0.00 C ATOM 1597 O ARG A 104 7.233 -0.228 -35.872 1.00 0.00 O ATOM 1598 CB ARG A 104 8.610 2.209 -37.152 1.00 0.00 C ATOM 1599 CG ARG A 104 8.859 3.478 -37.951 1.00 0.00 C ATOM 1600 CD ARG A 104 7.949 3.558 -39.166 1.00 0.00 C ATOM 1601 NE ARG A 104 8.510 4.404 -40.216 1.00 0.00 N ATOM 1602 CZ ARG A 104 8.083 4.397 -41.474 1.00 0.00 C ATOM 1603 NH1 ARG A 104 7.094 3.591 -41.836 1.00 0.00 N ATOM 1604 NH2 ARG A 104 8.645 5.196 -42.371 1.00 0.00 N ATOM 0 H ARG A 104 7.453 2.317 -34.754 1.00 0.00 H new ATOM 0 HA ARG A 104 6.515 2.461 -37.557 1.00 0.00 H new ATOM 0 HB2 ARG A 104 9.193 2.249 -36.232 1.00 0.00 H new ATOM 0 HB3 ARG A 104 8.973 1.354 -37.722 1.00 0.00 H new ATOM 0 HG2 ARG A 104 8.696 4.348 -37.315 1.00 0.00 H new ATOM 0 HG3 ARG A 104 9.900 3.509 -38.272 1.00 0.00 H new ATOM 0 HD2 ARG A 104 7.781 2.555 -39.560 1.00 0.00 H new ATOM 0 HD3 ARG A 104 6.977 3.950 -38.866 1.00 0.00 H new ATOM 0 HE ARG A 104 9.272 5.035 -39.970 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.660 2.975 -41.148 1.00 0.00 H new ATOM 0 HH12 ARG A 104 6.767 3.587 -42.802 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.406 5.817 -42.095 1.00 0.00 H new ATOM 0 HH22 ARG A 104 8.316 5.190 -43.337 1.00 0.00 H new ATOM 1618 N SER A 105 6.111 0.030 -37.805 1.00 0.00 N ATOM 1619 CA SER A 105 5.744 -1.377 -37.908 1.00 0.00 C ATOM 1620 C SER A 105 6.983 -2.267 -37.859 1.00 0.00 C ATOM 1621 O SER A 105 7.120 -3.108 -36.972 1.00 0.00 O ATOM 1622 CB SER A 105 4.971 -1.632 -39.204 1.00 0.00 C ATOM 1623 OG SER A 105 5.634 -1.053 -40.315 1.00 0.00 O ATOM 0 H SER A 105 5.772 0.611 -38.571 1.00 0.00 H new ATOM 0 HA SER A 105 5.107 -1.623 -37.059 1.00 0.00 H new ATOM 0 HB2 SER A 105 4.861 -2.705 -39.361 1.00 0.00 H new ATOM 0 HB3 SER A 105 3.966 -1.218 -39.120 1.00 0.00 H new ATOM 0 HG SER A 105 5.121 -1.231 -41.131 1.00 0.00 H new ATOM 1629 N GLU A 106 7.882 -2.072 -38.819 1.00 0.00 N ATOM 1630 CA GLU A 106 9.109 -2.857 -38.885 1.00 0.00 C ATOM 1631 C GLU A 106 9.801 -2.901 -37.526 1.00 0.00 C ATOM 1632 O GLU A 106 10.310 -3.941 -37.110 1.00 0.00 O ATOM 1633 CB GLU A 106 10.058 -2.272 -39.934 1.00 0.00 C ATOM 1634 CG GLU A 106 10.606 -0.905 -39.564 1.00 0.00 C ATOM 1635 CD GLU A 106 11.603 -0.381 -40.580 1.00 0.00 C ATOM 1636 OE1 GLU A 106 12.128 -1.195 -41.369 1.00 0.00 O ATOM 1637 OE2 GLU A 106 11.858 0.841 -40.587 1.00 0.00 O ATOM 0 H GLU A 106 7.784 -1.378 -39.560 1.00 0.00 H new ATOM 0 HA GLU A 106 8.844 -3.875 -39.171 1.00 0.00 H new ATOM 0 HB2 GLU A 106 10.891 -2.960 -40.082 1.00 0.00 H new ATOM 0 HB3 GLU A 106 9.532 -2.198 -40.886 1.00 0.00 H new ATOM 0 HG2 GLU A 106 9.780 -0.199 -39.473 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.085 -0.962 -38.587 1.00 0.00 H new ATOM 1644 N ASN A 107 9.816 -1.764 -36.839 1.00 0.00 N ATOM 1645 CA ASN A 107 10.447 -1.671 -35.527 1.00 0.00 C ATOM 1646 C ASN A 107 9.870 -2.713 -34.572 1.00 0.00 C ATOM 1647 O ASN A 107 10.583 -3.262 -33.731 1.00 0.00 O ATOM 1648 CB ASN A 107 10.258 -0.269 -34.944 1.00 0.00 C ATOM 1649 CG ASN A 107 11.389 0.669 -35.317 1.00 0.00 C ATOM 1650 OD1 ASN A 107 11.870 0.660 -36.451 1.00 0.00 O ATOM 1651 ND2 ASN A 107 11.820 1.485 -34.362 1.00 0.00 N ATOM 0 H ASN A 107 9.398 -0.894 -37.169 1.00 0.00 H new ATOM 0 HA ASN A 107 11.513 -1.865 -35.649 1.00 0.00 H new ATOM 0 HB2 ASN A 107 9.314 0.145 -35.299 1.00 0.00 H new ATOM 0 HB3 ASN A 107 10.188 -0.336 -33.858 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.579 2.139 -34.554 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.392 1.458 -33.437 1.00 0.00 H new ATOM 1658 N LEU A 108 8.576 -2.980 -34.708 1.00 0.00 N ATOM 1659 CA LEU A 108 7.903 -3.956 -33.859 1.00 0.00 C ATOM 1660 C LEU A 108 8.235 -5.380 -34.296 1.00 0.00 C ATOM 1661 O LEU A 108 8.482 -6.254 -33.466 1.00 0.00 O ATOM 1662 CB LEU A 108 6.390 -3.739 -33.898 1.00 0.00 C ATOM 1663 CG LEU A 108 5.566 -4.567 -32.911 1.00 0.00 C ATOM 1664 CD1 LEU A 108 6.175 -4.500 -31.520 1.00 0.00 C ATOM 1665 CD2 LEU A 108 4.122 -4.088 -32.887 1.00 0.00 C ATOM 0 H LEU A 108 7.972 -2.534 -35.398 1.00 0.00 H new ATOM 0 HA LEU A 108 8.258 -3.817 -32.838 1.00 0.00 H new ATOM 0 HB2 LEU A 108 6.190 -2.684 -33.712 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.038 -3.957 -34.906 1.00 0.00 H new ATOM 0 HG LEU A 108 5.577 -5.606 -33.241 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.575 -5.095 -30.831 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.191 -4.893 -31.549 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.196 -3.464 -31.181 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.551 -4.689 -32.179 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.091 -3.042 -32.583 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.688 -4.190 -33.882 1.00 0.00 H new ATOM 1677 N LYS A 109 8.241 -5.604 -35.606 1.00 0.00 N ATOM 1678 CA LYS A 109 8.546 -6.920 -36.155 1.00 0.00 C ATOM 1679 C LYS A 109 9.980 -7.327 -35.829 1.00 0.00 C ATOM 1680 O LYS A 109 10.254 -8.493 -35.544 1.00 0.00 O ATOM 1681 CB LYS A 109 8.337 -6.923 -37.671 1.00 0.00 C ATOM 1682 CG LYS A 109 7.199 -6.028 -38.130 1.00 0.00 C ATOM 1683 CD LYS A 109 5.945 -6.251 -37.301 1.00 0.00 C ATOM 1684 CE LYS A 109 5.213 -7.514 -37.726 1.00 0.00 C ATOM 1685 NZ LYS A 109 5.781 -8.729 -37.078 1.00 0.00 N ATOM 0 H LYS A 109 8.038 -4.891 -36.307 1.00 0.00 H new ATOM 0 HA LYS A 109 7.869 -7.642 -35.699 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.259 -6.603 -38.157 1.00 0.00 H new ATOM 0 HB3 LYS A 109 8.141 -7.943 -38.000 1.00 0.00 H new ATOM 0 HG2 LYS A 109 7.504 -4.984 -38.057 1.00 0.00 H new ATOM 0 HG3 LYS A 109 6.982 -6.224 -39.180 1.00 0.00 H new ATOM 0 HD2 LYS A 109 6.212 -6.322 -36.247 1.00 0.00 H new ATOM 0 HD3 LYS A 109 5.282 -5.392 -37.405 1.00 0.00 H new ATOM 0 HE2 LYS A 109 4.157 -7.426 -37.470 1.00 0.00 H new ATOM 0 HE3 LYS A 109 5.270 -7.620 -38.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 6.030 -9.427 -37.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 6.633 -8.470 -36.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 5.077 -9.139 -36.432 1.00 0.00 H new ATOM 1699 N ILE A 110 10.889 -6.359 -35.871 1.00 0.00 N ATOM 1700 CA ILE A 110 12.293 -6.617 -35.577 1.00 0.00 C ATOM 1701 C ILE A 110 12.515 -6.810 -34.081 1.00 0.00 C ATOM 1702 O ILE A 110 13.391 -7.570 -33.665 1.00 0.00 O ATOM 1703 CB ILE A 110 13.192 -5.470 -36.074 1.00 0.00 C ATOM 1704 CG1 ILE A 110 13.216 -5.438 -37.604 1.00 0.00 C ATOM 1705 CG2 ILE A 110 14.601 -5.624 -35.521 1.00 0.00 C ATOM 1706 CD1 ILE A 110 13.915 -4.222 -38.172 1.00 0.00 C ATOM 0 H ILE A 110 10.678 -5.389 -36.106 1.00 0.00 H new ATOM 0 HA ILE A 110 12.562 -7.533 -36.103 1.00 0.00 H new ATOM 0 HB ILE A 110 12.782 -4.526 -35.715 1.00 0.00 H new ATOM 0 HG12 ILE A 110 13.712 -6.337 -37.970 1.00 0.00 H new ATOM 0 HG13 ILE A 110 12.192 -5.465 -37.976 1.00 0.00 H new ATOM 0 HG21 ILE A 110 15.225 -4.806 -35.881 1.00 0.00 H new ATOM 0 HG22 ILE A 110 14.569 -5.603 -34.432 1.00 0.00 H new ATOM 0 HG23 ILE A 110 15.021 -6.573 -35.853 1.00 0.00 H new ATOM 0 HD11 ILE A 110 13.894 -4.266 -39.261 1.00 0.00 H new ATOM 0 HD12 ILE A 110 13.406 -3.319 -37.835 1.00 0.00 H new ATOM 0 HD13 ILE A 110 14.950 -4.204 -37.830 1.00 0.00 H new ATOM 1718 N HIS A 111 11.714 -6.119 -33.275 1.00 0.00 N ATOM 1719 CA HIS A 111 11.821 -6.216 -31.824 1.00 0.00 C ATOM 1720 C HIS A 111 11.217 -7.524 -31.321 1.00 0.00 C ATOM 1721 O HIS A 111 11.817 -8.224 -30.504 1.00 0.00 O ATOM 1722 CB HIS A 111 11.123 -5.030 -31.159 1.00 0.00 C ATOM 1723 CG HIS A 111 10.723 -5.288 -29.739 1.00 0.00 C ATOM 1724 ND1 HIS A 111 11.616 -5.261 -28.689 1.00 0.00 N ATOM 1725 CD2 HIS A 111 9.517 -5.579 -29.198 1.00 0.00 C ATOM 1726 CE1 HIS A 111 10.977 -5.525 -27.564 1.00 0.00 C ATOM 1727 NE2 HIS A 111 9.702 -5.721 -27.845 1.00 0.00 N ATOM 0 H HIS A 111 10.984 -5.486 -33.603 1.00 0.00 H new ATOM 0 HA HIS A 111 12.879 -6.199 -31.561 1.00 0.00 H new ATOM 0 HB2 HIS A 111 11.786 -4.165 -31.189 1.00 0.00 H new ATOM 0 HB3 HIS A 111 10.235 -4.771 -31.736 1.00 0.00 H new ATOM 0 HD1 HIS A 111 12.614 -5.067 -28.769 1.00 0.00 H new ATOM 0 HD2 HIS A 111 8.583 -5.681 -29.731 1.00 0.00 H new ATOM 0 HE1 HIS A 111 11.422 -5.573 -26.581 1.00 0.00 H new ATOM 1735 N LYS A 112 10.027 -7.848 -31.813 1.00 0.00 N ATOM 1736 CA LYS A 112 9.341 -9.071 -31.414 1.00 0.00 C ATOM 1737 C LYS A 112 10.225 -10.292 -31.650 1.00 0.00 C ATOM 1738 O LYS A 112 10.167 -11.266 -30.899 1.00 0.00 O ATOM 1739 CB LYS A 112 8.030 -9.221 -32.190 1.00 0.00 C ATOM 1740 CG LYS A 112 6.893 -8.385 -31.629 1.00 0.00 C ATOM 1741 CD LYS A 112 5.851 -8.076 -32.691 1.00 0.00 C ATOM 1742 CE LYS A 112 5.314 -9.346 -33.332 1.00 0.00 C ATOM 1743 NZ LYS A 112 6.267 -9.911 -34.327 1.00 0.00 N ATOM 0 H LYS A 112 9.517 -7.280 -32.490 1.00 0.00 H new ATOM 0 HA LYS A 112 9.121 -9.003 -30.349 1.00 0.00 H new ATOM 0 HB2 LYS A 112 8.198 -8.939 -33.229 1.00 0.00 H new ATOM 0 HB3 LYS A 112 7.734 -10.270 -32.188 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.424 -8.916 -30.801 1.00 0.00 H new ATOM 0 HG3 LYS A 112 7.290 -7.453 -31.226 1.00 0.00 H new ATOM 0 HD2 LYS A 112 5.029 -7.517 -32.244 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.290 -7.438 -33.458 1.00 0.00 H new ATOM 0 HE2 LYS A 112 5.115 -10.087 -32.558 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.363 -9.132 -33.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 5.736 -10.352 -35.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 6.867 -9.150 -34.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.865 -10.627 -33.867 1.00 0.00 H new ATOM 1757 N ARG A 113 11.043 -10.232 -32.695 1.00 0.00 N ATOM 1758 CA ARG A 113 11.940 -11.332 -33.028 1.00 0.00 C ATOM 1759 C ARG A 113 13.203 -11.281 -32.174 1.00 0.00 C ATOM 1760 O ARG A 113 13.875 -12.295 -31.977 1.00 0.00 O ATOM 1761 CB ARG A 113 12.311 -11.284 -34.511 1.00 0.00 C ATOM 1762 CG ARG A 113 12.972 -9.982 -34.932 1.00 0.00 C ATOM 1763 CD ARG A 113 13.330 -9.991 -36.410 1.00 0.00 C ATOM 1764 NE ARG A 113 14.520 -9.190 -36.689 1.00 0.00 N ATOM 1765 CZ ARG A 113 15.760 -9.618 -36.479 1.00 0.00 C ATOM 1766 NH1 ARG A 113 15.971 -10.833 -35.990 1.00 0.00 N ATOM 1767 NH2 ARG A 113 16.791 -8.832 -36.759 1.00 0.00 N ATOM 0 H ARG A 113 11.103 -9.433 -33.326 1.00 0.00 H new ATOM 0 HA ARG A 113 11.420 -12.267 -32.821 1.00 0.00 H new ATOM 0 HB2 ARG A 113 12.983 -12.112 -34.735 1.00 0.00 H new ATOM 0 HB3 ARG A 113 11.411 -11.434 -35.107 1.00 0.00 H new ATOM 0 HG2 ARG A 113 12.301 -9.148 -34.724 1.00 0.00 H new ATOM 0 HG3 ARG A 113 13.873 -9.822 -34.339 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.499 -11.017 -36.736 1.00 0.00 H new ATOM 0 HD3 ARG A 113 12.490 -9.607 -36.989 1.00 0.00 H new ATOM 0 HE ARG A 113 14.392 -8.251 -37.066 1.00 0.00 H new ATOM 0 HH11 ARG A 113 15.180 -11.440 -35.775 1.00 0.00 H new ATOM 0 HH12 ARG A 113 16.924 -11.160 -35.829 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.632 -7.898 -37.136 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.743 -9.162 -36.597 1.00 0.00 H new ATOM 1781 N THR A 114 13.523 -10.094 -31.669 1.00 0.00 N ATOM 1782 CA THR A 114 14.706 -9.910 -30.838 1.00 0.00 C ATOM 1783 C THR A 114 14.336 -9.845 -29.361 1.00 0.00 C ATOM 1784 O THR A 114 15.208 -9.781 -28.494 1.00 0.00 O ATOM 1785 CB THR A 114 15.468 -8.627 -31.221 1.00 0.00 C ATOM 1786 OG1 THR A 114 16.854 -8.762 -30.887 1.00 0.00 O ATOM 1787 CG2 THR A 114 14.884 -7.417 -30.508 1.00 0.00 C ATOM 0 H THR A 114 12.979 -9.245 -31.821 1.00 0.00 H new ATOM 0 HA THR A 114 15.350 -10.772 -31.011 1.00 0.00 H new ATOM 0 HB THR A 114 15.367 -8.478 -32.296 1.00 0.00 H new ATOM 0 HG1 THR A 114 16.939 -9.199 -30.014 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.438 -6.523 -30.794 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.837 -7.300 -30.788 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.957 -7.560 -29.430 1.00 0.00 H new ATOM 1795 N HIS A 115 13.037 -9.863 -29.080 1.00 0.00 N ATOM 1796 CA HIS A 115 12.551 -9.808 -27.705 1.00 0.00 C ATOM 1797 C HIS A 115 11.492 -10.878 -27.460 1.00 0.00 C ATOM 1798 O HIS A 115 11.548 -11.607 -26.469 1.00 0.00 O ATOM 1799 CB HIS A 115 11.976 -8.425 -27.401 1.00 0.00 C ATOM 1800 CG HIS A 115 10.701 -8.466 -26.614 1.00 0.00 C ATOM 1801 ND1 HIS A 115 10.669 -8.553 -25.239 1.00 0.00 N ATOM 1802 CD2 HIS A 115 9.410 -8.431 -27.019 1.00 0.00 C ATOM 1803 CE1 HIS A 115 9.412 -8.571 -24.831 1.00 0.00 C ATOM 1804 NE2 HIS A 115 8.629 -8.497 -25.891 1.00 0.00 N ATOM 0 H HIS A 115 12.302 -9.915 -29.785 1.00 0.00 H new ATOM 0 HA HIS A 115 13.393 -9.997 -27.040 1.00 0.00 H new ATOM 0 HB2 HIS A 115 12.716 -7.846 -26.848 1.00 0.00 H new ATOM 0 HB3 HIS A 115 11.797 -7.900 -28.340 1.00 0.00 H new ATOM 0 HD1 HIS A 115 11.487 -8.597 -24.631 1.00 0.00 H new ATOM 0 HD2 HIS A 115 9.060 -8.364 -28.038 1.00 0.00 H new ATOM 0 HE1 HIS A 115 9.082 -8.635 -23.805 1.00 0.00 H new ATOM 1812 N THR A 116 10.526 -10.967 -28.369 1.00 0.00 N ATOM 1813 CA THR A 116 9.453 -11.946 -28.250 1.00 0.00 C ATOM 1814 C THR A 116 9.847 -13.274 -28.888 1.00 0.00 C ATOM 1815 O THR A 116 10.709 -13.321 -29.764 1.00 0.00 O ATOM 1816 CB THR A 116 8.155 -11.440 -28.907 1.00 0.00 C ATOM 1817 OG1 THR A 116 7.343 -10.770 -27.936 1.00 0.00 O ATOM 1818 CG2 THR A 116 7.373 -12.592 -29.520 1.00 0.00 C ATOM 0 H THR A 116 10.465 -10.373 -29.196 1.00 0.00 H new ATOM 0 HA THR A 116 9.278 -12.095 -27.184 1.00 0.00 H new ATOM 0 HB THR A 116 8.424 -10.742 -29.700 1.00 0.00 H new ATOM 0 HG1 THR A 116 6.458 -10.591 -28.317 1.00 0.00 H new ATOM 0 HG21 THR A 116 6.461 -12.210 -29.978 1.00 0.00 H new ATOM 0 HG22 THR A 116 7.982 -13.082 -30.279 1.00 0.00 H new ATOM 0 HG23 THR A 116 7.115 -13.311 -28.743 1.00 0.00 H new ATOM 1826 N GLY A 117 9.208 -14.352 -28.443 1.00 0.00 N ATOM 1827 CA GLY A 117 9.506 -15.666 -28.982 1.00 0.00 C ATOM 1828 C GLY A 117 10.216 -16.556 -27.982 1.00 0.00 C ATOM 1829 O GLY A 117 9.926 -17.748 -27.888 1.00 0.00 O ATOM 0 H GLY A 117 8.490 -14.339 -27.719 1.00 0.00 H new ATOM 0 HA2 GLY A 117 8.579 -16.145 -29.296 1.00 0.00 H new ATOM 0 HA3 GLY A 117 10.126 -15.558 -29.872 1.00 0.00 H new ATOM 1833 N GLU A 118 11.149 -15.976 -27.234 1.00 0.00 N ATOM 1834 CA GLU A 118 11.904 -16.727 -26.237 1.00 0.00 C ATOM 1835 C GLU A 118 11.189 -16.713 -24.889 1.00 0.00 C ATOM 1836 O GLU A 118 10.370 -15.835 -24.617 1.00 0.00 O ATOM 1837 CB GLU A 118 13.312 -16.146 -26.087 1.00 0.00 C ATOM 1838 CG GLU A 118 14.357 -17.176 -25.696 1.00 0.00 C ATOM 1839 CD GLU A 118 14.512 -17.310 -24.193 1.00 0.00 C ATOM 1840 OE1 GLU A 118 14.323 -16.299 -23.485 1.00 0.00 O ATOM 1841 OE2 GLU A 118 14.823 -18.426 -23.726 1.00 0.00 O ATOM 0 H GLU A 118 11.400 -14.990 -27.299 1.00 0.00 H new ATOM 0 HA GLU A 118 11.980 -17.760 -26.578 1.00 0.00 H new ATOM 0 HB2 GLU A 118 13.606 -15.682 -27.028 1.00 0.00 H new ATOM 0 HB3 GLU A 118 13.292 -15.357 -25.335 1.00 0.00 H new ATOM 0 HG2 GLU A 118 14.083 -18.143 -26.117 1.00 0.00 H new ATOM 0 HG3 GLU A 118 15.316 -16.899 -26.133 1.00 0.00 H new ATOM 1848 N LYS A 119 11.506 -17.692 -24.048 1.00 0.00 N ATOM 1849 CA LYS A 119 10.896 -17.794 -22.728 1.00 0.00 C ATOM 1850 C LYS A 119 11.697 -17.006 -21.696 1.00 0.00 C ATOM 1851 O LYS A 119 12.899 -17.208 -21.522 1.00 0.00 O ATOM 1852 CB LYS A 119 10.797 -19.260 -22.301 1.00 0.00 C ATOM 1853 CG LYS A 119 12.129 -19.867 -21.897 1.00 0.00 C ATOM 1854 CD LYS A 119 12.387 -19.704 -20.408 1.00 0.00 C ATOM 1855 CE LYS A 119 13.849 -19.949 -20.066 1.00 0.00 C ATOM 1856 NZ LYS A 119 14.170 -19.531 -18.673 1.00 0.00 N ATOM 0 H LYS A 119 12.182 -18.426 -24.258 1.00 0.00 H new ATOM 0 HA LYS A 119 9.893 -17.370 -22.785 1.00 0.00 H new ATOM 0 HB2 LYS A 119 10.102 -19.340 -21.465 1.00 0.00 H new ATOM 0 HB3 LYS A 119 10.376 -19.841 -23.122 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.141 -20.926 -22.156 1.00 0.00 H new ATOM 0 HG3 LYS A 119 12.932 -19.392 -22.461 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.103 -18.699 -20.096 1.00 0.00 H new ATOM 0 HD3 LYS A 119 11.760 -20.400 -19.851 1.00 0.00 H new ATOM 0 HE2 LYS A 119 14.079 -21.007 -20.190 1.00 0.00 H new ATOM 0 HE3 LYS A 119 14.482 -19.402 -20.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 15.023 -20.030 -18.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.339 -18.505 -18.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 13.373 -19.766 -18.048 1.00 0.00 H new ATOM 1870 N PRO A 120 11.017 -16.087 -20.993 1.00 0.00 N ATOM 1871 CA PRO A 120 11.646 -15.253 -19.966 1.00 0.00 C ATOM 1872 C PRO A 120 12.036 -16.053 -18.728 1.00 0.00 C ATOM 1873 O PRO A 120 13.145 -15.914 -18.211 1.00 0.00 O ATOM 1874 CB PRO A 120 10.557 -14.233 -19.622 1.00 0.00 C ATOM 1875 CG PRO A 120 9.278 -14.914 -19.967 1.00 0.00 C ATOM 1876 CD PRO A 120 9.583 -15.793 -21.148 1.00 0.00 C ATOM 0 HA PRO A 120 12.575 -14.804 -20.318 1.00 0.00 H new ATOM 0 HB2 PRO A 120 10.589 -13.961 -18.567 1.00 0.00 H new ATOM 0 HB3 PRO A 120 10.682 -13.313 -20.193 1.00 0.00 H new ATOM 0 HG2 PRO A 120 8.910 -15.503 -19.127 1.00 0.00 H new ATOM 0 HG3 PRO A 120 8.503 -14.188 -20.211 1.00 0.00 H new ATOM 0 HD2 PRO A 120 8.983 -16.703 -21.137 1.00 0.00 H new ATOM 0 HD3 PRO A 120 9.376 -15.286 -22.090 1.00 0.00 H new ATOM 1884 N PHE A 121 11.119 -16.891 -18.257 1.00 0.00 N ATOM 1885 CA PHE A 121 11.367 -17.713 -17.079 1.00 0.00 C ATOM 1886 C PHE A 121 11.249 -19.197 -17.416 1.00 0.00 C ATOM 1887 O PHE A 121 10.479 -19.586 -18.294 1.00 0.00 O ATOM 1888 CB PHE A 121 10.385 -17.353 -15.962 1.00 0.00 C ATOM 1889 CG PHE A 121 10.549 -15.951 -15.449 1.00 0.00 C ATOM 1890 CD1 PHE A 121 10.113 -14.870 -16.198 1.00 0.00 C ATOM 1891 CD2 PHE A 121 11.138 -15.715 -14.217 1.00 0.00 C ATOM 1892 CE1 PHE A 121 10.264 -13.579 -15.728 1.00 0.00 C ATOM 1893 CE2 PHE A 121 11.291 -14.426 -13.742 1.00 0.00 C ATOM 1894 CZ PHE A 121 10.852 -13.356 -14.498 1.00 0.00 C ATOM 0 H PHE A 121 10.197 -17.019 -18.673 1.00 0.00 H new ATOM 0 HA PHE A 121 12.383 -17.515 -16.737 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.367 -17.480 -16.329 1.00 0.00 H new ATOM 0 HB3 PHE A 121 10.515 -18.051 -15.135 1.00 0.00 H new ATOM 0 HD1 PHE A 121 9.650 -15.038 -17.159 1.00 0.00 H new ATOM 0 HD2 PHE A 121 11.481 -16.548 -13.621 1.00 0.00 H new ATOM 0 HE1 PHE A 121 9.922 -12.745 -16.322 1.00 0.00 H new ATOM 0 HE2 PHE A 121 11.753 -14.255 -12.781 1.00 0.00 H new ATOM 0 HZ PHE A 121 10.968 -12.348 -14.128 1.00 0.00 H new ATOM 1904 N LYS A 122 12.019 -20.020 -16.712 1.00 0.00 N ATOM 1905 CA LYS A 122 12.002 -21.461 -16.935 1.00 0.00 C ATOM 1906 C LYS A 122 11.663 -22.207 -15.648 1.00 0.00 C ATOM 1907 O LYS A 122 12.154 -21.864 -14.572 1.00 0.00 O ATOM 1908 CB LYS A 122 13.357 -21.932 -17.468 1.00 0.00 C ATOM 1909 CG LYS A 122 13.727 -23.339 -17.030 1.00 0.00 C ATOM 1910 CD LYS A 122 14.745 -23.964 -17.969 1.00 0.00 C ATOM 1911 CE LYS A 122 16.169 -23.627 -17.551 1.00 0.00 C ATOM 1912 NZ LYS A 122 16.470 -22.180 -17.728 1.00 0.00 N ATOM 0 H LYS A 122 12.663 -19.714 -15.982 1.00 0.00 H new ATOM 0 HA LYS A 122 11.232 -21.679 -17.675 1.00 0.00 H new ATOM 0 HB2 LYS A 122 13.344 -21.891 -18.557 1.00 0.00 H new ATOM 0 HB3 LYS A 122 14.130 -21.241 -17.133 1.00 0.00 H new ATOM 0 HG2 LYS A 122 14.132 -23.312 -16.018 1.00 0.00 H new ATOM 0 HG3 LYS A 122 12.831 -23.959 -16.998 1.00 0.00 H new ATOM 0 HD2 LYS A 122 14.614 -25.046 -17.981 1.00 0.00 H new ATOM 0 HD3 LYS A 122 14.570 -23.611 -18.985 1.00 0.00 H new ATOM 0 HE2 LYS A 122 16.316 -23.904 -16.507 1.00 0.00 H new ATOM 0 HE3 LYS A 122 16.870 -24.219 -18.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 17.485 -22.057 -17.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 15.921 -21.806 -18.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 16.215 -21.664 -16.862 1.00 0.00 H new ATOM 1926 N CYS A 123 10.822 -23.229 -15.766 1.00 0.00 N ATOM 1927 CA CYS A 123 10.418 -24.024 -14.612 1.00 0.00 C ATOM 1928 C CYS A 123 11.622 -24.368 -13.740 1.00 0.00 C ATOM 1929 O CYS A 123 12.484 -25.151 -14.136 1.00 0.00 O ATOM 1930 CB CYS A 123 9.722 -25.308 -15.070 1.00 0.00 C ATOM 1931 SG CYS A 123 9.301 -26.449 -13.714 1.00 0.00 S ATOM 0 H CYS A 123 10.407 -23.526 -16.649 1.00 0.00 H new ATOM 0 HA CYS A 123 9.720 -23.432 -14.020 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.810 -25.043 -15.604 1.00 0.00 H new ATOM 0 HB3 CYS A 123 10.368 -25.826 -15.779 1.00 0.00 H new ATOM 1936 N GLU A 124 11.672 -23.776 -12.551 1.00 0.00 N ATOM 1937 CA GLU A 124 12.771 -24.019 -11.623 1.00 0.00 C ATOM 1938 C GLU A 124 13.029 -25.515 -11.466 1.00 0.00 C ATOM 1939 O GLU A 124 14.102 -25.929 -11.026 1.00 0.00 O ATOM 1940 CB GLU A 124 12.463 -23.398 -10.259 1.00 0.00 C ATOM 1941 CG GLU A 124 11.977 -21.960 -10.341 1.00 0.00 C ATOM 1942 CD GLU A 124 12.269 -21.173 -9.078 1.00 0.00 C ATOM 1943 OE1 GLU A 124 13.092 -21.642 -8.263 1.00 0.00 O ATOM 1944 OE2 GLU A 124 11.675 -20.089 -8.905 1.00 0.00 O ATOM 0 H GLU A 124 10.965 -23.125 -12.208 1.00 0.00 H new ATOM 0 HA GLU A 124 13.668 -23.554 -12.032 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.706 -24.001 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 124 13.360 -23.435 -9.641 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.452 -21.468 -11.190 1.00 0.00 H new ATOM 0 HG3 GLU A 124 10.903 -21.953 -10.529 1.00 0.00 H new ATOM 1951 N PHE A 125 12.037 -26.322 -11.829 1.00 0.00 N ATOM 1952 CA PHE A 125 12.155 -27.772 -11.728 1.00 0.00 C ATOM 1953 C PHE A 125 13.068 -28.321 -12.819 1.00 0.00 C ATOM 1954 O PHE A 125 12.735 -28.274 -14.003 1.00 0.00 O ATOM 1955 CB PHE A 125 10.774 -28.425 -11.825 1.00 0.00 C ATOM 1956 CG PHE A 125 10.665 -29.712 -11.059 1.00 0.00 C ATOM 1957 CD1 PHE A 125 10.318 -29.708 -9.717 1.00 0.00 C ATOM 1958 CD2 PHE A 125 10.909 -30.926 -11.680 1.00 0.00 C ATOM 1959 CE1 PHE A 125 10.216 -30.890 -9.009 1.00 0.00 C ATOM 1960 CE2 PHE A 125 10.808 -32.112 -10.977 1.00 0.00 C ATOM 1961 CZ PHE A 125 10.462 -32.094 -9.640 1.00 0.00 C ATOM 0 H PHE A 125 11.143 -25.996 -12.196 1.00 0.00 H new ATOM 0 HA PHE A 125 12.594 -28.009 -10.759 1.00 0.00 H new ATOM 0 HB2 PHE A 125 10.024 -27.726 -11.455 1.00 0.00 H new ATOM 0 HB3 PHE A 125 10.543 -28.615 -12.873 1.00 0.00 H new ATOM 0 HD1 PHE A 125 10.125 -28.769 -9.219 1.00 0.00 H new ATOM 0 HD2 PHE A 125 11.181 -30.946 -12.725 1.00 0.00 H new ATOM 0 HE1 PHE A 125 9.944 -30.873 -7.964 1.00 0.00 H new ATOM 0 HE2 PHE A 125 11.000 -33.052 -11.473 1.00 0.00 H new ATOM 0 HZ PHE A 125 10.384 -33.020 -9.089 1.00 0.00 H new ATOM 1971 N GLU A 126 14.222 -28.841 -12.412 1.00 0.00 N ATOM 1972 CA GLU A 126 15.184 -29.397 -13.355 1.00 0.00 C ATOM 1973 C GLU A 126 14.589 -30.589 -14.100 1.00 0.00 C ATOM 1974 O GLU A 126 13.677 -31.251 -13.606 1.00 0.00 O ATOM 1975 CB GLU A 126 16.460 -29.823 -12.625 1.00 0.00 C ATOM 1976 CG GLU A 126 16.676 -31.327 -12.604 1.00 0.00 C ATOM 1977 CD GLU A 126 15.633 -32.055 -11.778 1.00 0.00 C ATOM 1978 OE1 GLU A 126 15.082 -31.439 -10.842 1.00 0.00 O ATOM 1979 OE2 GLU A 126 15.369 -33.240 -12.068 1.00 0.00 O ATOM 0 H GLU A 126 14.513 -28.889 -11.435 1.00 0.00 H new ATOM 0 HA GLU A 126 15.431 -28.623 -14.081 1.00 0.00 H new ATOM 0 HB2 GLU A 126 17.317 -29.348 -13.102 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.422 -29.456 -11.600 1.00 0.00 H new ATOM 0 HG2 GLU A 126 16.656 -31.707 -13.625 1.00 0.00 H new ATOM 0 HG3 GLU A 126 17.667 -31.542 -12.203 1.00 0.00 H new ATOM 1986 N GLY A 127 15.112 -30.856 -15.293 1.00 0.00 N ATOM 1987 CA GLY A 127 14.621 -31.966 -16.087 1.00 0.00 C ATOM 1988 C GLY A 127 13.200 -31.750 -16.569 1.00 0.00 C ATOM 1989 O GLY A 127 12.612 -32.625 -17.206 1.00 0.00 O ATOM 0 H GLY A 127 15.867 -30.323 -15.723 1.00 0.00 H new ATOM 0 HA2 GLY A 127 15.275 -32.111 -16.947 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.666 -32.880 -15.495 1.00 0.00 H new ATOM 1993 N CYS A 128 12.645 -30.582 -16.264 1.00 0.00 N ATOM 1994 CA CYS A 128 11.283 -30.253 -16.668 1.00 0.00 C ATOM 1995 C CYS A 128 11.284 -29.321 -17.876 1.00 0.00 C ATOM 1996 O CYS A 128 12.231 -28.562 -18.087 1.00 0.00 O ATOM 1997 CB CYS A 128 10.527 -29.602 -15.508 1.00 0.00 C ATOM 1998 SG CYS A 128 8.714 -29.667 -15.672 1.00 0.00 S ATOM 0 H CYS A 128 13.118 -29.847 -15.738 1.00 0.00 H new ATOM 0 HA CYS A 128 10.780 -31.179 -16.946 1.00 0.00 H new ATOM 0 HB2 CYS A 128 10.815 -30.094 -14.579 1.00 0.00 H new ATOM 0 HB3 CYS A 128 10.837 -28.560 -15.426 1.00 0.00 H new ATOM 2003 N ASP A 129 10.218 -29.383 -18.666 1.00 0.00 N ATOM 2004 CA ASP A 129 10.094 -28.544 -19.852 1.00 0.00 C ATOM 2005 C ASP A 129 8.813 -27.717 -19.802 1.00 0.00 C ATOM 2006 O ASP A 129 7.717 -28.241 -19.997 1.00 0.00 O ATOM 2007 CB ASP A 129 10.111 -29.405 -21.116 1.00 0.00 C ATOM 2008 CG ASP A 129 10.094 -28.573 -22.383 1.00 0.00 C ATOM 2009 OD1 ASP A 129 9.013 -28.061 -22.743 1.00 0.00 O ATOM 2010 OD2 ASP A 129 11.162 -28.434 -23.016 1.00 0.00 O ATOM 0 H ASP A 129 9.427 -30.006 -18.506 1.00 0.00 H new ATOM 0 HA ASP A 129 10.944 -27.862 -19.875 1.00 0.00 H new ATOM 0 HB2 ASP A 129 11.000 -30.036 -21.111 1.00 0.00 H new ATOM 0 HB3 ASP A 129 9.248 -30.071 -21.110 1.00 0.00 H new ATOM 2015 N ARG A 130 8.961 -26.423 -19.537 1.00 0.00 N ATOM 2016 CA ARG A 130 7.816 -25.524 -19.458 1.00 0.00 C ATOM 2017 C ARG A 130 8.227 -24.090 -19.778 1.00 0.00 C ATOM 2018 O ARG A 130 9.367 -23.833 -20.165 1.00 0.00 O ATOM 2019 CB ARG A 130 7.186 -25.586 -18.065 1.00 0.00 C ATOM 2020 CG ARG A 130 6.825 -26.995 -17.622 1.00 0.00 C ATOM 2021 CD ARG A 130 5.691 -27.568 -18.457 1.00 0.00 C ATOM 2022 NE ARG A 130 5.720 -29.027 -18.492 1.00 0.00 N ATOM 2023 CZ ARG A 130 4.972 -29.758 -19.312 1.00 0.00 C ATOM 2024 NH1 ARG A 130 4.142 -29.168 -20.160 1.00 0.00 N ATOM 2025 NH2 ARG A 130 5.055 -31.082 -19.284 1.00 0.00 N ATOM 0 H ARG A 130 9.862 -25.974 -19.373 1.00 0.00 H new ATOM 0 HA ARG A 130 7.082 -25.847 -20.196 1.00 0.00 H new ATOM 0 HB2 ARG A 130 7.878 -25.153 -17.343 1.00 0.00 H new ATOM 0 HB3 ARG A 130 6.287 -24.969 -18.054 1.00 0.00 H new ATOM 0 HG2 ARG A 130 7.700 -27.639 -17.705 1.00 0.00 H new ATOM 0 HG3 ARG A 130 6.535 -26.984 -16.571 1.00 0.00 H new ATOM 0 HD2 ARG A 130 4.737 -27.234 -18.050 1.00 0.00 H new ATOM 0 HD3 ARG A 130 5.757 -27.180 -19.473 1.00 0.00 H new ATOM 0 HE ARG A 130 6.349 -29.512 -17.852 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.076 -28.150 -20.184 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.569 -29.731 -20.788 1.00 0.00 H new ATOM 0 HH21 ARG A 130 5.693 -31.539 -18.633 1.00 0.00 H new ATOM 0 HH22 ARG A 130 4.481 -31.642 -19.914 1.00 0.00 H new ATOM 2039 N ARG A 131 7.291 -23.161 -19.615 1.00 0.00 N ATOM 2040 CA ARG A 131 7.556 -21.753 -19.888 1.00 0.00 C ATOM 2041 C ARG A 131 6.651 -20.857 -19.048 1.00 0.00 C ATOM 2042 O ARG A 131 5.431 -21.028 -19.033 1.00 0.00 O ATOM 2043 CB ARG A 131 7.352 -21.454 -21.374 1.00 0.00 C ATOM 2044 CG ARG A 131 6.309 -22.339 -22.037 1.00 0.00 C ATOM 2045 CD ARG A 131 5.873 -21.777 -23.381 1.00 0.00 C ATOM 2046 NE ARG A 131 5.147 -20.518 -23.238 1.00 0.00 N ATOM 2047 CZ ARG A 131 4.450 -19.956 -24.220 1.00 0.00 C ATOM 2048 NH1 ARG A 131 4.385 -20.539 -25.409 1.00 0.00 N ATOM 2049 NH2 ARG A 131 3.816 -18.809 -24.012 1.00 0.00 N ATOM 0 H ARG A 131 6.343 -23.357 -19.295 1.00 0.00 H new ATOM 0 HA ARG A 131 8.592 -21.545 -19.621 1.00 0.00 H new ATOM 0 HB2 ARG A 131 7.057 -20.411 -21.489 1.00 0.00 H new ATOM 0 HB3 ARG A 131 8.302 -21.575 -21.894 1.00 0.00 H new ATOM 0 HG2 ARG A 131 6.715 -23.341 -22.175 1.00 0.00 H new ATOM 0 HG3 ARG A 131 5.442 -22.434 -21.383 1.00 0.00 H new ATOM 0 HD2 ARG A 131 6.749 -21.621 -24.010 1.00 0.00 H new ATOM 0 HD3 ARG A 131 5.241 -22.504 -23.890 1.00 0.00 H new ATOM 0 HE ARG A 131 5.177 -20.044 -22.335 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.871 -21.421 -25.572 1.00 0.00 H new ATOM 0 HH12 ARG A 131 3.849 -20.105 -26.161 1.00 0.00 H new ATOM 0 HH21 ARG A 131 3.864 -18.358 -23.098 1.00 0.00 H new ATOM 0 HH22 ARG A 131 3.281 -18.378 -24.766 1.00 0.00 H new ATOM 2063 N PHE A 132 7.256 -19.901 -18.351 1.00 0.00 N ATOM 2064 CA PHE A 132 6.505 -18.979 -17.507 1.00 0.00 C ATOM 2065 C PHE A 132 6.897 -17.533 -17.799 1.00 0.00 C ATOM 2066 O PHE A 132 8.049 -17.245 -18.122 1.00 0.00 O ATOM 2067 CB PHE A 132 6.744 -19.296 -16.029 1.00 0.00 C ATOM 2068 CG PHE A 132 6.388 -20.706 -15.653 1.00 0.00 C ATOM 2069 CD1 PHE A 132 5.070 -21.134 -15.686 1.00 0.00 C ATOM 2070 CD2 PHE A 132 7.370 -21.603 -15.268 1.00 0.00 C ATOM 2071 CE1 PHE A 132 4.740 -22.430 -15.340 1.00 0.00 C ATOM 2072 CE2 PHE A 132 7.046 -22.902 -14.921 1.00 0.00 C ATOM 2073 CZ PHE A 132 5.729 -23.316 -14.958 1.00 0.00 C ATOM 0 H PHE A 132 8.264 -19.745 -18.354 1.00 0.00 H new ATOM 0 HA PHE A 132 5.445 -19.102 -17.730 1.00 0.00 H new ATOM 0 HB2 PHE A 132 7.793 -19.119 -15.793 1.00 0.00 H new ATOM 0 HB3 PHE A 132 6.160 -18.607 -15.419 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.293 -20.447 -15.985 1.00 0.00 H new ATOM 0 HD2 PHE A 132 8.402 -21.284 -15.238 1.00 0.00 H new ATOM 0 HE1 PHE A 132 3.709 -22.751 -15.368 1.00 0.00 H new ATOM 0 HE2 PHE A 132 7.822 -23.591 -14.622 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.473 -24.330 -14.689 1.00 0.00 H new ATOM 2083 N ALA A 133 5.930 -16.629 -17.682 1.00 0.00 N ATOM 2084 CA ALA A 133 6.174 -15.214 -17.931 1.00 0.00 C ATOM 2085 C ALA A 133 6.333 -14.445 -16.623 1.00 0.00 C ATOM 2086 O ALA A 133 6.781 -13.300 -16.617 1.00 0.00 O ATOM 2087 CB ALA A 133 5.043 -14.621 -18.759 1.00 0.00 C ATOM 0 H ALA A 133 4.971 -16.851 -17.416 1.00 0.00 H new ATOM 0 HA ALA A 133 7.105 -15.125 -18.490 1.00 0.00 H new ATOM 0 HB1 ALA A 133 5.238 -13.564 -18.937 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.978 -15.144 -19.713 1.00 0.00 H new ATOM 0 HB3 ALA A 133 4.102 -14.730 -18.220 1.00 0.00 H new ATOM 2093 N ASN A 134 5.963 -15.084 -15.518 1.00 0.00 N ATOM 2094 CA ASN A 134 6.064 -14.459 -14.204 1.00 0.00 C ATOM 2095 C ASN A 134 6.545 -15.463 -13.161 1.00 0.00 C ATOM 2096 O ASN A 134 6.284 -16.661 -13.270 1.00 0.00 O ATOM 2097 CB ASN A 134 4.710 -13.881 -13.786 1.00 0.00 C ATOM 2098 CG ASN A 134 3.582 -14.884 -13.937 1.00 0.00 C ATOM 2099 OD1 ASN A 134 2.857 -15.167 -12.983 1.00 0.00 O ATOM 2100 ND2 ASN A 134 3.429 -15.426 -15.139 1.00 0.00 N ATOM 0 H ASN A 134 5.591 -16.034 -15.506 1.00 0.00 H new ATOM 0 HA ASN A 134 6.792 -13.651 -14.268 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.763 -13.552 -12.748 1.00 0.00 H new ATOM 0 HB3 ASN A 134 4.492 -13.000 -14.389 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.687 -16.107 -15.301 1.00 0.00 H new ATOM 0 HD22 ASN A 134 4.054 -15.162 -15.901 1.00 0.00 H new ATOM 2107 N SER A 135 7.247 -14.964 -12.148 1.00 0.00 N ATOM 2108 CA SER A 135 7.768 -15.817 -11.086 1.00 0.00 C ATOM 2109 C SER A 135 6.631 -16.501 -10.332 1.00 0.00 C ATOM 2110 O SER A 135 6.769 -17.635 -9.875 1.00 0.00 O ATOM 2111 CB SER A 135 8.618 -14.996 -10.114 1.00 0.00 C ATOM 2112 OG SER A 135 7.802 -14.246 -9.231 1.00 0.00 O ATOM 0 H SER A 135 7.468 -13.974 -12.041 1.00 0.00 H new ATOM 0 HA SER A 135 8.392 -16.585 -11.544 1.00 0.00 H new ATOM 0 HB2 SER A 135 9.264 -15.660 -9.541 1.00 0.00 H new ATOM 0 HB3 SER A 135 9.268 -14.323 -10.673 1.00 0.00 H new ATOM 0 HG SER A 135 8.369 -13.732 -8.619 1.00 0.00 H new ATOM 2118 N SER A 136 5.508 -15.801 -10.206 1.00 0.00 N ATOM 2119 CA SER A 136 4.348 -16.338 -9.505 1.00 0.00 C ATOM 2120 C SER A 136 3.848 -17.612 -10.178 1.00 0.00 C ATOM 2121 O SER A 136 3.720 -18.656 -9.538 1.00 0.00 O ATOM 2122 CB SER A 136 3.227 -15.298 -9.459 1.00 0.00 C ATOM 2123 OG SER A 136 2.007 -15.881 -9.034 1.00 0.00 O ATOM 0 H SER A 136 5.377 -14.861 -10.580 1.00 0.00 H new ATOM 0 HA SER A 136 4.651 -16.581 -8.486 1.00 0.00 H new ATOM 0 HB2 SER A 136 3.503 -14.491 -8.781 1.00 0.00 H new ATOM 0 HB3 SER A 136 3.097 -14.855 -10.446 1.00 0.00 H new ATOM 0 HG SER A 136 1.307 -15.195 -9.012 1.00 0.00 H new ATOM 2129 N ASP A 137 3.566 -17.519 -11.472 1.00 0.00 N ATOM 2130 CA ASP A 137 3.081 -18.663 -12.234 1.00 0.00 C ATOM 2131 C ASP A 137 4.065 -19.826 -12.155 1.00 0.00 C ATOM 2132 O ASP A 137 3.673 -20.970 -11.924 1.00 0.00 O ATOM 2133 CB ASP A 137 2.852 -18.271 -13.695 1.00 0.00 C ATOM 2134 CG ASP A 137 1.710 -19.040 -14.329 1.00 0.00 C ATOM 2135 OD1 ASP A 137 0.994 -19.753 -13.594 1.00 0.00 O ATOM 2136 OD2 ASP A 137 1.530 -18.928 -15.559 1.00 0.00 O ATOM 0 H ASP A 137 3.665 -16.662 -12.016 1.00 0.00 H new ATOM 0 HA ASP A 137 2.134 -18.982 -11.799 1.00 0.00 H new ATOM 0 HB2 ASP A 137 2.643 -17.203 -13.753 1.00 0.00 H new ATOM 0 HB3 ASP A 137 3.765 -18.448 -14.263 1.00 0.00 H new ATOM 2141 N ARG A 138 5.345 -19.525 -12.348 1.00 0.00 N ATOM 2142 CA ARG A 138 6.385 -20.545 -12.300 1.00 0.00 C ATOM 2143 C ARG A 138 6.333 -21.314 -10.983 1.00 0.00 C ATOM 2144 O ARG A 138 6.492 -22.535 -10.957 1.00 0.00 O ATOM 2145 CB ARG A 138 7.764 -19.907 -12.476 1.00 0.00 C ATOM 2146 CG ARG A 138 8.890 -20.702 -11.836 1.00 0.00 C ATOM 2147 CD ARG A 138 10.236 -20.360 -12.455 1.00 0.00 C ATOM 2148 NE ARG A 138 10.883 -19.241 -11.774 1.00 0.00 N ATOM 2149 CZ ARG A 138 11.937 -18.595 -12.260 1.00 0.00 C ATOM 2150 NH1 ARG A 138 12.460 -18.954 -13.425 1.00 0.00 N ATOM 2151 NH2 ARG A 138 12.469 -17.587 -11.582 1.00 0.00 N ATOM 0 H ARG A 138 5.686 -18.583 -12.539 1.00 0.00 H new ATOM 0 HA ARG A 138 6.209 -21.245 -13.117 1.00 0.00 H new ATOM 0 HB2 ARG A 138 7.970 -19.795 -13.541 1.00 0.00 H new ATOM 0 HB3 ARG A 138 7.749 -18.905 -12.047 1.00 0.00 H new ATOM 0 HG2 ARG A 138 8.918 -20.498 -10.766 1.00 0.00 H new ATOM 0 HG3 ARG A 138 8.695 -21.768 -11.952 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.886 -21.234 -12.415 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.099 -20.113 -13.508 1.00 0.00 H new ATOM 0 HE ARG A 138 10.505 -18.939 -10.876 1.00 0.00 H new ATOM 0 HH11 ARG A 138 12.053 -19.728 -13.950 1.00 0.00 H new ATOM 0 HH12 ARG A 138 13.269 -18.456 -13.796 1.00 0.00 H new ATOM 0 HH21 ARG A 138 12.069 -17.307 -10.686 1.00 0.00 H new ATOM 0 HH22 ARG A 138 13.278 -17.092 -11.956 1.00 0.00 H new ATOM 2165 N LYS A 139 6.110 -20.591 -9.891 1.00 0.00 N ATOM 2166 CA LYS A 139 6.035 -21.204 -8.570 1.00 0.00 C ATOM 2167 C LYS A 139 4.698 -21.910 -8.372 1.00 0.00 C ATOM 2168 O LYS A 139 4.538 -22.713 -7.452 1.00 0.00 O ATOM 2169 CB LYS A 139 6.230 -20.145 -7.482 1.00 0.00 C ATOM 2170 CG LYS A 139 7.660 -19.644 -7.370 1.00 0.00 C ATOM 2171 CD LYS A 139 8.606 -20.751 -6.937 1.00 0.00 C ATOM 2172 CE LYS A 139 9.862 -20.189 -6.288 1.00 0.00 C ATOM 2173 NZ LYS A 139 9.700 -20.024 -4.817 1.00 0.00 N ATOM 0 H LYS A 139 5.978 -19.580 -9.895 1.00 0.00 H new ATOM 0 HA LYS A 139 6.831 -21.945 -8.496 1.00 0.00 H new ATOM 0 HB2 LYS A 139 5.573 -19.300 -7.687 1.00 0.00 H new ATOM 0 HB3 LYS A 139 5.924 -20.561 -6.522 1.00 0.00 H new ATOM 0 HG2 LYS A 139 7.983 -19.244 -8.331 1.00 0.00 H new ATOM 0 HG3 LYS A 139 7.704 -18.825 -6.652 1.00 0.00 H new ATOM 0 HD2 LYS A 139 8.097 -21.412 -6.235 1.00 0.00 H new ATOM 0 HD3 LYS A 139 8.881 -21.355 -7.802 1.00 0.00 H new ATOM 0 HE2 LYS A 139 10.703 -20.853 -6.489 1.00 0.00 H new ATOM 0 HE3 LYS A 139 10.103 -19.225 -6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 10.577 -19.639 -4.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 8.914 -19.370 -4.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 9.495 -20.947 -4.385 1.00 0.00 H new ATOM 2187 N LYS A 140 3.740 -21.608 -9.242 1.00 0.00 N ATOM 2188 CA LYS A 140 2.417 -22.216 -9.166 1.00 0.00 C ATOM 2189 C LYS A 140 2.415 -23.598 -9.812 1.00 0.00 C ATOM 2190 O LYS A 140 1.591 -24.450 -9.478 1.00 0.00 O ATOM 2191 CB LYS A 140 1.381 -21.320 -9.848 1.00 0.00 C ATOM 2192 CG LYS A 140 0.932 -20.148 -8.993 1.00 0.00 C ATOM 2193 CD LYS A 140 -0.104 -19.300 -9.709 1.00 0.00 C ATOM 2194 CE LYS A 140 -1.090 -18.679 -8.731 1.00 0.00 C ATOM 2195 NZ LYS A 140 -2.298 -19.530 -8.546 1.00 0.00 N ATOM 0 H LYS A 140 3.855 -20.945 -10.009 1.00 0.00 H new ATOM 0 HA LYS A 140 2.155 -22.326 -8.114 1.00 0.00 H new ATOM 0 HB2 LYS A 140 1.799 -20.940 -10.780 1.00 0.00 H new ATOM 0 HB3 LYS A 140 0.511 -21.921 -10.111 1.00 0.00 H new ATOM 0 HG2 LYS A 140 0.516 -20.518 -8.056 1.00 0.00 H new ATOM 0 HG3 LYS A 140 1.794 -19.532 -8.737 1.00 0.00 H new ATOM 0 HD2 LYS A 140 0.396 -18.512 -10.273 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -0.643 -19.915 -10.430 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -0.601 -18.528 -7.769 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -1.390 -17.696 -9.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -2.945 -19.072 -7.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -2.779 -19.653 -9.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -2.014 -20.460 -8.176 1.00 0.00 H new ATOM 2209 N HIS A 141 3.343 -23.814 -10.739 1.00 0.00 N ATOM 2210 CA HIS A 141 3.449 -25.094 -11.431 1.00 0.00 C ATOM 2211 C HIS A 141 4.234 -26.100 -10.595 1.00 0.00 C ATOM 2212 O HIS A 141 4.429 -27.244 -11.005 1.00 0.00 O ATOM 2213 CB HIS A 141 4.121 -24.908 -12.791 1.00 0.00 C ATOM 2214 CG HIS A 141 4.687 -26.174 -13.358 1.00 0.00 C ATOM 2215 ND1 HIS A 141 3.934 -27.078 -14.077 1.00 0.00 N ATOM 2216 CD2 HIS A 141 5.940 -26.683 -13.310 1.00 0.00 C ATOM 2217 CE1 HIS A 141 4.700 -28.090 -14.445 1.00 0.00 C ATOM 2218 NE2 HIS A 141 5.922 -27.874 -13.992 1.00 0.00 N ATOM 0 H HIS A 141 4.032 -23.120 -11.028 1.00 0.00 H new ATOM 0 HA HIS A 141 2.442 -25.482 -11.582 1.00 0.00 H new ATOM 0 HB2 HIS A 141 3.395 -24.498 -13.493 1.00 0.00 H new ATOM 0 HB3 HIS A 141 4.921 -24.174 -12.695 1.00 0.00 H new ATOM 0 HD1 HIS A 141 2.941 -26.981 -14.291 1.00 0.00 H new ATOM 0 HD2 HIS A 141 6.795 -26.235 -12.825 1.00 0.00 H new ATOM 0 HE1 HIS A 141 4.381 -28.948 -15.019 1.00 0.00 H new ATOM 2226 N MET A 142 4.683 -25.665 -9.422 1.00 0.00 N ATOM 2227 CA MET A 142 5.447 -26.528 -8.529 1.00 0.00 C ATOM 2228 C MET A 142 4.520 -27.319 -7.612 1.00 0.00 C ATOM 2229 O MET A 142 4.908 -28.347 -7.057 1.00 0.00 O ATOM 2230 CB MET A 142 6.423 -25.698 -7.693 1.00 0.00 C ATOM 2231 CG MET A 142 7.093 -24.579 -8.475 1.00 0.00 C ATOM 2232 SD MET A 142 8.658 -25.087 -9.212 1.00 0.00 S ATOM 2233 CE MET A 142 8.138 -25.463 -10.884 1.00 0.00 C ATOM 0 H MET A 142 4.531 -24.721 -9.068 1.00 0.00 H new ATOM 0 HA MET A 142 6.011 -27.232 -9.141 1.00 0.00 H new ATOM 0 HB2 MET A 142 5.889 -25.269 -6.845 1.00 0.00 H new ATOM 0 HB3 MET A 142 7.191 -26.356 -7.286 1.00 0.00 H new ATOM 0 HG2 MET A 142 6.420 -24.237 -9.261 1.00 0.00 H new ATOM 0 HG3 MET A 142 7.266 -23.731 -7.812 1.00 0.00 H new ATOM 0 HE1 MET A 142 8.541 -26.431 -11.181 1.00 0.00 H new ATOM 0 HE2 MET A 142 7.049 -25.494 -10.928 1.00 0.00 H new ATOM 0 HE3 MET A 142 8.507 -24.693 -11.562 1.00 0.00 H new ATOM 2243 N HIS A 143 3.292 -26.833 -7.458 1.00 0.00 N ATOM 2244 CA HIS A 143 2.309 -27.495 -6.608 1.00 0.00 C ATOM 2245 C HIS A 143 2.079 -28.933 -7.062 1.00 0.00 C ATOM 2246 O HIS A 143 1.593 -29.767 -6.297 1.00 0.00 O ATOM 2247 CB HIS A 143 0.988 -26.725 -6.625 1.00 0.00 C ATOM 2248 CG HIS A 143 0.231 -26.863 -7.910 1.00 0.00 C ATOM 2249 ND1 HIS A 143 -0.006 -28.078 -8.517 1.00 0.00 N ATOM 2250 CD2 HIS A 143 -0.346 -25.930 -8.702 1.00 0.00 C ATOM 2251 CE1 HIS A 143 -0.694 -27.886 -9.628 1.00 0.00 C ATOM 2252 NE2 HIS A 143 -0.913 -26.591 -9.764 1.00 0.00 N ATOM 0 H HIS A 143 2.954 -25.984 -7.911 1.00 0.00 H new ATOM 0 HA HIS A 143 2.698 -27.512 -5.590 1.00 0.00 H new ATOM 0 HB2 HIS A 143 0.362 -27.076 -5.805 1.00 0.00 H new ATOM 0 HB3 HIS A 143 1.190 -25.669 -6.443 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -0.358 -24.864 -8.531 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -1.022 -28.657 -10.309 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -1.421 -26.153 -10.533 1.00 0.00 H new ATOM 2260 N VAL A 144 2.431 -29.218 -8.312 1.00 0.00 N ATOM 2261 CA VAL A 144 2.264 -30.555 -8.868 1.00 0.00 C ATOM 2262 C VAL A 144 3.572 -31.336 -8.824 1.00 0.00 C ATOM 2263 O VAL A 144 3.578 -32.565 -8.909 1.00 0.00 O ATOM 2264 CB VAL A 144 1.761 -30.499 -10.323 1.00 0.00 C ATOM 2265 CG1 VAL A 144 2.172 -29.191 -10.980 1.00 0.00 C ATOM 2266 CG2 VAL A 144 2.283 -31.689 -11.113 1.00 0.00 C ATOM 0 H VAL A 144 2.834 -28.540 -8.959 1.00 0.00 H new ATOM 0 HA VAL A 144 1.520 -31.063 -8.253 1.00 0.00 H new ATOM 0 HB VAL A 144 0.672 -30.547 -10.315 1.00 0.00 H new ATOM 0 HG11 VAL A 144 1.808 -29.170 -12.007 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.744 -28.355 -10.426 1.00 0.00 H new ATOM 0 HG13 VAL A 144 3.259 -29.109 -10.979 1.00 0.00 H new ATOM 0 HG21 VAL A 144 1.918 -31.633 -12.139 1.00 0.00 H new ATOM 0 HG22 VAL A 144 3.373 -31.675 -11.115 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.933 -32.613 -10.653 1.00 0.00 H new ATOM 2276 N HIS A 145 4.681 -30.616 -8.690 1.00 0.00 N ATOM 2277 CA HIS A 145 5.998 -31.242 -8.634 1.00 0.00 C ATOM 2278 C HIS A 145 6.189 -31.985 -7.315 1.00 0.00 C ATOM 2279 O HIS A 145 6.783 -33.064 -7.278 1.00 0.00 O ATOM 2280 CB HIS A 145 7.094 -30.189 -8.803 1.00 0.00 C ATOM 2281 CG HIS A 145 7.502 -29.974 -10.228 1.00 0.00 C ATOM 2282 ND1 HIS A 145 8.027 -30.974 -11.020 1.00 0.00 N ATOM 2283 CD2 HIS A 145 7.458 -28.866 -11.004 1.00 0.00 C ATOM 2284 CE1 HIS A 145 8.290 -30.489 -12.220 1.00 0.00 C ATOM 2285 NE2 HIS A 145 7.954 -29.212 -12.237 1.00 0.00 N ATOM 0 H HIS A 145 4.694 -29.599 -8.618 1.00 0.00 H new ATOM 0 HA HIS A 145 6.067 -31.961 -9.450 1.00 0.00 H new ATOM 0 HB2 HIS A 145 6.746 -29.244 -8.387 1.00 0.00 H new ATOM 0 HB3 HIS A 145 7.968 -30.490 -8.225 1.00 0.00 H new ATOM 0 HD1 HIS A 145 8.187 -31.937 -10.725 1.00 0.00 H new ATOM 0 HD2 HIS A 145 7.099 -27.891 -10.709 1.00 0.00 H new ATOM 0 HE1 HIS A 145 8.709 -31.043 -13.047 1.00 0.00 H new ATOM 2293 N THR A 146 5.684 -31.402 -6.233 1.00 0.00 N ATOM 2294 CA THR A 146 5.801 -32.007 -4.913 1.00 0.00 C ATOM 2295 C THR A 146 4.563 -32.829 -4.573 1.00 0.00 C ATOM 2296 O THR A 146 4.648 -34.037 -4.356 1.00 0.00 O ATOM 2297 CB THR A 146 6.011 -30.940 -3.822 1.00 0.00 C ATOM 2298 OG1 THR A 146 7.374 -30.504 -3.819 1.00 0.00 O ATOM 2299 CG2 THR A 146 5.646 -31.489 -2.451 1.00 0.00 C ATOM 0 H THR A 146 5.189 -30.510 -6.245 1.00 0.00 H new ATOM 0 HA THR A 146 6.672 -32.662 -4.942 1.00 0.00 H new ATOM 0 HB THR A 146 5.360 -30.094 -4.042 1.00 0.00 H new ATOM 0 HG1 THR A 146 7.499 -29.825 -3.124 1.00 0.00 H new ATOM 0 HG21 THR A 146 5.802 -30.718 -1.697 1.00 0.00 H new ATOM 0 HG22 THR A 146 4.599 -31.793 -2.448 1.00 0.00 H new ATOM 0 HG23 THR A 146 6.275 -32.350 -2.225 1.00 0.00 H new ATOM 2307 N SER A 147 3.412 -32.165 -4.528 1.00 0.00 N ATOM 2308 CA SER A 147 2.155 -32.834 -4.211 1.00 0.00 C ATOM 2309 C SER A 147 1.451 -33.298 -5.482 1.00 0.00 C ATOM 2310 O SER A 147 1.930 -33.062 -6.592 1.00 0.00 O ATOM 2311 CB SER A 147 1.240 -31.898 -3.419 1.00 0.00 C ATOM 2312 OG SER A 147 0.139 -32.603 -2.873 1.00 0.00 O ATOM 0 H SER A 147 3.324 -31.165 -4.707 1.00 0.00 H new ATOM 0 HA SER A 147 2.381 -33.709 -3.602 1.00 0.00 H new ATOM 0 HB2 SER A 147 1.806 -31.424 -2.617 1.00 0.00 H new ATOM 0 HB3 SER A 147 0.879 -31.101 -4.069 1.00 0.00 H new ATOM 0 HG SER A 147 -0.430 -31.983 -2.370 1.00 0.00 H new ATOM 2318 N ASP A 148 0.311 -33.958 -5.312 1.00 0.00 N ATOM 2319 CA ASP A 148 -0.462 -34.455 -6.445 1.00 0.00 C ATOM 2320 C ASP A 148 -1.832 -33.787 -6.502 1.00 0.00 C ATOM 2321 O ASP A 148 -2.465 -33.733 -7.557 1.00 0.00 O ATOM 2322 CB ASP A 148 -0.624 -35.973 -6.353 1.00 0.00 C ATOM 2323 CG ASP A 148 -0.715 -36.459 -4.920 1.00 0.00 C ATOM 2324 OD1 ASP A 148 -1.600 -35.976 -4.185 1.00 0.00 O ATOM 2325 OD2 ASP A 148 0.101 -37.323 -4.534 1.00 0.00 O ATOM 0 H ASP A 148 -0.099 -34.162 -4.400 1.00 0.00 H new ATOM 0 HA ASP A 148 0.080 -34.211 -7.359 1.00 0.00 H new ATOM 0 HB2 ASP A 148 -1.522 -36.273 -6.893 1.00 0.00 H new ATOM 0 HB3 ASP A 148 0.220 -36.456 -6.845 1.00 0.00 H new ATOM 2330 N LYS A 149 -2.286 -33.280 -5.361 1.00 0.00 N ATOM 2331 CA LYS A 149 -3.581 -32.615 -5.280 1.00 0.00 C ATOM 2332 C LYS A 149 -3.600 -31.354 -6.139 1.00 0.00 C ATOM 2333 O LYS A 149 -2.810 -30.435 -5.925 1.00 0.00 O ATOM 2334 CB LYS A 149 -3.905 -32.260 -3.827 1.00 0.00 C ATOM 2335 CG LYS A 149 -3.780 -33.434 -2.872 1.00 0.00 C ATOM 2336 CD LYS A 149 -4.567 -34.638 -3.362 1.00 0.00 C ATOM 2337 CE LYS A 149 -6.032 -34.294 -3.582 1.00 0.00 C ATOM 2338 NZ LYS A 149 -6.869 -35.514 -3.752 1.00 0.00 N ATOM 0 H LYS A 149 -1.776 -33.317 -4.479 1.00 0.00 H new ATOM 0 HA LYS A 149 -4.338 -33.302 -5.657 1.00 0.00 H new ATOM 0 HB2 LYS A 149 -3.238 -31.463 -3.499 1.00 0.00 H new ATOM 0 HB3 LYS A 149 -4.920 -31.867 -3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 149 -2.730 -33.705 -2.762 1.00 0.00 H new ATOM 0 HG3 LYS A 149 -4.138 -33.141 -1.885 1.00 0.00 H new ATOM 0 HD2 LYS A 149 -4.134 -35.003 -4.293 1.00 0.00 H new ATOM 0 HD3 LYS A 149 -4.487 -35.447 -2.635 1.00 0.00 H new ATOM 0 HE2 LYS A 149 -6.401 -33.716 -2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -6.128 -33.662 -4.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -7.861 -35.237 -3.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -6.534 -36.053 -4.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 -6.798 -36.105 -2.899 1.00 0.00 H new ATOM 2352 N SER A 150 -4.508 -31.319 -7.109 1.00 0.00 N ATOM 2353 CA SER A 150 -4.628 -30.172 -8.001 1.00 0.00 C ATOM 2354 C SER A 150 -5.604 -29.144 -7.437 1.00 0.00 C ATOM 2355 O SER A 150 -6.691 -29.490 -6.978 1.00 0.00 O ATOM 2356 CB SER A 150 -5.091 -30.623 -9.388 1.00 0.00 C ATOM 2357 OG SER A 150 -4.198 -31.577 -9.938 1.00 0.00 O ATOM 0 H SER A 150 -5.171 -32.071 -7.297 1.00 0.00 H new ATOM 0 HA SER A 150 -3.646 -29.707 -8.087 1.00 0.00 H new ATOM 0 HB2 SER A 150 -6.090 -31.053 -9.319 1.00 0.00 H new ATOM 0 HB3 SER A 150 -5.160 -29.760 -10.050 1.00 0.00 H new ATOM 0 HG SER A 150 -4.516 -31.851 -10.823 1.00 0.00 H new ATOM 2363 N GLY A 151 -5.205 -27.876 -7.473 1.00 0.00 N ATOM 2364 CA GLY A 151 -6.055 -26.816 -6.962 1.00 0.00 C ATOM 2365 C GLY A 151 -6.014 -25.572 -7.828 1.00 0.00 C ATOM 2366 O GLY A 151 -5.547 -24.513 -7.408 1.00 0.00 O ATOM 0 H GLY A 151 -4.309 -27.564 -7.847 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -7.082 -27.177 -6.898 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -5.743 -26.561 -5.949 1.00 0.00 H new ATOM 2370 N PRO A 152 -6.511 -25.693 -9.068 1.00 0.00 N ATOM 2371 CA PRO A 152 -6.539 -24.579 -10.021 1.00 0.00 C ATOM 2372 C PRO A 152 -7.538 -23.499 -9.620 1.00 0.00 C ATOM 2373 O PRO A 152 -8.745 -23.739 -9.583 1.00 0.00 O ATOM 2374 CB PRO A 152 -6.968 -25.245 -11.331 1.00 0.00 C ATOM 2375 CG PRO A 152 -7.727 -26.456 -10.910 1.00 0.00 C ATOM 2376 CD PRO A 152 -7.083 -26.925 -9.635 1.00 0.00 C ATOM 0 HA PRO A 152 -5.578 -24.069 -10.081 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -7.588 -24.578 -11.930 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -6.105 -25.511 -11.941 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -8.780 -26.222 -10.752 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -7.684 -27.230 -11.677 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -7.810 -27.378 -8.961 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -6.315 -27.674 -9.825 1.00 0.00 H new ATOM 2384 N SER A 153 -7.028 -22.309 -9.322 1.00 0.00 N ATOM 2385 CA SER A 153 -7.875 -21.192 -8.921 1.00 0.00 C ATOM 2386 C SER A 153 -8.007 -20.176 -10.052 1.00 0.00 C ATOM 2387 O SER A 153 -9.055 -20.075 -10.691 1.00 0.00 O ATOM 2388 CB SER A 153 -7.304 -20.513 -7.674 1.00 0.00 C ATOM 2389 OG SER A 153 -5.890 -20.450 -7.731 1.00 0.00 O ATOM 0 H SER A 153 -6.032 -22.093 -9.351 1.00 0.00 H new ATOM 0 HA SER A 153 -8.866 -21.584 -8.691 1.00 0.00 H new ATOM 0 HB2 SER A 153 -7.713 -19.507 -7.585 1.00 0.00 H new ATOM 0 HB3 SER A 153 -7.611 -21.062 -6.784 1.00 0.00 H new ATOM 0 HG SER A 153 -5.549 -20.011 -6.924 1.00 0.00 H new ATOM 2395 N SER A 154 -6.937 -19.426 -10.293 1.00 0.00 N ATOM 2396 CA SER A 154 -6.934 -18.415 -11.344 1.00 0.00 C ATOM 2397 C SER A 154 -5.721 -18.583 -12.255 1.00 0.00 C ATOM 2398 O SER A 154 -4.764 -19.274 -11.911 1.00 0.00 O ATOM 2399 CB SER A 154 -6.936 -17.013 -10.732 1.00 0.00 C ATOM 2400 OG SER A 154 -7.278 -16.035 -11.699 1.00 0.00 O ATOM 0 H SER A 154 -6.061 -19.499 -9.775 1.00 0.00 H new ATOM 0 HA SER A 154 -7.837 -18.544 -11.941 1.00 0.00 H new ATOM 0 HB2 SER A 154 -7.645 -16.975 -9.905 1.00 0.00 H new ATOM 0 HB3 SER A 154 -5.952 -16.792 -10.319 1.00 0.00 H new ATOM 0 HG SER A 154 -7.274 -15.148 -11.283 1.00 0.00 H new ATOM 2406 N GLY A 155 -5.771 -17.944 -13.420 1.00 0.00 N ATOM 2407 CA GLY A 155 -4.672 -18.034 -14.363 1.00 0.00 C ATOM 2408 C GLY A 155 -5.117 -17.808 -15.794 1.00 0.00 C ATOM 2409 O GLY A 155 -5.314 -18.781 -16.521 1.00 0.00 O ATOM 0 H GLY A 155 -6.553 -17.366 -13.727 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -3.912 -17.298 -14.102 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -4.206 -19.016 -14.281 1.00 0.00 H new TER 2413 GLY A 155 HETATM 2414 ZN ZN A 201 -8.924 17.850 -20.789 1.00 0.00 ZN HETATM 2415 ZN ZN A 401 1.714 18.406 -19.283 1.00 0.00 ZN HETATM 2416 ZN ZN A 601 8.383 -6.469 -26.392 1.00 0.00 ZN HETATM 2417 ZN ZN A 801 7.983 -28.185 -14.069 1.00 0.00 ZN