USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 896 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 103 THR OG1 : rot -104:sc= 1.31 USER MOD Set 1.2: A 127 CYS SG : rot 149:sc= -0.661 USER MOD Set 2.1: A 105 THR OG1 : rot 134:sc= 1.1 USER MOD Set 2.2: A 108 THR OG1 : rot -58:sc= -0.179 USER MOD Set 3.1: A 6 TYR OH : rot -16:sc= -2.85 USER MOD Set 3.2: A 133 HIS :FLIP no HD1:sc= -7.19! C(o=-11!,f=-10!) USER MOD Single : A 4 ASN : amide:sc= -0.04 X(o=-0.04,f=0) USER MOD Single : A 9 ASN : amide:sc= -9.59! C(o=-9.6!,f=-12!) USER MOD Single : A 11 MET CE :methyl -146:sc= -0.175 (180deg=-0.395) USER MOD Single : A 15 THR OG1 : rot 78:sc= 0.0683 USER MOD Single : A 16 CYS SG : rot -99:sc= -4.35 USER MOD Single : A 17 GLN : amide:sc= -0.223 K(o=-0.22,f=-1.3!) USER MOD Single : A 24 TYR OH : rot 165:sc= -0.647 USER MOD Single : A 25 LYS NZ :NH3+ -127:sc= 0.0458 (180deg=-1.28) USER MOD Single : A 27 SER OG : rot 37:sc= 0.244 USER MOD Single : A 29 SER OG : rot 81:sc= 0.00866 USER MOD Single : A 37 LYS NZ :NH3+ 157:sc= 0.201 (180deg=0.0776) USER MOD Single : A 38 THR OG1 : rot 1:sc= 1.13 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= -2 USER MOD Single : A 59 TYR OH : rot -86:sc= 0.643 USER MOD Single : A 61 ASN : amide:sc= -3.09! C(o=-3.1!,f=-6.9!) USER MOD Single : A 64 THR OG1 : rot 28:sc= -0.984 USER MOD Single : A 68 GLN : amide:sc= -10! C(o=-10!,f=-13!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot -60:sc= -5.13! USER MOD Single : A 71 SER OG : rot -13:sc= -5.52! USER MOD Single : A 76 SER OG : rot 130:sc= -1.83! USER MOD Single : A 84 SER OG : rot -139:sc= 0.301 USER MOD Single : A 85 MET CE :methyl 154:sc= -9.39! (180deg=-11!) USER MOD Single : A 89 THR OG1 : rot -16:sc= 1.08 USER MOD Single : A 90 LYS NZ :NH3+ -178:sc= -1.22 (180deg=-1.27) USER MOD Single : A 99 ASN :FLIP amide:sc= 0.507 F(o=-1.5!,f=0.51) USER MOD Single : A 101 THR OG1 : rot -40:sc= -1.12 USER MOD Single : A 104 LYS NZ :NH3+ 151:sc= -0.302 (180deg=-1.49!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 154:sc= -0.125 (180deg=-0.276) USER MOD Single : A 124 ASN : amide:sc= -1.34 K(o=-1.3,f=-2.3!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 176:sc= -0.451 (180deg=-0.466) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl -137:sc= -5.64! (180deg=-8.78!) USER MOD Single : A 132 SER OG : rot 42:sc= 0.319 USER MOD Single : A 137 SER OG : rot -38:sc= -0.799 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.537 14.102 1.023 1.00 0.00 N ATOM 21 CA TRP A 3 -17.156 12.952 0.122 1.00 0.00 C ATOM 22 C TRP A 3 -17.613 13.205 -1.338 1.00 0.00 C ATOM 23 O TRP A 3 -16.848 13.017 -2.277 1.00 0.00 O ATOM 24 CB TRP A 3 -17.806 11.715 0.619 1.00 0.00 C ATOM 25 CG TRP A 3 -16.938 10.991 1.627 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.324 9.852 2.191 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.579 11.291 2.201 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.359 9.408 3.067 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.271 10.245 3.113 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.587 12.334 2.046 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.079 10.213 3.830 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.388 12.275 2.782 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.141 11.222 3.666 1.00 0.00 C ATOM 0 HA TRP A 3 -16.071 12.852 0.133 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.763 11.966 1.077 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -18.018 11.053 -0.221 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.258 9.348 1.992 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.443 8.554 3.619 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.766 13.155 1.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.884 9.401 4.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.650 13.054 2.661 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.217 11.193 4.224 1.00 0.00 H new ATOM 44 N ASN A 4 -18.875 13.599 -1.526 1.00 0.00 N ATOM 45 CA ASN A 4 -19.423 13.834 -2.920 1.00 0.00 C ATOM 46 C ASN A 4 -18.625 14.912 -3.650 1.00 0.00 C ATOM 47 O ASN A 4 -18.612 14.946 -4.860 1.00 0.00 O ATOM 48 CB ASN A 4 -20.892 14.255 -2.829 1.00 0.00 C ATOM 49 CG ASN A 4 -21.717 13.098 -2.275 1.00 0.00 C ATOM 50 OD1 ASN A 4 -22.201 12.270 -3.020 1.00 0.00 O ATOM 51 ND2 ASN A 4 -21.892 13.000 -0.986 1.00 0.00 N ATOM 0 H ASN A 4 -19.542 13.766 -0.773 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.338 12.905 -3.483 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -20.992 15.129 -2.185 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.262 14.541 -3.814 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.436 12.227 -0.602 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.485 13.696 -0.362 1.00 0.00 H new ATOM 58 N ALA A 5 -17.966 15.775 -2.916 1.00 0.00 N ATOM 59 CA ALA A 5 -17.119 16.875 -3.540 1.00 0.00 C ATOM 60 C ALA A 5 -15.834 16.231 -4.066 1.00 0.00 C ATOM 61 O ALA A 5 -15.342 16.565 -5.147 1.00 0.00 O ATOM 62 CB ALA A 5 -16.778 17.929 -2.484 1.00 0.00 C ATOM 0 H ALA A 5 -17.971 15.775 -1.896 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.661 17.362 -4.350 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.172 18.714 -2.936 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.698 18.362 -2.092 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.221 17.463 -1.671 1.00 0.00 H new ATOM 68 N TYR A 6 -15.313 15.259 -3.335 1.00 0.00 N ATOM 69 CA TYR A 6 -14.085 14.523 -3.821 1.00 0.00 C ATOM 70 C TYR A 6 -14.534 13.582 -4.958 1.00 0.00 C ATOM 71 O TYR A 6 -13.737 13.106 -5.728 1.00 0.00 O ATOM 72 CB TYR A 6 -13.398 13.812 -2.661 1.00 0.00 C ATOM 73 CG TYR A 6 -13.341 14.822 -1.561 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.518 15.942 -1.669 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.187 14.687 -0.511 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.573 16.936 -0.688 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.235 15.657 0.490 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.439 16.783 0.398 1.00 0.00 C ATOM 79 OH TYR A 6 -13.531 17.770 1.356 1.00 0.00 O ATOM 0 H TYR A 6 -15.679 14.947 -2.435 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.332 15.203 -4.220 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -13.957 12.927 -2.355 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.399 13.477 -2.940 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.842 16.041 -2.506 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.829 13.821 -0.449 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.951 17.815 -0.769 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.894 15.528 1.336 1.00 0.00 H new ATOM 0 HH TYR A 6 -12.764 18.375 1.277 1.00 0.00 H new ATOM 89 N ILE A 7 -15.853 13.421 -5.108 1.00 0.00 N ATOM 90 CA ILE A 7 -16.419 12.667 -6.270 1.00 0.00 C ATOM 91 C ILE A 7 -16.661 13.775 -7.392 1.00 0.00 C ATOM 92 O ILE A 7 -16.588 13.537 -8.632 1.00 0.00 O ATOM 93 CB ILE A 7 -17.709 11.956 -5.868 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.326 10.731 -5.012 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.491 11.510 -7.111 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.640 9.656 -5.862 1.00 0.00 C ATOM 0 H ILE A 7 -16.551 13.789 -4.461 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.756 11.881 -6.631 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.348 12.633 -5.301 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.661 11.041 -4.206 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.220 10.315 -4.546 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.407 11.005 -6.803 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.743 12.382 -7.715 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -17.880 10.825 -7.699 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.381 8.805 -5.232 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.316 9.331 -6.652 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.734 10.067 -6.307 1.00 0.00 H new ATOM 108 N ASP A 8 -16.872 15.021 -6.938 1.00 0.00 N ATOM 109 CA ASP A 8 -17.023 16.151 -7.867 1.00 0.00 C ATOM 110 C ASP A 8 -15.690 16.333 -8.598 1.00 0.00 C ATOM 111 O ASP A 8 -15.642 16.901 -9.630 1.00 0.00 O ATOM 112 CB ASP A 8 -17.438 17.406 -7.096 1.00 0.00 C ATOM 113 CG ASP A 8 -18.968 17.488 -7.038 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.583 16.493 -6.687 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.498 18.542 -7.348 1.00 0.00 O ATOM 0 H ASP A 8 -16.941 15.269 -5.951 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.806 15.961 -8.601 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.026 17.379 -6.087 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.034 18.294 -7.581 1.00 0.00 H new ATOM 120 N ASN A 9 -14.611 15.769 -8.036 1.00 0.00 N ATOM 121 CA ASN A 9 -13.249 15.782 -8.657 1.00 0.00 C ATOM 122 C ASN A 9 -13.368 15.256 -10.064 1.00 0.00 C ATOM 123 O ASN A 9 -13.034 15.899 -11.028 1.00 0.00 O ATOM 124 CB ASN A 9 -12.391 14.820 -7.730 1.00 0.00 C ATOM 125 CG ASN A 9 -11.512 13.705 -8.482 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.670 14.029 -9.291 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.695 12.353 -8.181 1.00 0.00 N ATOM 0 H ASN A 9 -14.643 15.287 -7.138 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.790 16.768 -8.723 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.722 15.433 -7.127 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.068 14.315 -7.041 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.122 11.646 -8.641 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.402 12.073 -7.501 1.00 0.00 H new ATOM 134 N LEU A 10 -13.883 14.104 -10.126 1.00 0.00 N ATOM 135 CA LEU A 10 -14.150 13.356 -11.395 1.00 0.00 C ATOM 136 C LEU A 10 -14.888 14.152 -12.342 1.00 0.00 C ATOM 137 O LEU A 10 -14.698 14.088 -13.560 1.00 0.00 O ATOM 138 CB LEU A 10 -15.076 12.216 -11.055 1.00 0.00 C ATOM 139 CG LEU A 10 -14.427 11.187 -10.162 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.876 11.124 -10.314 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.812 11.445 -8.662 1.00 0.00 C ATOM 0 H LEU A 10 -14.162 13.586 -9.293 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.190 13.056 -11.816 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.965 12.610 -10.563 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.408 11.735 -11.975 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.811 10.218 -10.482 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.475 10.364 -9.643 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.621 10.871 -11.343 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.446 12.093 -10.062 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.336 10.695 -8.030 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.473 12.437 -8.365 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.894 11.382 -8.548 1.00 0.00 H new ATOM 153 N MET A 11 -15.789 14.832 -11.837 1.00 0.00 N ATOM 154 CA MET A 11 -16.645 15.593 -12.685 1.00 0.00 C ATOM 155 C MET A 11 -15.880 16.884 -13.103 1.00 0.00 C ATOM 156 O MET A 11 -15.988 17.347 -14.225 1.00 0.00 O ATOM 157 CB MET A 11 -17.937 15.766 -11.898 1.00 0.00 C ATOM 158 CG MET A 11 -18.457 14.284 -11.466 1.00 0.00 C ATOM 159 SD MET A 11 -19.418 13.576 -12.840 1.00 0.00 S ATOM 160 CE MET A 11 -18.136 12.462 -13.492 1.00 0.00 C ATOM 0 H MET A 11 -15.984 14.902 -10.838 1.00 0.00 H new ATOM 0 HA MET A 11 -16.919 15.133 -13.635 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.768 16.384 -11.016 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.688 16.273 -12.503 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.610 13.641 -11.228 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.072 14.347 -10.568 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.229 12.395 -14.576 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.151 12.852 -13.236 1.00 0.00 H new ATOM 0 HE3 MET A 11 -18.259 11.471 -13.055 1.00 0.00 H new ATOM 170 N ALA A 12 -15.065 17.403 -12.207 1.00 0.00 N ATOM 171 CA ALA A 12 -14.197 18.604 -12.477 1.00 0.00 C ATOM 172 C ALA A 12 -12.835 18.241 -13.189 1.00 0.00 C ATOM 173 O ALA A 12 -12.042 19.134 -13.457 1.00 0.00 O ATOM 174 CB ALA A 12 -13.897 19.306 -11.144 1.00 0.00 C ATOM 0 H ALA A 12 -14.963 17.028 -11.264 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.746 19.255 -13.157 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.269 20.178 -11.325 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.832 19.622 -10.681 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.377 18.617 -10.479 1.00 0.00 H new ATOM 180 N ASP A 13 -12.515 16.946 -13.411 1.00 0.00 N ATOM 181 CA ASP A 13 -11.120 16.578 -14.014 1.00 0.00 C ATOM 182 C ASP A 13 -11.116 16.288 -15.511 1.00 0.00 C ATOM 183 O ASP A 13 -10.049 16.074 -16.055 1.00 0.00 O ATOM 184 CB ASP A 13 -10.501 15.336 -13.277 1.00 0.00 C ATOM 185 CG ASP A 13 -11.536 14.421 -12.754 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.375 14.040 -13.518 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.454 14.084 -11.594 1.00 0.00 O ATOM 0 H ASP A 13 -13.125 16.153 -13.213 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.522 17.477 -13.861 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.854 14.793 -13.966 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.874 15.680 -12.454 1.00 0.00 H new ATOM 192 N GLY A 14 -12.256 16.325 -16.193 1.00 0.00 N ATOM 193 CA GLY A 14 -12.292 16.066 -17.726 1.00 0.00 C ATOM 194 C GLY A 14 -11.183 15.047 -18.181 1.00 0.00 C ATOM 195 O GLY A 14 -10.623 15.164 -19.258 1.00 0.00 O ATOM 0 H GLY A 14 -13.166 16.520 -15.775 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.273 15.682 -18.005 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.156 17.009 -18.256 1.00 0.00 H new ATOM 199 N THR A 15 -10.879 14.089 -17.335 1.00 0.00 N ATOM 200 CA THR A 15 -9.827 13.060 -17.607 1.00 0.00 C ATOM 201 C THR A 15 -10.259 11.749 -16.972 1.00 0.00 C ATOM 202 O THR A 15 -9.975 10.669 -17.489 1.00 0.00 O ATOM 203 CB THR A 15 -8.510 13.518 -16.986 1.00 0.00 C ATOM 204 OG1 THR A 15 -7.976 14.598 -17.738 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.546 12.358 -16.995 1.00 0.00 C ATOM 0 H THR A 15 -11.338 13.977 -16.431 1.00 0.00 H new ATOM 0 HA THR A 15 -9.694 12.927 -18.681 1.00 0.00 H new ATOM 0 HB THR A 15 -8.675 13.853 -15.962 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.451 15.424 -17.507 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.599 12.669 -16.554 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.963 11.534 -16.416 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.379 12.032 -18.022 1.00 0.00 H new ATOM 213 N CYS A 16 -10.904 11.842 -15.842 1.00 0.00 N ATOM 214 CA CYS A 16 -11.334 10.660 -15.119 1.00 0.00 C ATOM 215 C CYS A 16 -12.452 9.969 -15.941 1.00 0.00 C ATOM 216 O CYS A 16 -12.790 10.381 -17.048 1.00 0.00 O ATOM 217 CB CYS A 16 -11.897 11.148 -13.734 1.00 0.00 C ATOM 218 SG CYS A 16 -13.692 11.460 -13.856 1.00 0.00 S ATOM 0 H CYS A 16 -11.148 12.725 -15.394 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.519 9.953 -14.965 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.703 10.396 -12.969 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.383 12.058 -13.425 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.901 12.733 -14.016 1.00 0.00 H new ATOM 224 N GLN A 17 -13.037 8.981 -15.354 1.00 0.00 N ATOM 225 CA GLN A 17 -14.164 8.257 -15.952 1.00 0.00 C ATOM 226 C GLN A 17 -15.006 7.741 -14.791 1.00 0.00 C ATOM 227 O GLN A 17 -16.221 7.842 -14.791 1.00 0.00 O ATOM 228 CB GLN A 17 -13.677 7.113 -16.806 1.00 0.00 C ATOM 229 CG GLN A 17 -14.835 6.611 -17.703 1.00 0.00 C ATOM 230 CD GLN A 17 -15.243 5.187 -17.296 1.00 0.00 C ATOM 231 OE1 GLN A 17 -14.418 4.397 -16.870 1.00 0.00 O ATOM 232 NE2 GLN A 17 -16.492 4.824 -17.415 1.00 0.00 N ATOM 0 H GLN A 17 -12.762 8.631 -14.436 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.746 8.909 -16.604 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -12.839 7.437 -17.423 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.314 6.302 -16.174 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.690 7.281 -17.614 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.527 6.624 -18.748 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.183 5.484 -17.771 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.776 3.880 -17.152 1.00 0.00 H new ATOM 241 N ASP A 18 -14.324 7.212 -13.765 1.00 0.00 N ATOM 242 CA ASP A 18 -15.011 6.704 -12.546 1.00 0.00 C ATOM 243 C ASP A 18 -14.251 7.221 -11.302 1.00 0.00 C ATOM 244 O ASP A 18 -13.364 8.065 -11.426 1.00 0.00 O ATOM 245 CB ASP A 18 -15.095 5.165 -12.618 1.00 0.00 C ATOM 246 CG ASP A 18 -16.206 4.618 -11.688 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.148 5.346 -11.401 1.00 0.00 O ATOM 248 OD2 ASP A 18 -16.089 3.475 -11.283 1.00 0.00 O ATOM 0 H ASP A 18 -13.308 7.121 -13.744 1.00 0.00 H new ATOM 0 HA ASP A 18 -16.035 7.071 -12.476 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.293 4.857 -13.645 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.135 4.733 -12.335 1.00 0.00 H new ATOM 253 N ALA A 19 -14.631 6.790 -10.111 1.00 0.00 N ATOM 254 CA ALA A 19 -13.987 7.322 -8.865 1.00 0.00 C ATOM 255 C ALA A 19 -14.422 6.512 -7.666 1.00 0.00 C ATOM 256 O ALA A 19 -15.618 6.337 -7.476 1.00 0.00 O ATOM 257 CB ALA A 19 -14.504 8.675 -8.707 1.00 0.00 C ATOM 0 H ALA A 19 -15.359 6.093 -9.954 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.900 7.284 -8.937 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -14.074 9.127 -7.813 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -14.236 9.271 -9.579 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.589 8.641 -8.611 1.00 0.00 H new ATOM 263 N ALA A 20 -13.508 6.023 -6.827 1.00 0.00 N ATOM 264 CA ALA A 20 -14.013 5.240 -5.614 1.00 0.00 C ATOM 265 C ALA A 20 -13.300 5.544 -4.314 1.00 0.00 C ATOM 266 O ALA A 20 -12.214 5.053 -4.050 1.00 0.00 O ATOM 267 CB ALA A 20 -13.932 3.755 -5.841 1.00 0.00 C ATOM 0 H ALA A 20 -12.497 6.121 -6.916 1.00 0.00 H new ATOM 0 HA ALA A 20 -15.046 5.571 -5.511 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.299 3.231 -4.958 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.542 3.485 -6.703 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.896 3.471 -6.026 1.00 0.00 H new ATOM 273 N ILE A 21 -13.991 6.228 -3.442 1.00 0.00 N ATOM 274 CA ILE A 21 -13.470 6.445 -2.078 1.00 0.00 C ATOM 275 C ILE A 21 -14.031 5.239 -1.347 1.00 0.00 C ATOM 276 O ILE A 21 -15.232 5.050 -1.336 1.00 0.00 O ATOM 277 CB ILE A 21 -13.995 7.746 -1.481 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.505 8.911 -2.369 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.463 7.895 -0.024 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.792 10.254 -1.709 1.00 0.00 C ATOM 0 H ILE A 21 -14.903 6.647 -3.626 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.385 6.535 -2.026 1.00 0.00 H new ATOM 0 HB ILE A 21 -15.084 7.750 -1.447 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.435 8.811 -2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.998 8.866 -3.340 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.836 8.824 0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.807 7.053 0.577 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.373 7.912 -0.035 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.438 11.059 -2.353 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.865 10.360 -1.552 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -13.278 10.305 -0.749 1.00 0.00 H new ATOM 292 N VAL A 22 -13.198 4.360 -0.841 1.00 0.00 N ATOM 293 CA VAL A 22 -13.733 3.099 -0.234 1.00 0.00 C ATOM 294 C VAL A 22 -13.238 2.885 1.207 1.00 0.00 C ATOM 295 O VAL A 22 -12.082 2.586 1.405 1.00 0.00 O ATOM 296 CB VAL A 22 -13.237 1.907 -1.088 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.906 0.612 -0.615 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.568 2.140 -2.573 1.00 0.00 C ATOM 0 H VAL A 22 -12.183 4.459 -0.822 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.820 3.172 -0.212 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.157 1.822 -0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.552 -0.222 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.655 0.434 0.431 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.987 0.702 -0.718 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -13.214 1.294 -3.162 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.647 2.240 -2.694 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.079 3.051 -2.916 1.00 0.00 H new ATOM 308 N GLY A 23 -14.132 2.978 2.210 1.00 0.00 N ATOM 309 CA GLY A 23 -13.716 2.702 3.646 1.00 0.00 C ATOM 310 C GLY A 23 -13.310 1.221 3.722 1.00 0.00 C ATOM 311 O GLY A 23 -14.115 0.357 3.998 1.00 0.00 O ATOM 0 H GLY A 23 -15.113 3.230 2.088 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.885 3.345 3.937 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.537 2.912 4.332 1.00 0.00 H new ATOM 315 N TYR A 24 -12.069 0.954 3.418 1.00 0.00 N ATOM 316 CA TYR A 24 -11.522 -0.436 3.369 1.00 0.00 C ATOM 317 C TYR A 24 -11.052 -0.944 4.768 1.00 0.00 C ATOM 318 O TYR A 24 -10.092 -1.709 4.856 1.00 0.00 O ATOM 319 CB TYR A 24 -10.333 -0.413 2.366 1.00 0.00 C ATOM 320 CG TYR A 24 -9.054 0.172 3.000 1.00 0.00 C ATOM 321 CD1 TYR A 24 -9.100 1.145 4.033 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.839 -0.296 2.564 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.913 1.612 4.596 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.655 0.175 3.119 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.690 1.129 4.139 1.00 0.00 C ATOM 326 OH TYR A 24 -5.516 1.582 4.701 1.00 0.00 O ATOM 0 H TYR A 24 -11.382 1.673 3.192 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.303 -1.127 3.052 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -10.134 -1.426 2.016 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.607 0.178 1.492 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -10.050 1.522 4.381 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.803 -1.039 1.781 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.942 2.348 5.386 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.706 -0.197 2.761 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.781 0.986 4.448 1.00 0.00 H new ATOM 336 N LYS A 25 -11.716 -0.546 5.844 1.00 0.00 N ATOM 337 CA LYS A 25 -11.314 -1.020 7.201 1.00 0.00 C ATOM 338 C LYS A 25 -11.542 -2.531 7.261 1.00 0.00 C ATOM 339 O LYS A 25 -11.551 -3.193 6.231 1.00 0.00 O ATOM 340 CB LYS A 25 -12.136 -0.280 8.238 1.00 0.00 C ATOM 341 CG LYS A 25 -11.491 1.077 8.498 1.00 0.00 C ATOM 342 CD LYS A 25 -11.856 2.024 7.382 1.00 0.00 C ATOM 343 CE LYS A 25 -11.853 3.453 7.923 1.00 0.00 C ATOM 344 NZ LYS A 25 -12.924 3.606 8.961 1.00 0.00 N ATOM 0 H LYS A 25 -12.516 0.086 5.829 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.262 -0.820 7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.159 -0.150 7.886 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.187 -0.857 9.161 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.829 1.476 9.454 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.408 0.972 8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.145 1.931 6.561 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.839 1.774 6.983 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.880 3.686 8.355 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.018 4.160 7.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.528 4.418 8.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.502 2.742 8.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.486 3.764 9.891 1.00 0.00 H new ATOM 358 N ASP A 26 -11.729 -3.087 8.447 1.00 0.00 N ATOM 359 CA ASP A 26 -11.980 -4.605 8.596 1.00 0.00 C ATOM 360 C ASP A 26 -12.956 -5.054 7.507 1.00 0.00 C ATOM 361 O ASP A 26 -12.638 -5.889 6.668 1.00 0.00 O ATOM 362 CB ASP A 26 -12.584 -4.938 9.970 1.00 0.00 C ATOM 363 CG ASP A 26 -13.464 -3.790 10.498 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.912 -2.849 11.044 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.673 -3.881 10.356 1.00 0.00 O ATOM 0 H ASP A 26 -11.722 -2.571 9.327 1.00 0.00 H new ATOM 0 HA ASP A 26 -11.026 -5.123 8.502 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.179 -5.848 9.895 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.783 -5.139 10.681 1.00 0.00 H new ATOM 370 N SER A 27 -14.112 -4.443 7.499 1.00 0.00 N ATOM 371 CA SER A 27 -15.130 -4.711 6.480 1.00 0.00 C ATOM 372 C SER A 27 -15.123 -3.494 5.539 1.00 0.00 C ATOM 373 O SER A 27 -15.339 -2.382 6.003 1.00 0.00 O ATOM 374 CB SER A 27 -16.480 -4.845 7.148 1.00 0.00 C ATOM 375 OG SER A 27 -16.627 -3.839 8.146 1.00 0.00 O ATOM 0 H SER A 27 -14.387 -3.745 8.190 1.00 0.00 H new ATOM 0 HA SER A 27 -14.929 -5.632 5.933 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.274 -4.753 6.406 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.577 -5.833 7.598 1.00 0.00 H new ATOM 0 HG SER A 27 -16.203 -3.010 7.840 1.00 0.00 H new ATOM 381 N PRO A 28 -14.824 -3.712 4.249 1.00 0.00 N ATOM 382 CA PRO A 28 -14.731 -2.628 3.292 1.00 0.00 C ATOM 383 C PRO A 28 -16.099 -2.169 2.847 1.00 0.00 C ATOM 384 O PRO A 28 -17.077 -2.906 2.919 1.00 0.00 O ATOM 385 CB PRO A 28 -13.924 -3.212 2.143 1.00 0.00 C ATOM 386 CG PRO A 28 -14.053 -4.741 2.264 1.00 0.00 C ATOM 387 CD PRO A 28 -14.579 -5.038 3.661 1.00 0.00 C ATOM 0 HA PRO A 28 -14.259 -1.739 3.710 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.305 -2.864 1.183 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.880 -2.903 2.203 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.732 -5.131 1.506 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.088 -5.222 2.106 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.493 -5.631 3.624 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.855 -5.605 4.246 1.00 0.00 H new ATOM 395 N SER A 29 -16.165 -0.942 2.384 1.00 0.00 N ATOM 396 CA SER A 29 -17.428 -0.362 1.919 1.00 0.00 C ATOM 397 C SER A 29 -17.110 0.840 1.069 1.00 0.00 C ATOM 398 O SER A 29 -16.045 1.428 1.184 1.00 0.00 O ATOM 399 CB SER A 29 -18.282 0.055 3.111 1.00 0.00 C ATOM 400 OG SER A 29 -17.583 1.034 3.870 1.00 0.00 O ATOM 0 H SER A 29 -15.363 -0.316 2.315 1.00 0.00 H new ATOM 0 HA SER A 29 -17.985 -1.097 1.338 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.235 0.457 2.767 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.507 -0.812 3.733 1.00 0.00 H new ATOM 0 HG SER A 29 -17.695 1.913 3.452 1.00 0.00 H new ATOM 406 N VAL A 30 -18.010 1.195 0.207 1.00 0.00 N ATOM 407 CA VAL A 30 -17.795 2.331 -0.684 1.00 0.00 C ATOM 408 C VAL A 30 -18.237 3.618 0.009 1.00 0.00 C ATOM 409 O VAL A 30 -19.420 3.915 0.115 1.00 0.00 O ATOM 410 CB VAL A 30 -18.572 2.038 -1.952 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.643 3.275 -2.849 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.845 0.886 -2.683 1.00 0.00 C ATOM 0 H VAL A 30 -18.907 0.725 0.088 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.744 2.474 -0.936 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.597 1.757 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.206 3.038 -3.752 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -19.140 4.084 -2.314 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.634 3.585 -3.121 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.377 0.646 -3.604 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.826 1.192 -2.922 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.818 0.006 -2.040 1.00 0.00 H new ATOM 422 N TRP A 31 -17.268 4.369 0.484 1.00 0.00 N ATOM 423 CA TRP A 31 -17.540 5.641 1.191 1.00 0.00 C ATOM 424 C TRP A 31 -18.064 6.691 0.211 1.00 0.00 C ATOM 425 O TRP A 31 -18.744 7.627 0.608 1.00 0.00 O ATOM 426 CB TRP A 31 -16.231 6.116 1.858 1.00 0.00 C ATOM 427 CG TRP A 31 -16.090 5.476 3.225 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.869 4.469 3.704 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.141 5.782 4.284 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.475 4.159 4.967 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.411 4.936 5.381 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.081 6.701 4.405 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.672 5.003 6.552 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.336 6.769 5.587 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.634 5.925 6.657 1.00 0.00 C ATOM 0 H TRP A 31 -16.278 4.137 0.403 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.305 5.491 1.953 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.377 5.853 1.233 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.234 7.202 1.953 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.674 3.991 3.165 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.913 3.438 5.541 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.842 7.357 3.581 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -14.900 4.345 7.377 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.526 7.478 5.672 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.058 5.987 7.569 1.00 0.00 H new ATOM 446 N ALA A 32 -17.772 6.527 -1.072 1.00 0.00 N ATOM 447 CA ALA A 32 -18.274 7.504 -2.108 1.00 0.00 C ATOM 448 C ALA A 32 -17.722 7.148 -3.498 1.00 0.00 C ATOM 449 O ALA A 32 -16.709 7.690 -3.942 1.00 0.00 O ATOM 450 CB ALA A 32 -17.851 8.941 -1.737 1.00 0.00 C ATOM 0 H ALA A 32 -17.210 5.761 -1.442 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.362 7.445 -2.133 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.219 9.635 -2.492 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.271 9.205 -0.766 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.764 9.000 -1.690 1.00 0.00 H new ATOM 456 N ALA A 33 -18.406 6.261 -4.200 1.00 0.00 N ATOM 457 CA ALA A 33 -17.977 5.874 -5.567 1.00 0.00 C ATOM 458 C ALA A 33 -19.036 6.328 -6.528 1.00 0.00 C ATOM 459 O ALA A 33 -20.211 6.088 -6.302 1.00 0.00 O ATOM 460 CB ALA A 33 -17.839 4.350 -5.688 1.00 0.00 C ATOM 0 H ALA A 33 -19.249 5.792 -3.869 1.00 0.00 H new ATOM 0 HA ALA A 33 -17.012 6.332 -5.782 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -17.524 4.092 -6.699 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -17.096 3.994 -4.974 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.799 3.880 -5.477 1.00 0.00 H new ATOM 466 N VAL A 34 -18.641 6.964 -7.624 1.00 0.00 N ATOM 467 CA VAL A 34 -19.649 7.428 -8.664 1.00 0.00 C ATOM 468 C VAL A 34 -20.604 6.221 -8.955 1.00 0.00 C ATOM 469 O VAL A 34 -20.196 5.275 -9.601 1.00 0.00 O ATOM 470 CB VAL A 34 -18.897 7.871 -9.947 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.898 8.386 -10.982 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.928 9.012 -9.595 1.00 0.00 C ATOM 0 H VAL A 34 -17.669 7.182 -7.844 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.229 8.280 -8.309 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.351 7.020 -10.354 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.365 8.696 -11.881 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.602 7.593 -11.233 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.441 9.237 -10.571 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.396 9.328 -10.493 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.489 9.854 -9.190 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.210 8.664 -8.852 1.00 0.00 H new ATOM 482 N PRO A 35 -21.836 6.257 -8.380 1.00 0.00 N ATOM 483 CA PRO A 35 -22.787 5.134 -8.496 1.00 0.00 C ATOM 484 C PRO A 35 -23.254 4.916 -9.919 1.00 0.00 C ATOM 485 O PRO A 35 -23.356 5.844 -10.709 1.00 0.00 O ATOM 486 CB PRO A 35 -23.950 5.522 -7.569 1.00 0.00 C ATOM 487 CG PRO A 35 -23.863 7.058 -7.397 1.00 0.00 C ATOM 488 CD PRO A 35 -22.377 7.417 -7.622 1.00 0.00 C ATOM 0 HA PRO A 35 -22.328 4.186 -8.214 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.907 5.231 -8.001 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.868 5.016 -6.607 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.503 7.570 -8.115 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -24.193 7.361 -6.403 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.271 8.345 -8.184 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.852 7.555 -6.677 1.00 0.00 H new ATOM 496 N GLY A 36 -23.533 3.663 -10.244 1.00 0.00 N ATOM 497 CA GLY A 36 -23.992 3.301 -11.612 1.00 0.00 C ATOM 498 C GLY A 36 -22.795 2.826 -12.457 1.00 0.00 C ATOM 499 O GLY A 36 -22.977 2.319 -13.557 1.00 0.00 O ATOM 0 H GLY A 36 -23.457 2.875 -9.601 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.744 2.514 -11.556 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -24.465 4.161 -12.086 1.00 0.00 H new ATOM 503 N LYS A 37 -21.560 3.015 -11.962 1.00 0.00 N ATOM 504 CA LYS A 37 -20.355 2.604 -12.751 1.00 0.00 C ATOM 505 C LYS A 37 -19.892 1.171 -12.403 1.00 0.00 C ATOM 506 O LYS A 37 -20.269 0.230 -13.092 1.00 0.00 O ATOM 507 CB LYS A 37 -19.223 3.615 -12.504 1.00 0.00 C ATOM 508 CG LYS A 37 -19.720 5.042 -12.824 1.00 0.00 C ATOM 509 CD LYS A 37 -20.243 5.111 -14.267 1.00 0.00 C ATOM 510 CE LYS A 37 -20.238 6.563 -14.751 1.00 0.00 C ATOM 511 NZ LYS A 37 -18.912 6.876 -15.347 1.00 0.00 N ATOM 0 H LYS A 37 -21.358 3.433 -11.054 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.623 2.599 -13.808 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.892 3.559 -11.467 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -18.362 3.371 -13.127 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -20.511 5.324 -12.129 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.908 5.756 -12.689 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.620 4.499 -14.919 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -21.253 4.705 -14.317 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -21.026 6.716 -15.488 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.444 7.237 -13.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -19.007 7.676 -16.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -18.242 7.127 -14.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.558 6.045 -15.862 1.00 0.00 H new ATOM 525 N THR A 38 -19.046 0.987 -11.371 1.00 0.00 N ATOM 526 CA THR A 38 -18.539 -0.411 -11.051 1.00 0.00 C ATOM 527 C THR A 38 -17.838 -0.470 -9.658 1.00 0.00 C ATOM 528 O THR A 38 -17.911 -1.476 -8.973 1.00 0.00 O ATOM 529 CB THR A 38 -17.541 -0.792 -12.187 1.00 0.00 C ATOM 530 OG1 THR A 38 -18.272 -1.196 -13.333 1.00 0.00 O ATOM 531 CG2 THR A 38 -16.578 -1.936 -11.786 1.00 0.00 C ATOM 0 H THR A 38 -18.700 1.727 -10.760 1.00 0.00 H new ATOM 0 HA THR A 38 -19.372 -1.113 -11.000 1.00 0.00 H new ATOM 0 HB THR A 38 -16.936 0.092 -12.390 1.00 0.00 H new ATOM 0 HG1 THR A 38 -19.232 -1.126 -13.150 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.908 -2.156 -12.617 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.992 -1.631 -10.919 1.00 0.00 H new ATOM 0 HG23 THR A 38 -17.155 -2.827 -11.539 1.00 0.00 H new ATOM 539 N PHE A 39 -17.127 0.569 -9.295 1.00 0.00 N ATOM 540 CA PHE A 39 -16.349 0.594 -7.994 1.00 0.00 C ATOM 541 C PHE A 39 -17.224 0.466 -6.780 1.00 0.00 C ATOM 542 O PHE A 39 -16.825 -0.115 -5.794 1.00 0.00 O ATOM 543 CB PHE A 39 -15.658 1.906 -7.901 1.00 0.00 C ATOM 544 CG PHE A 39 -14.754 2.145 -9.111 1.00 0.00 C ATOM 545 CD1 PHE A 39 -14.454 1.110 -10.039 1.00 0.00 C ATOM 546 CD2 PHE A 39 -14.210 3.406 -9.295 1.00 0.00 C ATOM 547 CE1 PHE A 39 -13.636 1.365 -11.119 1.00 0.00 C ATOM 548 CE2 PHE A 39 -13.393 3.658 -10.366 1.00 0.00 C ATOM 549 CZ PHE A 39 -13.102 2.631 -11.292 1.00 0.00 C ATOM 0 H PHE A 39 -17.045 1.422 -9.849 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.664 -0.254 -8.008 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -16.397 2.705 -7.833 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -15.064 1.943 -6.988 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.868 0.122 -9.897 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -14.431 4.194 -8.591 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -13.413 0.581 -11.827 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -12.971 4.643 -10.502 1.00 0.00 H new ATOM 0 HZ PHE A 39 -12.461 2.834 -12.137 1.00 0.00 H new ATOM 559 N VAL A 40 -18.392 1.029 -6.836 1.00 0.00 N ATOM 560 CA VAL A 40 -19.343 0.984 -5.681 1.00 0.00 C ATOM 561 C VAL A 40 -19.629 -0.495 -5.328 1.00 0.00 C ATOM 562 O VAL A 40 -20.005 -0.817 -4.207 1.00 0.00 O ATOM 563 CB VAL A 40 -20.621 1.763 -6.056 1.00 0.00 C ATOM 564 CG1 VAL A 40 -21.102 1.327 -7.432 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.719 1.542 -4.999 1.00 0.00 C ATOM 0 H VAL A 40 -18.743 1.533 -7.651 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.918 1.458 -4.796 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.392 2.828 -6.084 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -22.005 1.879 -7.694 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -20.326 1.530 -8.170 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -21.321 0.259 -7.420 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.613 2.099 -5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.958 0.480 -4.939 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -21.365 1.890 -4.029 1.00 0.00 H new ATOM 575 N ASN A 41 -19.390 -1.399 -6.267 1.00 0.00 N ATOM 576 CA ASN A 41 -19.570 -2.832 -6.007 1.00 0.00 C ATOM 577 C ASN A 41 -18.227 -3.397 -5.466 1.00 0.00 C ATOM 578 O ASN A 41 -17.911 -4.566 -5.659 1.00 0.00 O ATOM 579 CB ASN A 41 -19.937 -3.517 -7.314 1.00 0.00 C ATOM 580 CG ASN A 41 -21.426 -3.298 -7.614 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.787 -2.370 -8.310 1.00 0.00 O ATOM 582 ND2 ASN A 41 -22.311 -4.123 -7.112 1.00 0.00 N ATOM 0 H ASN A 41 -19.073 -1.175 -7.210 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.361 -3.004 -5.277 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.330 -3.119 -8.127 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.722 -4.584 -7.249 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.303 -3.986 -7.305 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.008 -4.902 -6.528 1.00 0.00 H new ATOM 589 N ILE A 42 -17.425 -2.547 -4.786 1.00 0.00 N ATOM 590 CA ILE A 42 -16.117 -2.994 -4.238 1.00 0.00 C ATOM 591 C ILE A 42 -16.359 -3.807 -2.931 1.00 0.00 C ATOM 592 O ILE A 42 -17.127 -3.427 -2.062 1.00 0.00 O ATOM 593 CB ILE A 42 -15.198 -1.738 -4.009 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.391 -1.503 -5.300 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.223 -1.942 -2.826 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.893 -0.053 -5.370 1.00 0.00 C ATOM 0 H ILE A 42 -17.650 -1.569 -4.604 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.604 -3.652 -4.939 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.826 -0.881 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.543 -2.187 -5.334 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.012 -1.722 -6.168 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.608 -1.051 -2.704 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.791 -2.119 -1.913 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.582 -2.800 -3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.325 0.093 -6.289 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.746 0.626 -5.359 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.254 0.154 -4.512 1.00 0.00 H new ATOM 608 N THR A 43 -15.694 -4.918 -2.850 1.00 0.00 N ATOM 609 CA THR A 43 -15.780 -5.862 -1.694 1.00 0.00 C ATOM 610 C THR A 43 -14.344 -6.046 -1.118 1.00 0.00 C ATOM 611 O THR A 43 -13.416 -5.516 -1.686 1.00 0.00 O ATOM 612 CB THR A 43 -16.297 -7.181 -2.283 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.469 -7.565 -3.363 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.724 -6.969 -2.790 1.00 0.00 C ATOM 0 H THR A 43 -15.055 -5.232 -3.580 1.00 0.00 H new ATOM 0 HA THR A 43 -16.432 -5.510 -0.894 1.00 0.00 H new ATOM 0 HB THR A 43 -16.286 -7.960 -1.521 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.795 -8.408 -3.742 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.103 -7.900 -3.211 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.362 -6.659 -1.962 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.726 -6.196 -3.558 1.00 0.00 H new ATOM 622 N PRO A 44 -14.176 -6.828 -0.017 1.00 0.00 N ATOM 623 CA PRO A 44 -12.829 -7.072 0.563 1.00 0.00 C ATOM 624 C PRO A 44 -11.986 -8.002 -0.315 1.00 0.00 C ATOM 625 O PRO A 44 -10.839 -8.303 0.007 1.00 0.00 O ATOM 626 CB PRO A 44 -13.106 -7.699 1.909 1.00 0.00 C ATOM 627 CG PRO A 44 -14.545 -8.275 1.847 1.00 0.00 C ATOM 628 CD PRO A 44 -15.270 -7.516 0.713 1.00 0.00 C ATOM 0 HA PRO A 44 -12.251 -6.151 0.640 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.383 -8.486 2.125 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -13.019 -6.960 2.705 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.526 -9.346 1.647 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -15.060 -8.137 2.798 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.816 -8.198 0.062 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.995 -6.804 1.109 1.00 0.00 H new ATOM 636 N ALA A 45 -12.530 -8.430 -1.419 1.00 0.00 N ATOM 637 CA ALA A 45 -11.786 -9.308 -2.358 1.00 0.00 C ATOM 638 C ALA A 45 -10.983 -8.412 -3.269 1.00 0.00 C ATOM 639 O ALA A 45 -9.735 -8.394 -3.249 1.00 0.00 O ATOM 640 CB ALA A 45 -12.785 -10.123 -3.178 1.00 0.00 C ATOM 0 H ALA A 45 -13.479 -8.202 -1.714 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.130 -9.994 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.246 -10.770 -3.870 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.393 -10.733 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.430 -9.448 -3.741 1.00 0.00 H new ATOM 646 N GLU A 46 -11.690 -7.641 -4.045 1.00 0.00 N ATOM 647 CA GLU A 46 -11.019 -6.676 -4.984 1.00 0.00 C ATOM 648 C GLU A 46 -10.187 -5.673 -4.145 1.00 0.00 C ATOM 649 O GLU A 46 -9.143 -5.198 -4.580 1.00 0.00 O ATOM 650 CB GLU A 46 -12.062 -5.941 -5.863 1.00 0.00 C ATOM 651 CG GLU A 46 -13.317 -5.586 -5.075 1.00 0.00 C ATOM 652 CD GLU A 46 -14.513 -6.387 -5.616 1.00 0.00 C ATOM 653 OE1 GLU A 46 -14.412 -7.601 -5.665 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.507 -5.770 -5.966 1.00 0.00 O ATOM 0 H GLU A 46 -12.709 -7.631 -4.076 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.360 -7.219 -5.661 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.619 -5.032 -6.269 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.331 -6.571 -6.711 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.168 -5.806 -4.018 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.517 -4.517 -5.154 1.00 0.00 H new ATOM 661 N VAL A 47 -10.623 -5.412 -2.912 1.00 0.00 N ATOM 662 CA VAL A 47 -9.869 -4.520 -1.986 1.00 0.00 C ATOM 663 C VAL A 47 -8.772 -5.325 -1.256 1.00 0.00 C ATOM 664 O VAL A 47 -7.777 -4.763 -0.825 1.00 0.00 O ATOM 665 CB VAL A 47 -10.879 -3.805 -1.031 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.330 -3.581 0.324 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.117 -2.393 -1.545 1.00 0.00 C ATOM 0 H VAL A 47 -11.484 -5.794 -2.520 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.346 -3.736 -2.534 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.762 -4.443 -0.997 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.077 -3.081 0.941 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.069 -4.539 0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.439 -2.957 0.257 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.820 -1.881 -0.889 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.173 -1.848 -1.562 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.528 -2.437 -2.553 1.00 0.00 H new ATOM 677 N GLY A 48 -8.942 -6.627 -1.144 1.00 0.00 N ATOM 678 CA GLY A 48 -7.907 -7.486 -0.475 1.00 0.00 C ATOM 679 C GLY A 48 -6.591 -7.397 -1.247 1.00 0.00 C ATOM 680 O GLY A 48 -5.520 -7.550 -0.683 1.00 0.00 O ATOM 0 H GLY A 48 -9.758 -7.132 -1.490 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.759 -7.160 0.555 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.248 -8.520 -0.436 1.00 0.00 H new ATOM 684 N VAL A 49 -6.679 -7.163 -2.538 1.00 0.00 N ATOM 685 CA VAL A 49 -5.435 -7.052 -3.405 1.00 0.00 C ATOM 686 C VAL A 49 -5.043 -5.579 -3.559 1.00 0.00 C ATOM 687 O VAL A 49 -3.864 -5.237 -3.590 1.00 0.00 O ATOM 688 CB VAL A 49 -5.682 -7.685 -4.795 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.807 -6.942 -5.520 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.392 -7.604 -5.639 1.00 0.00 C ATOM 0 H VAL A 49 -7.559 -7.042 -3.040 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.621 -7.592 -2.922 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.969 -8.728 -4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.972 -7.396 -6.497 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.722 -7.004 -4.932 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.529 -5.896 -5.648 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.569 -8.051 -6.617 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.103 -6.560 -5.763 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.592 -8.144 -5.133 1.00 0.00 H new ATOM 700 N LEU A 50 -6.021 -4.720 -3.616 1.00 0.00 N ATOM 701 CA LEU A 50 -5.778 -3.256 -3.722 1.00 0.00 C ATOM 702 C LEU A 50 -5.148 -2.733 -2.436 1.00 0.00 C ATOM 703 O LEU A 50 -4.715 -1.593 -2.379 1.00 0.00 O ATOM 704 CB LEU A 50 -7.146 -2.569 -3.815 1.00 0.00 C ATOM 705 CG LEU A 50 -7.663 -2.342 -5.218 1.00 0.00 C ATOM 706 CD1 LEU A 50 -9.184 -2.109 -5.120 1.00 0.00 C ATOM 707 CD2 LEU A 50 -7.031 -1.083 -5.790 1.00 0.00 C ATOM 0 H LEU A 50 -7.007 -4.981 -3.593 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.133 -3.062 -4.579 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.874 -3.171 -3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.085 -1.606 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.427 -3.197 -5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.591 -1.941 -6.117 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.658 -2.985 -4.677 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.379 -1.236 -4.497 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.402 -0.917 -6.801 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.290 -0.229 -5.164 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.947 -1.199 -5.815 1.00 0.00 H new ATOM 719 N VAL A 51 -5.252 -3.504 -1.361 1.00 0.00 N ATOM 720 CA VAL A 51 -4.827 -2.975 -0.012 1.00 0.00 C ATOM 721 C VAL A 51 -4.247 -4.062 0.925 1.00 0.00 C ATOM 722 O VAL A 51 -3.723 -3.737 1.981 1.00 0.00 O ATOM 723 CB VAL A 51 -6.149 -2.334 0.642 1.00 0.00 C ATOM 724 CG1 VAL A 51 -7.115 -1.798 -0.450 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.944 -3.380 1.476 1.00 0.00 C ATOM 0 H VAL A 51 -5.607 -4.460 -1.361 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.022 -2.252 -0.143 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.802 -1.523 1.283 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.999 -1.371 0.024 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.611 -1.030 -1.036 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.414 -2.616 -1.105 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.830 -2.909 1.901 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.246 -4.205 0.832 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.313 -3.760 2.280 1.00 0.00 H new ATOM 735 N GLY A 52 -4.377 -5.316 0.578 1.00 0.00 N ATOM 736 CA GLY A 52 -3.866 -6.428 1.487 1.00 0.00 C ATOM 737 C GLY A 52 -2.347 -6.297 1.747 1.00 0.00 C ATOM 738 O GLY A 52 -1.851 -5.282 2.218 1.00 0.00 O ATOM 0 H GLY A 52 -4.811 -5.634 -0.289 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.402 -6.399 2.436 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -4.076 -7.396 1.032 1.00 0.00 H new ATOM 822 N PHE A 58 0.635 -8.893 -6.982 1.00 0.00 N ATOM 823 CA PHE A 58 -0.274 -8.286 -8.064 1.00 0.00 C ATOM 824 C PHE A 58 0.356 -7.201 -8.951 1.00 0.00 C ATOM 825 O PHE A 58 -0.207 -6.907 -9.995 1.00 0.00 O ATOM 826 CB PHE A 58 -1.571 -7.758 -7.471 1.00 0.00 C ATOM 827 CG PHE A 58 -1.295 -6.767 -6.407 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.890 -5.483 -6.752 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.461 -7.119 -5.067 1.00 0.00 C ATOM 830 CE1 PHE A 58 -0.647 -4.551 -5.763 1.00 0.00 C ATOM 831 CE2 PHE A 58 -1.221 -6.181 -4.076 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.815 -4.895 -4.426 1.00 0.00 C ATOM 0 HA PHE A 58 -0.464 -9.131 -8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.174 -7.299 -8.254 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.153 -8.584 -7.063 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.766 -5.215 -7.791 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.775 -8.118 -4.804 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.326 -3.554 -6.028 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.348 -6.446 -3.037 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.630 -4.162 -3.655 1.00 0.00 H new ATOM 842 N TYR A 59 1.493 -6.577 -8.605 1.00 0.00 N ATOM 843 CA TYR A 59 2.038 -5.519 -9.529 1.00 0.00 C ATOM 844 C TYR A 59 2.232 -6.065 -10.947 1.00 0.00 C ATOM 845 O TYR A 59 2.415 -5.298 -11.889 1.00 0.00 O ATOM 846 CB TYR A 59 3.362 -4.924 -9.041 1.00 0.00 C ATOM 847 CG TYR A 59 3.329 -4.495 -7.603 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.221 -3.852 -7.103 1.00 0.00 C ATOM 849 CD2 TYR A 59 4.459 -4.684 -6.799 1.00 0.00 C ATOM 850 CE1 TYR A 59 2.217 -3.387 -5.778 1.00 0.00 C ATOM 851 CE2 TYR A 59 4.460 -4.233 -5.488 1.00 0.00 C ATOM 852 CZ TYR A 59 3.342 -3.578 -4.972 1.00 0.00 C ATOM 853 OH TYR A 59 3.346 -3.124 -3.670 1.00 0.00 O ATOM 0 H TYR A 59 2.035 -6.754 -7.759 1.00 0.00 H new ATOM 0 HA TYR A 59 1.292 -4.725 -9.536 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.154 -5.661 -9.174 1.00 0.00 H new ATOM 0 HB3 TYR A 59 3.617 -4.066 -9.663 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.354 -3.705 -7.730 1.00 0.00 H new ATOM 0 HD2 TYR A 59 5.330 -5.181 -7.200 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.347 -2.883 -5.383 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.328 -4.389 -4.865 1.00 0.00 H new ATOM 0 HH TYR A 59 3.635 -2.188 -3.651 1.00 0.00 H new ATOM 863 N VAL A 60 2.194 -7.363 -11.102 1.00 0.00 N ATOM 864 CA VAL A 60 2.367 -7.982 -12.420 1.00 0.00 C ATOM 865 C VAL A 60 1.018 -8.381 -13.022 1.00 0.00 C ATOM 866 O VAL A 60 0.816 -8.231 -14.223 1.00 0.00 O ATOM 867 CB VAL A 60 3.247 -9.194 -12.274 1.00 0.00 C ATOM 868 CG1 VAL A 60 4.632 -8.723 -11.874 1.00 0.00 C ATOM 869 CG2 VAL A 60 2.706 -10.151 -11.197 1.00 0.00 C ATOM 0 H VAL A 60 2.045 -8.025 -10.340 1.00 0.00 H new ATOM 0 HA VAL A 60 2.831 -7.262 -13.094 1.00 0.00 H new ATOM 0 HB VAL A 60 3.272 -9.734 -13.221 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.291 -9.584 -11.761 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.028 -8.062 -12.645 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.574 -8.184 -10.928 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.364 -11.016 -11.116 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.666 -9.634 -10.238 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.705 -10.481 -11.473 1.00 0.00 H new ATOM 879 N ASN A 61 0.085 -8.891 -12.209 1.00 0.00 N ATOM 880 CA ASN A 61 -1.231 -9.289 -12.762 1.00 0.00 C ATOM 881 C ASN A 61 -2.160 -8.072 -12.822 1.00 0.00 C ATOM 882 O ASN A 61 -2.629 -7.710 -13.897 1.00 0.00 O ATOM 883 CB ASN A 61 -1.865 -10.444 -11.963 1.00 0.00 C ATOM 884 CG ASN A 61 -1.681 -10.316 -10.469 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.392 -9.583 -9.810 1.00 0.00 O ATOM 886 ND2 ASN A 61 -0.771 -11.052 -9.887 1.00 0.00 N ATOM 0 H ASN A 61 0.200 -9.037 -11.206 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.077 -9.661 -13.775 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.931 -10.488 -12.187 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -1.430 -11.387 -12.295 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.655 -11.013 -8.874 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.177 -11.665 -10.445 1.00 0.00 H new ATOM 893 N GLY A 62 -2.414 -7.414 -11.693 1.00 0.00 N ATOM 894 CA GLY A 62 -3.281 -6.205 -11.698 1.00 0.00 C ATOM 895 C GLY A 62 -4.316 -6.275 -10.575 1.00 0.00 C ATOM 896 O GLY A 62 -4.796 -7.347 -10.220 1.00 0.00 O ATOM 0 H GLY A 62 -2.049 -7.677 -10.777 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.668 -5.312 -11.579 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.787 -6.118 -12.660 1.00 0.00 H new ATOM 900 N LEU A 63 -4.672 -5.117 -10.020 1.00 0.00 N ATOM 901 CA LEU A 63 -5.692 -5.068 -8.918 1.00 0.00 C ATOM 902 C LEU A 63 -7.071 -5.249 -9.524 1.00 0.00 C ATOM 903 O LEU A 63 -7.209 -5.740 -10.640 1.00 0.00 O ATOM 904 CB LEU A 63 -5.652 -3.703 -8.167 1.00 0.00 C ATOM 905 CG LEU A 63 -4.243 -3.296 -7.814 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.278 -1.873 -7.227 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.709 -4.265 -6.777 1.00 0.00 C ATOM 0 H LEU A 63 -4.293 -4.210 -10.291 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.468 -5.861 -8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.107 -2.933 -8.790 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.249 -3.771 -7.257 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.602 -3.312 -8.695 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.266 -1.562 -6.966 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.690 -1.185 -7.965 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.903 -1.863 -6.334 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.690 -3.986 -6.509 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.340 -4.231 -5.889 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.713 -5.275 -7.187 1.00 0.00 H new ATOM 919 N THR A 64 -8.092 -4.839 -8.793 1.00 0.00 N ATOM 920 CA THR A 64 -9.461 -4.949 -9.251 1.00 0.00 C ATOM 921 C THR A 64 -10.279 -4.004 -8.440 1.00 0.00 C ATOM 922 O THR A 64 -10.249 -4.051 -7.230 1.00 0.00 O ATOM 923 CB THR A 64 -9.971 -6.364 -9.018 1.00 0.00 C ATOM 924 OG1 THR A 64 -9.640 -6.777 -7.702 1.00 0.00 O ATOM 925 CG2 THR A 64 -9.325 -7.291 -10.016 1.00 0.00 C ATOM 0 H THR A 64 -7.994 -4.422 -7.868 1.00 0.00 H new ATOM 0 HA THR A 64 -9.526 -4.719 -10.314 1.00 0.00 H new ATOM 0 HB THR A 64 -11.054 -6.390 -9.140 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.585 -5.993 -7.117 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.686 -8.307 -9.855 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.579 -6.971 -11.027 1.00 0.00 H new ATOM 0 HG23 THR A 64 -8.243 -7.266 -9.889 1.00 0.00 H new ATOM 933 N LEU A 65 -10.989 -3.151 -9.083 1.00 0.00 N ATOM 934 CA LEU A 65 -11.865 -2.185 -8.344 1.00 0.00 C ATOM 935 C LEU A 65 -13.271 -2.310 -8.904 1.00 0.00 C ATOM 936 O LEU A 65 -13.575 -1.817 -9.984 1.00 0.00 O ATOM 937 CB LEU A 65 -11.350 -0.745 -8.441 1.00 0.00 C ATOM 938 CG LEU A 65 -10.995 -0.357 -9.869 1.00 0.00 C ATOM 939 CD1 LEU A 65 -10.890 1.167 -9.937 1.00 0.00 C ATOM 940 CD2 LEU A 65 -9.649 -0.979 -10.268 1.00 0.00 C ATOM 0 H LEU A 65 -11.013 -3.066 -10.099 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.859 -2.429 -7.282 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.109 -0.063 -8.059 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.471 -0.632 -7.806 1.00 0.00 H new ATOM 0 HG LEU A 65 -11.763 -0.720 -10.553 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.636 1.469 -10.953 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.845 1.610 -9.655 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.114 1.509 -9.252 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.406 -0.694 -11.292 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.869 -0.620 -9.596 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.715 -2.065 -10.199 1.00 0.00 H new ATOM 952 N GLY A 66 -14.120 -3.031 -8.192 1.00 0.00 N ATOM 953 CA GLY A 66 -15.509 -3.280 -8.666 1.00 0.00 C ATOM 954 C GLY A 66 -15.457 -4.382 -9.733 1.00 0.00 C ATOM 955 O GLY A 66 -16.346 -4.496 -10.568 1.00 0.00 O ATOM 0 H GLY A 66 -13.895 -3.458 -7.293 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.146 -3.584 -7.835 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.939 -2.368 -9.081 1.00 0.00 H new ATOM 959 N GLY A 67 -14.395 -5.193 -9.714 1.00 0.00 N ATOM 960 CA GLY A 67 -14.237 -6.274 -10.717 1.00 0.00 C ATOM 961 C GLY A 67 -13.457 -5.738 -11.934 1.00 0.00 C ATOM 962 O GLY A 67 -13.338 -6.427 -12.942 1.00 0.00 O ATOM 0 H GLY A 67 -13.639 -5.132 -9.032 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.708 -7.119 -10.276 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -15.215 -6.639 -11.031 1.00 0.00 H new ATOM 966 N GLN A 68 -12.911 -4.502 -11.854 1.00 0.00 N ATOM 967 CA GLN A 68 -12.133 -3.950 -13.034 1.00 0.00 C ATOM 968 C GLN A 68 -10.647 -4.247 -12.879 1.00 0.00 C ATOM 969 O GLN A 68 -9.935 -3.558 -12.153 1.00 0.00 O ATOM 970 CB GLN A 68 -12.324 -2.468 -13.162 1.00 0.00 C ATOM 971 CG GLN A 68 -11.827 -2.012 -14.555 1.00 0.00 C ATOM 972 CD GLN A 68 -10.290 -1.836 -14.550 1.00 0.00 C ATOM 973 OE1 GLN A 68 -9.747 -1.180 -13.684 1.00 0.00 O ATOM 974 NE2 GLN A 68 -9.564 -2.403 -15.500 1.00 0.00 N ATOM 0 H GLN A 68 -12.976 -3.884 -11.045 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.513 -4.436 -13.933 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.376 -2.212 -13.036 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -11.773 -1.949 -12.378 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.113 -2.746 -15.308 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.306 -1.072 -14.829 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.018 -2.954 -16.228 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.550 -2.289 -15.504 1.00 0.00 H new ATOM 983 N LYS A 69 -10.168 -5.266 -13.565 1.00 0.00 N ATOM 984 CA LYS A 69 -8.756 -5.632 -13.501 1.00 0.00 C ATOM 985 C LYS A 69 -7.871 -4.483 -14.022 1.00 0.00 C ATOM 986 O LYS A 69 -7.728 -4.303 -15.229 1.00 0.00 O ATOM 987 CB LYS A 69 -8.557 -6.856 -14.385 1.00 0.00 C ATOM 988 CG LYS A 69 -7.274 -7.547 -14.002 1.00 0.00 C ATOM 989 CD LYS A 69 -7.595 -8.765 -13.143 1.00 0.00 C ATOM 990 CE LYS A 69 -6.382 -9.712 -13.101 1.00 0.00 C ATOM 991 NZ LYS A 69 -6.704 -10.970 -13.841 1.00 0.00 N ATOM 0 H LYS A 69 -10.731 -5.859 -14.175 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.475 -5.839 -12.468 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -9.399 -7.540 -14.273 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.524 -6.560 -15.433 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.730 -7.851 -14.896 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -6.628 -6.861 -13.454 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.856 -8.450 -12.133 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -8.462 -9.288 -13.548 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.514 -9.227 -13.547 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.123 -9.942 -12.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.884 -11.609 -13.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.521 -11.435 -13.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.931 -10.743 -14.830 1.00 0.00 H new ATOM 1005 N CYS A 70 -7.220 -3.740 -13.120 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.285 -2.655 -13.550 1.00 0.00 C ATOM 1007 C CYS A 70 -4.894 -3.147 -13.189 1.00 0.00 C ATOM 1008 O CYS A 70 -4.762 -4.118 -12.464 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.602 -1.367 -12.814 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.686 -1.672 -11.030 1.00 0.00 S ATOM 0 H CYS A 70 -7.308 -3.853 -12.110 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.371 -2.444 -14.616 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.838 -0.620 -13.027 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.551 -0.962 -13.166 1.00 0.00 H new ATOM 0 HG CYS A 70 -7.619 -2.542 -10.782 1.00 0.00 H new ATOM 1016 N SER A 71 -3.861 -2.531 -13.693 1.00 0.00 N ATOM 1017 CA SER A 71 -2.468 -3.040 -13.367 1.00 0.00 C ATOM 1018 C SER A 71 -1.562 -1.940 -12.859 1.00 0.00 C ATOM 1019 O SER A 71 -1.227 -1.010 -13.568 1.00 0.00 O ATOM 1020 CB SER A 71 -1.849 -3.693 -14.586 1.00 0.00 C ATOM 1021 OG SER A 71 -1.100 -2.761 -15.342 1.00 0.00 O ATOM 0 H SER A 71 -3.901 -1.715 -14.304 1.00 0.00 H new ATOM 0 HA SER A 71 -2.573 -3.776 -12.570 1.00 0.00 H new ATOM 0 HB2 SER A 71 -1.204 -4.514 -14.273 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.633 -4.123 -15.209 1.00 0.00 H new ATOM 0 HG SER A 71 -1.301 -1.853 -15.034 1.00 0.00 H new ATOM 1027 N VAL A 72 -1.143 -2.088 -11.649 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.222 -1.116 -10.992 1.00 0.00 C ATOM 1029 C VAL A 72 0.914 -0.693 -11.899 1.00 0.00 C ATOM 1030 O VAL A 72 1.595 -1.505 -12.517 1.00 0.00 O ATOM 1031 CB VAL A 72 0.427 -1.719 -9.751 1.00 0.00 C ATOM 1032 CG1 VAL A 72 0.916 -0.589 -8.854 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.548 -2.609 -8.973 1.00 0.00 C ATOM 0 H VAL A 72 -1.407 -2.874 -11.055 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.846 -0.258 -10.740 1.00 0.00 H new ATOM 0 HB VAL A 72 1.261 -2.345 -10.069 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.382 -1.008 -7.962 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.644 0.015 -9.395 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.072 0.035 -8.562 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.046 -3.019 -8.096 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.407 -2.017 -8.656 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.885 -3.425 -9.612 1.00 0.00 H new ATOM 1043 N ILE A 73 1.140 0.574 -11.901 1.00 0.00 N ATOM 1044 CA ILE A 73 2.242 1.177 -12.647 1.00 0.00 C ATOM 1045 C ILE A 73 2.892 2.220 -11.688 1.00 0.00 C ATOM 1046 O ILE A 73 2.711 3.396 -11.786 1.00 0.00 O ATOM 1047 CB ILE A 73 1.749 1.798 -13.963 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.517 0.667 -15.012 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.775 2.803 -14.528 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.035 0.606 -15.420 1.00 0.00 C ATOM 0 H ILE A 73 0.572 1.247 -11.386 1.00 0.00 H new ATOM 0 HA ILE A 73 2.981 0.435 -12.949 1.00 0.00 H new ATOM 0 HB ILE A 73 0.819 2.329 -13.761 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.135 0.846 -15.892 1.00 0.00 H new ATOM 0 HG13 ILE A 73 1.825 -0.292 -14.596 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.397 3.225 -15.459 1.00 0.00 H new ATOM 0 HG22 ILE A 73 2.936 3.604 -13.806 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.718 2.291 -14.718 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.108 -0.189 -16.152 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.576 0.404 -14.541 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.262 1.560 -15.857 1.00 0.00 H new ATOM 1062 N ARG A 74 3.587 1.697 -10.739 1.00 0.00 N ATOM 1063 CA ARG A 74 4.315 2.471 -9.639 1.00 0.00 C ATOM 1064 C ARG A 74 3.479 2.396 -8.381 1.00 0.00 C ATOM 1065 O ARG A 74 2.647 3.264 -8.116 1.00 0.00 O ATOM 1066 CB ARG A 74 4.582 3.948 -10.014 1.00 0.00 C ATOM 1067 CG ARG A 74 5.856 4.432 -9.309 1.00 0.00 C ATOM 1068 CD ARG A 74 7.083 3.707 -9.885 1.00 0.00 C ATOM 1069 NE ARG A 74 8.025 4.706 -10.459 1.00 0.00 N ATOM 1070 CZ ARG A 74 9.185 4.321 -10.915 1.00 0.00 C ATOM 1071 NH1 ARG A 74 9.253 3.602 -12.004 1.00 0.00 N ATOM 1072 NH2 ARG A 74 10.276 4.640 -10.278 1.00 0.00 N ATOM 0 H ARG A 74 3.706 0.688 -10.651 1.00 0.00 H new ATOM 0 HA ARG A 74 5.294 2.015 -9.491 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.692 4.046 -11.094 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.734 4.568 -9.722 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.966 5.509 -9.438 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.782 4.245 -8.238 1.00 0.00 H new ATOM 0 HD2 ARG A 74 7.579 3.131 -9.103 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.773 3.000 -10.654 1.00 0.00 H new ATOM 0 HE ARG A 74 7.764 5.691 -10.496 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.399 3.342 -12.497 1.00 0.00 H new ATOM 0 HH12 ARG A 74 10.160 3.301 -12.361 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.224 5.191 -9.422 1.00 0.00 H new ATOM 0 HH22 ARG A 74 11.182 4.338 -10.636 1.00 0.00 H new ATOM 1086 N ASP A 75 3.670 1.337 -7.601 1.00 0.00 N ATOM 1087 CA ASP A 75 2.871 1.174 -6.369 1.00 0.00 C ATOM 1088 C ASP A 75 3.478 1.984 -5.240 1.00 0.00 C ATOM 1089 O ASP A 75 4.453 1.584 -4.610 1.00 0.00 O ATOM 1090 CB ASP A 75 2.739 -0.328 -5.987 1.00 0.00 C ATOM 1091 CG ASP A 75 2.257 -0.498 -4.531 1.00 0.00 C ATOM 1092 OD1 ASP A 75 3.094 -0.491 -3.645 1.00 0.00 O ATOM 1093 OD2 ASP A 75 1.059 -0.622 -4.340 1.00 0.00 O ATOM 0 H ASP A 75 4.346 0.595 -7.782 1.00 0.00 H new ATOM 0 HA ASP A 75 1.865 1.551 -6.553 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.038 -0.817 -6.663 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.702 -0.823 -6.113 1.00 0.00 H new ATOM 1098 N SER A 76 2.849 3.092 -4.945 1.00 0.00 N ATOM 1099 CA SER A 76 3.294 3.948 -3.800 1.00 0.00 C ATOM 1100 C SER A 76 2.153 3.970 -2.748 1.00 0.00 C ATOM 1101 O SER A 76 2.296 4.547 -1.696 1.00 0.00 O ATOM 1102 CB SER A 76 3.635 5.380 -4.260 1.00 0.00 C ATOM 1103 OG SER A 76 4.910 5.736 -3.749 1.00 0.00 O ATOM 0 H SER A 76 2.038 3.445 -5.452 1.00 0.00 H new ATOM 0 HA SER A 76 4.204 3.532 -3.368 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.636 5.436 -5.349 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.878 6.080 -3.906 1.00 0.00 H new ATOM 0 HG SER A 76 5.467 6.088 -4.475 1.00 0.00 H new ATOM 1109 N LEU A 77 1.014 3.285 -3.061 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.189 3.172 -2.147 1.00 0.00 C ATOM 1111 C LEU A 77 0.211 3.187 -0.706 1.00 0.00 C ATOM 1112 O LEU A 77 -0.440 3.818 0.107 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.855 1.838 -2.474 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.294 1.812 -1.985 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.105 2.891 -2.704 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.897 0.426 -2.282 1.00 0.00 C ATOM 0 H LEU A 77 0.893 2.794 -3.947 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.859 4.018 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.830 1.670 -3.551 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.295 1.025 -2.011 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.321 2.005 -0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.136 2.868 -2.350 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.672 3.870 -2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -3.086 2.705 -3.778 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.930 0.397 -1.935 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.870 0.240 -3.356 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -2.319 -0.340 -1.766 1.00 0.00 H new ATOM 1128 N LEU A 78 1.286 2.541 -0.371 1.00 0.00 N ATOM 1129 CA LEU A 78 1.724 2.569 1.013 1.00 0.00 C ATOM 1130 C LEU A 78 2.714 3.723 1.162 1.00 0.00 C ATOM 1131 O LEU A 78 3.664 3.835 0.437 1.00 0.00 O ATOM 1132 CB LEU A 78 2.240 1.216 1.404 1.00 0.00 C ATOM 1133 CG LEU A 78 1.030 0.227 1.371 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.485 -1.245 1.308 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.175 0.431 2.622 1.00 0.00 C ATOM 0 H LEU A 78 1.870 1.999 -1.008 1.00 0.00 H new ATOM 0 HA LEU A 78 0.912 2.764 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.021 0.890 0.717 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.683 1.247 2.399 1.00 0.00 H new ATOM 0 HG LEU A 78 0.455 0.440 0.470 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.611 -1.896 1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.078 -1.404 0.407 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.089 -1.477 2.185 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.670 -0.258 2.602 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.778 0.240 3.510 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.193 1.457 2.648 1.00 0.00 H new ATOM 1183 N GLU A 82 4.144 8.984 -0.636 1.00 0.00 N ATOM 1184 CA GLU A 82 3.301 9.096 -1.842 1.00 0.00 C ATOM 1185 C GLU A 82 1.858 8.535 -1.682 1.00 0.00 C ATOM 1186 O GLU A 82 0.894 9.182 -2.051 1.00 0.00 O ATOM 1187 CB GLU A 82 3.951 8.239 -2.900 1.00 0.00 C ATOM 1188 CG GLU A 82 5.054 8.970 -3.672 1.00 0.00 C ATOM 1189 CD GLU A 82 4.526 10.284 -4.274 1.00 0.00 C ATOM 1190 OE1 GLU A 82 3.677 10.216 -5.147 1.00 0.00 O ATOM 1191 OE2 GLU A 82 4.987 11.332 -3.848 1.00 0.00 O ATOM 0 HA GLU A 82 3.222 10.158 -2.073 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.372 7.350 -2.431 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.189 7.898 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.891 9.181 -3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.433 8.328 -4.467 1.00 0.00 H new ATOM 1198 N PHE A 83 1.740 7.273 -1.272 1.00 0.00 N ATOM 1199 CA PHE A 83 0.390 6.547 -1.235 1.00 0.00 C ATOM 1200 C PHE A 83 -0.227 6.490 -2.675 1.00 0.00 C ATOM 1201 O PHE A 83 -1.341 6.035 -2.828 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.685 7.172 -0.336 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.246 8.430 0.367 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.703 8.365 1.375 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -0.817 9.664 0.010 1.00 0.00 C ATOM 1206 CE1 PHE A 83 1.103 9.533 2.042 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.420 10.836 0.673 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.542 10.771 1.690 1.00 0.00 C ATOM 0 H PHE A 83 2.527 6.705 -0.957 1.00 0.00 H new ATOM 0 HA PHE A 83 0.637 5.569 -0.822 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.564 7.395 -0.941 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.989 6.439 0.411 1.00 0.00 H new ATOM 0 HD1 PHE A 83 1.135 7.414 1.648 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.560 9.710 -0.773 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.843 9.480 2.827 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -0.855 11.786 0.400 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.851 11.671 2.202 1.00 0.00 H new ATOM 1218 N SER A 84 0.462 6.976 -3.716 1.00 0.00 N ATOM 1219 CA SER A 84 -0.146 6.971 -5.087 1.00 0.00 C ATOM 1220 C SER A 84 0.294 5.739 -5.856 1.00 0.00 C ATOM 1221 O SER A 84 1.451 5.378 -5.874 1.00 0.00 O ATOM 1222 CB SER A 84 0.243 8.237 -5.826 1.00 0.00 C ATOM 1223 OG SER A 84 1.622 8.516 -5.599 1.00 0.00 O ATOM 0 H SER A 84 1.403 7.366 -3.660 1.00 0.00 H new ATOM 0 HA SER A 84 -1.232 6.941 -4.996 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.056 8.120 -6.893 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.369 9.072 -5.485 1.00 0.00 H new ATOM 0 HG SER A 84 1.743 9.479 -5.465 1.00 0.00 H new ATOM 1229 N MET A 85 -0.664 5.088 -6.456 1.00 0.00 N ATOM 1230 CA MET A 85 -0.432 3.820 -7.214 1.00 0.00 C ATOM 1231 C MET A 85 -1.038 3.984 -8.615 1.00 0.00 C ATOM 1232 O MET A 85 -2.206 4.266 -8.729 1.00 0.00 O ATOM 1233 CB MET A 85 -1.211 2.807 -6.431 1.00 0.00 C ATOM 1234 CG MET A 85 -0.811 1.390 -6.684 1.00 0.00 C ATOM 1235 SD MET A 85 -1.827 0.364 -5.609 1.00 0.00 S ATOM 1236 CE MET A 85 -1.164 -1.203 -6.112 1.00 0.00 C ATOM 0 H MET A 85 -1.637 5.394 -6.453 1.00 0.00 H new ATOM 0 HA MET A 85 0.617 3.547 -7.329 1.00 0.00 H new ATOM 0 HB2 MET A 85 -1.095 3.020 -5.368 1.00 0.00 H new ATOM 0 HB3 MET A 85 -2.269 2.920 -6.665 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.965 1.125 -7.730 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.248 1.243 -6.471 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.283 -1.925 -5.304 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.696 -1.556 -6.996 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.105 -1.092 -6.346 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.268 3.827 -9.688 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.879 4.026 -11.066 1.00 0.00 C ATOM 1248 C ASP A 86 -1.380 2.702 -11.640 1.00 0.00 C ATOM 1249 O ASP A 86 -0.752 2.126 -12.503 1.00 0.00 O ATOM 1250 CB ASP A 86 0.172 4.590 -11.967 1.00 0.00 C ATOM 1251 CG ASP A 86 0.138 6.114 -11.923 1.00 0.00 C ATOM 1252 OD1 ASP A 86 -0.926 6.669 -12.139 1.00 0.00 O ATOM 1253 OD2 ASP A 86 1.176 6.703 -11.670 1.00 0.00 O ATOM 0 H ASP A 86 0.721 3.579 -9.674 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.729 4.704 -10.987 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.155 4.232 -11.661 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.010 4.244 -12.988 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.540 2.234 -11.241 1.00 0.00 N ATOM 1259 CA LEU A 87 -3.026 0.967 -11.833 1.00 0.00 C ATOM 1260 C LEU A 87 -3.938 1.313 -12.951 1.00 0.00 C ATOM 1261 O LEU A 87 -4.941 1.986 -12.775 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.644 -0.028 -10.809 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.300 0.615 -9.559 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.279 1.362 -8.707 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.434 1.535 -9.975 1.00 0.00 C ATOM 0 H LEU A 87 -3.151 2.668 -10.549 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.172 0.406 -12.213 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.395 -0.629 -11.322 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.862 -0.710 -10.476 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.707 -0.188 -8.945 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.777 1.798 -7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.508 0.668 -8.371 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.821 2.154 -9.299 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.886 1.980 -9.088 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.045 2.324 -10.619 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.187 0.963 -10.517 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.550 0.913 -14.141 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.368 1.286 -15.364 1.00 0.00 C ATOM 1279 C ARG A 88 -4.906 0.080 -16.065 1.00 0.00 C ATOM 1280 O ARG A 88 -4.204 -0.874 -16.286 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.507 2.173 -16.359 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.707 1.364 -17.430 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.123 2.372 -18.432 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.726 1.994 -18.792 1.00 0.00 N ATOM 1285 CZ ARG A 88 -0.429 1.694 -20.029 1.00 0.00 C ATOM 1286 NH1 ARG A 88 -1.070 0.737 -20.636 1.00 0.00 N ATOM 1287 NH2 ARG A 88 0.510 2.353 -20.658 1.00 0.00 N ATOM 0 H ARG A 88 -2.718 0.353 -14.327 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.222 1.870 -15.021 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.171 2.869 -16.871 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -2.806 2.771 -15.777 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.911 0.787 -16.959 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.358 0.653 -17.938 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.741 2.403 -19.329 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.136 3.373 -18.001 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.003 1.970 -18.073 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.802 0.223 -20.146 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.840 0.501 -21.601 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.012 3.103 -20.183 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.740 2.117 -21.623 1.00 0.00 H new ATOM 1301 N THR A 89 -6.169 0.150 -16.473 1.00 0.00 N ATOM 1302 CA THR A 89 -6.795 -0.984 -17.248 1.00 0.00 C ATOM 1303 C THR A 89 -5.906 -1.170 -18.480 1.00 0.00 C ATOM 1304 O THR A 89 -5.941 -0.372 -19.399 1.00 0.00 O ATOM 1305 CB THR A 89 -8.268 -0.627 -17.661 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.294 0.137 -18.860 1.00 0.00 O ATOM 1307 CG2 THR A 89 -8.965 0.167 -16.543 1.00 0.00 C ATOM 0 H THR A 89 -6.787 0.943 -16.301 1.00 0.00 H new ATOM 0 HA THR A 89 -6.857 -1.898 -16.657 1.00 0.00 H new ATOM 0 HB THR A 89 -8.797 -1.565 -17.827 1.00 0.00 H new ATOM 0 HG1 THR A 89 -7.400 0.498 -19.037 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.984 0.405 -16.847 1.00 0.00 H new ATOM 0 HG22 THR A 89 -8.989 -0.431 -15.632 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.417 1.090 -16.356 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.058 -2.155 -18.463 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.121 -2.317 -19.564 1.00 0.00 C ATOM 1317 C LYS A 90 -4.765 -3.093 -20.690 1.00 0.00 C ATOM 1318 O LYS A 90 -5.828 -3.681 -20.544 1.00 0.00 O ATOM 1319 CB LYS A 90 -2.829 -3.021 -19.122 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.471 -2.771 -17.652 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.612 -1.512 -17.573 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.128 -1.891 -17.747 1.00 0.00 C ATOM 1323 NZ LYS A 90 0.518 -0.959 -18.711 1.00 0.00 N ATOM 0 H LYS A 90 -4.985 -2.852 -17.721 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.855 -1.319 -19.912 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.934 -4.094 -19.285 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.006 -2.682 -19.751 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.376 -2.651 -17.056 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.931 -3.625 -17.243 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.911 -0.806 -18.347 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.762 -1.016 -16.614 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.384 -1.847 -16.786 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.044 -2.917 -18.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.510 -1.238 -18.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 0.015 -0.997 -19.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.481 0.010 -18.335 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.788 4.640 -17.470 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.815 4.796 -16.324 1.00 0.00 C ATOM 1436 C ASN A 99 -6.494 5.219 -15.043 1.00 0.00 C ATOM 1437 O ASN A 99 -7.407 6.025 -15.025 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.670 5.776 -16.699 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.160 5.530 -18.146 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -2.951 5.892 -18.457 1.00 0.00 O flip ATOM 1441 ND2 ASN A 99 -4.853 5.006 -18.988 1.00 0.00 N flip ATOM 0 HA ASN A 99 -5.382 3.813 -16.140 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.024 6.803 -16.607 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.845 5.659 -15.997 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -5.804 4.717 -18.758 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -4.486 4.854 -19.928 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.026 4.630 -13.954 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.570 4.890 -12.615 1.00 0.00 C ATOM 1450 C VAL A 100 -5.422 5.176 -11.670 1.00 0.00 C ATOM 1451 O VAL A 100 -4.396 4.492 -11.697 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.263 3.612 -12.060 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.280 3.996 -11.006 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -7.963 2.822 -13.183 1.00 0.00 C ATOM 0 H VAL A 100 -5.259 3.958 -13.965 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.272 5.721 -12.686 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.494 2.977 -11.620 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.762 3.097 -10.621 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.779 4.517 -10.190 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -9.032 4.650 -11.447 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.437 1.935 -12.763 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.720 3.450 -13.653 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.228 2.521 -13.929 1.00 0.00 H new ATOM 1464 N THR A 101 -5.628 6.086 -10.777 1.00 0.00 N ATOM 1465 CA THR A 101 -4.639 6.362 -9.734 1.00 0.00 C ATOM 1466 C THR A 101 -5.332 5.936 -8.464 1.00 0.00 C ATOM 1467 O THR A 101 -6.523 6.105 -8.328 1.00 0.00 O ATOM 1468 CB THR A 101 -4.270 7.867 -9.683 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.385 8.171 -10.753 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.582 8.198 -8.338 1.00 0.00 C ATOM 0 H THR A 101 -6.467 6.664 -10.730 1.00 0.00 H new ATOM 0 HA THR A 101 -3.698 5.838 -9.904 1.00 0.00 H new ATOM 0 HB THR A 101 -5.179 8.462 -9.775 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.740 7.441 -10.862 1.00 0.00 H new ATOM 0 HG21 THR A 101 -3.326 9.257 -8.311 1.00 0.00 H new ATOM 0 HG22 THR A 101 -4.260 7.967 -7.516 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.674 7.603 -8.238 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.624 5.385 -7.563 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.248 4.922 -6.316 1.00 0.00 C ATOM 1480 C VAL A 102 -4.410 5.431 -5.164 1.00 0.00 C ATOM 1481 O VAL A 102 -3.271 5.041 -4.971 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.384 3.398 -6.423 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.593 2.747 -5.049 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.598 3.119 -7.289 1.00 0.00 C ATOM 0 H VAL A 102 -3.618 5.228 -7.629 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.252 5.308 -6.139 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.470 2.982 -6.848 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.685 1.667 -5.168 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.741 2.970 -4.407 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.502 3.140 -4.594 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.732 2.042 -7.392 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.484 3.552 -6.824 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.452 3.562 -8.274 1.00 0.00 H new ATOM 1494 N THR A 103 -4.988 6.356 -4.422 1.00 0.00 N ATOM 1495 CA THR A 103 -4.276 7.001 -3.283 1.00 0.00 C ATOM 1496 C THR A 103 -4.780 6.420 -1.985 1.00 0.00 C ATOM 1497 O THR A 103 -5.970 6.295 -1.784 1.00 0.00 O ATOM 1498 CB THR A 103 -4.532 8.510 -3.296 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.903 8.751 -3.511 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.719 9.167 -4.412 1.00 0.00 C ATOM 0 H THR A 103 -5.940 6.691 -4.568 1.00 0.00 H new ATOM 0 HA THR A 103 -3.206 6.817 -3.379 1.00 0.00 H new ATOM 0 HB THR A 103 -4.231 8.932 -2.337 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.043 9.040 -4.437 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.906 10.241 -4.415 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.658 8.984 -4.245 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.013 8.745 -5.373 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.878 6.061 -1.112 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.259 5.470 0.197 1.00 0.00 C ATOM 1510 C LYS A 104 -3.943 6.459 1.313 1.00 0.00 C ATOM 1511 O LYS A 104 -2.840 6.976 1.406 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.441 4.188 0.401 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.700 3.567 1.787 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.811 2.557 1.677 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.277 1.272 1.034 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.115 0.760 1.820 1.00 0.00 N ATOM 0 H LYS A 104 -2.873 6.156 -1.257 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.325 5.244 0.214 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.695 3.466 -0.375 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.380 4.412 0.294 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.794 3.090 2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -3.968 4.344 2.503 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.217 2.340 2.665 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.627 2.963 1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.064 0.518 0.997 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -3.975 1.467 0.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.062 -0.275 1.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -2.237 1.185 1.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -3.235 1.013 2.822 1.00 0.00 H new ATOM 1530 N THR A 105 -4.896 6.679 2.181 1.00 0.00 N ATOM 1531 CA THR A 105 -4.677 7.586 3.344 1.00 0.00 C ATOM 1532 C THR A 105 -4.211 6.691 4.508 1.00 0.00 C ATOM 1533 O THR A 105 -3.494 5.718 4.279 1.00 0.00 O ATOM 1534 CB THR A 105 -5.996 8.296 3.689 1.00 0.00 C ATOM 1535 OG1 THR A 105 -6.956 7.329 4.069 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.495 9.088 2.471 1.00 0.00 C ATOM 0 H THR A 105 -5.826 6.264 2.132 1.00 0.00 H new ATOM 0 HA THR A 105 -3.934 8.355 3.132 1.00 0.00 H new ATOM 0 HB THR A 105 -5.836 8.990 4.514 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.414 7.625 4.883 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.430 9.589 2.721 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.749 9.831 2.190 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.661 8.406 1.637 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.616 6.976 5.739 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.213 6.112 6.883 1.00 0.00 C ATOM 1546 C ASP A 106 -5.350 5.125 7.184 1.00 0.00 C ATOM 1547 O ASP A 106 -5.129 4.097 7.809 1.00 0.00 O ATOM 1548 CB ASP A 106 -3.942 6.970 8.113 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.275 6.115 9.192 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -2.140 5.715 8.985 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -3.908 5.873 10.206 1.00 0.00 O ATOM 0 H ASP A 106 -5.206 7.771 5.985 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.305 5.567 6.627 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.299 7.810 7.850 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.875 7.389 8.490 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.587 5.440 6.751 1.00 0.00 N ATOM 1557 CA LYS A 107 -7.751 4.519 7.032 1.00 0.00 C ATOM 1558 C LYS A 107 -8.820 4.614 5.903 1.00 0.00 C ATOM 1559 O LYS A 107 -9.994 4.350 6.137 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.399 4.901 8.388 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.317 5.194 9.436 1.00 0.00 C ATOM 1562 CD LYS A 107 -7.977 5.643 10.738 1.00 0.00 C ATOM 1563 CE LYS A 107 -6.903 5.965 11.777 1.00 0.00 C ATOM 1564 NZ LYS A 107 -7.421 5.647 13.137 1.00 0.00 N ATOM 0 H LYS A 107 -6.820 6.283 6.226 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.379 3.495 7.073 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.036 5.776 8.260 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.039 4.089 8.734 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.714 4.303 9.610 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.643 5.969 9.071 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.597 6.521 10.558 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.635 4.859 11.112 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -6.001 5.388 11.575 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -6.628 7.018 11.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -6.692 5.865 13.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -8.270 6.217 13.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -7.663 4.637 13.189 1.00 0.00 H new ATOM 1578 N THR A 108 -8.418 4.966 4.677 1.00 0.00 N ATOM 1579 CA THR A 108 -9.403 5.060 3.535 1.00 0.00 C ATOM 1580 C THR A 108 -8.682 4.637 2.230 1.00 0.00 C ATOM 1581 O THR A 108 -7.473 4.777 2.103 1.00 0.00 O ATOM 1582 CB THR A 108 -9.960 6.499 3.430 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.019 7.348 2.799 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.271 7.022 4.843 1.00 0.00 C ATOM 0 H THR A 108 -7.454 5.189 4.429 1.00 0.00 H new ATOM 0 HA THR A 108 -10.249 4.395 3.707 1.00 0.00 H new ATOM 0 HB THR A 108 -10.871 6.489 2.831 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.182 7.345 3.309 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.664 8.036 4.777 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.011 6.376 5.315 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.358 7.025 5.439 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.423 4.085 1.294 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.824 3.586 -0.010 1.00 0.00 C ATOM 1594 C LEU A 109 -9.413 4.465 -1.144 1.00 0.00 C ATOM 1595 O LEU A 109 -10.432 4.118 -1.718 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.310 2.099 -0.165 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.324 1.130 -0.879 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.790 0.815 -2.284 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.884 1.633 -0.897 1.00 0.00 C ATOM 0 H LEU A 109 -10.432 3.953 1.371 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.736 3.637 -0.039 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.523 1.702 0.827 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.250 2.101 -0.717 1.00 0.00 H new ATOM 0 HG LEU A 109 -8.327 0.215 -0.287 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.082 0.136 -2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.773 0.345 -2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.852 1.737 -2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.252 0.908 -1.410 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.839 2.588 -1.420 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.531 1.762 0.126 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.795 5.619 -1.471 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.371 6.489 -2.516 1.00 0.00 C ATOM 1613 C VAL A 110 -8.883 6.006 -3.865 1.00 0.00 C ATOM 1614 O VAL A 110 -7.733 5.634 -4.023 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.941 7.980 -2.245 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -9.012 8.817 -3.533 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.891 8.621 -1.200 1.00 0.00 C ATOM 0 H VAL A 110 -7.932 5.960 -1.047 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.460 6.447 -2.503 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.916 7.968 -1.875 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.710 9.842 -3.318 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.343 8.391 -4.281 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.033 8.812 -3.914 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.588 9.652 -1.017 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.913 8.605 -1.579 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.841 8.057 -0.268 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.750 6.054 -4.833 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.389 5.660 -6.203 1.00 0.00 C ATOM 1629 C LEU A 111 -9.871 6.768 -7.122 1.00 0.00 C ATOM 1630 O LEU A 111 -10.818 7.486 -6.818 1.00 0.00 O ATOM 1631 CB LEU A 111 -10.052 4.325 -6.626 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.091 3.323 -5.460 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -10.859 2.053 -5.888 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.685 2.941 -5.035 1.00 0.00 C ATOM 0 H LEU A 111 -10.717 6.359 -4.720 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.311 5.512 -6.261 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.066 4.516 -6.977 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.501 3.892 -7.461 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.598 3.794 -4.618 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.884 1.346 -5.059 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -11.878 2.321 -6.167 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.358 1.595 -6.740 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.735 2.231 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.163 2.484 -5.875 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.147 3.833 -4.715 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.226 6.910 -8.215 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.580 7.948 -9.203 1.00 0.00 C ATOM 1648 C LEU A 112 -9.503 7.285 -10.539 1.00 0.00 C ATOM 1649 O LEU A 112 -8.432 7.037 -11.047 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.543 9.064 -9.113 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.747 10.249 -10.140 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -10.094 10.211 -10.896 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.611 11.575 -9.383 1.00 0.00 C ATOM 0 H LEU A 112 -8.432 6.329 -8.484 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.570 8.372 -9.033 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.557 9.472 -8.102 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.554 8.634 -9.269 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.980 10.142 -10.907 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.152 11.058 -11.579 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.167 9.283 -11.462 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.914 10.265 -10.180 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.749 12.405 -10.076 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.368 11.626 -8.600 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.620 11.638 -8.934 1.00 0.00 H new ATOM 1665 N MET A 113 -10.611 6.959 -11.100 1.00 0.00 N ATOM 1666 CA MET A 113 -10.579 6.230 -12.420 1.00 0.00 C ATOM 1667 C MET A 113 -10.578 7.199 -13.543 1.00 0.00 C ATOM 1668 O MET A 113 -11.099 8.285 -13.439 1.00 0.00 O ATOM 1669 CB MET A 113 -11.758 5.264 -12.495 1.00 0.00 C ATOM 1670 CG MET A 113 -12.016 4.694 -13.926 1.00 0.00 C ATOM 1671 SD MET A 113 -10.910 3.293 -14.248 1.00 0.00 S ATOM 1672 CE MET A 113 -12.177 2.101 -14.775 1.00 0.00 C ATOM 0 H MET A 113 -11.540 7.153 -10.726 1.00 0.00 H new ATOM 0 HA MET A 113 -9.661 5.647 -12.500 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.580 4.435 -11.810 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.657 5.775 -12.150 1.00 0.00 H new ATOM 0 HG2 MET A 113 -13.055 4.376 -14.017 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.855 5.473 -14.671 1.00 0.00 H new ATOM 0 HE1 MET A 113 -11.727 1.361 -15.436 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.593 1.601 -13.900 1.00 0.00 H new ATOM 0 HE3 MET A 113 -12.972 2.626 -15.305 1.00 0.00 H new ATOM 1682 N GLY A 114 -9.971 6.785 -14.625 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.878 7.622 -15.819 1.00 0.00 C ATOM 1684 C GLY A 114 -9.999 6.783 -17.081 1.00 0.00 C ATOM 1685 O GLY A 114 -9.619 5.621 -17.126 1.00 0.00 O ATOM 0 H GLY A 114 -9.528 5.871 -14.715 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.665 8.376 -15.802 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.927 8.155 -15.821 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.099 10.987 -15.383 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.321 11.930 -14.492 1.00 0.00 C ATOM 1775 C GLY A 121 -1.261 13.000 -13.914 1.00 0.00 C ATOM 1776 O GLY A 121 -1.055 13.483 -12.805 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.151 11.373 -13.683 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.478 12.405 -15.061 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.310 13.350 -14.649 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.297 14.366 -14.148 1.00 0.00 C ATOM 1782 C LEU A 122 -4.176 13.663 -13.164 1.00 0.00 C ATOM 1783 O LEU A 122 -4.518 14.208 -12.157 1.00 0.00 O ATOM 1784 CB LEU A 122 -4.188 14.952 -15.292 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.454 15.067 -16.673 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -1.961 15.417 -16.510 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -3.607 13.742 -17.452 1.00 0.00 C ATOM 0 H LEU A 122 -2.518 12.971 -15.573 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.754 15.202 -13.707 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.070 14.322 -15.411 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.540 15.940 -14.995 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.918 15.881 -17.230 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.494 15.486 -17.493 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.866 16.373 -15.995 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -1.467 14.640 -15.927 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.097 13.823 -18.412 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.168 12.928 -16.875 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.665 13.539 -17.620 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.519 12.426 -13.459 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.360 11.607 -12.542 1.00 0.00 C ATOM 1801 C ILE A 123 -4.533 11.331 -11.307 1.00 0.00 C ATOM 1802 O ILE A 123 -5.044 11.319 -10.212 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.698 10.324 -13.269 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.725 10.648 -14.365 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.269 9.220 -12.314 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.929 9.430 -15.209 1.00 0.00 C ATOM 0 H ILE A 123 -4.242 11.947 -14.316 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.284 12.107 -12.252 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.780 9.922 -13.696 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.669 10.960 -13.918 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.374 11.478 -14.978 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.494 8.322 -12.889 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.531 8.985 -11.548 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.180 9.585 -11.840 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.656 9.647 -15.991 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.982 9.140 -15.664 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.297 8.614 -14.587 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.235 11.134 -11.492 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.331 10.900 -10.334 1.00 0.00 C ATOM 1820 C ASN A 124 -2.353 12.168 -9.465 1.00 0.00 C ATOM 1821 O ASN A 124 -2.157 12.123 -8.255 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.901 10.642 -10.836 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.003 10.223 -9.662 1.00 0.00 C ATOM 1824 OD1 ASN A 124 -0.135 10.724 -8.563 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.918 9.322 -9.854 1.00 0.00 N ATOM 0 H ASN A 124 -2.776 11.128 -12.403 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.659 10.034 -9.760 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.908 9.861 -11.596 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.503 11.541 -11.307 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.524 9.040 -9.084 1.00 0.00 H new ATOM 0 HD22 ASN A 124 1.033 8.898 -10.775 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.597 13.311 -10.102 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.635 14.632 -9.359 1.00 0.00 C ATOM 1834 C LYS A 125 -4.040 14.896 -8.753 1.00 0.00 C ATOM 1835 O LYS A 125 -4.157 15.526 -7.710 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.283 15.747 -10.352 1.00 0.00 C ATOM 1837 CG LYS A 125 -0.751 15.795 -10.559 1.00 0.00 C ATOM 1838 CD LYS A 125 -0.191 17.157 -10.100 1.00 0.00 C ATOM 1839 CE LYS A 125 0.484 17.873 -11.280 1.00 0.00 C ATOM 1840 NZ LYS A 125 1.766 17.188 -11.616 1.00 0.00 N ATOM 0 H LYS A 125 -2.771 13.382 -11.105 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.920 14.604 -8.537 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.783 15.571 -11.304 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.640 16.707 -9.978 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.276 14.991 -9.997 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.514 15.632 -11.610 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.996 17.775 -9.702 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.528 17.011 -9.294 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -0.178 17.872 -12.146 1.00 0.00 H new ATOM 0 HE3 LYS A 125 0.673 18.916 -11.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 2.221 17.675 -12.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.399 17.211 -10.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 1.574 16.200 -11.877 1.00 0.00 H new ATOM 1854 N LYS A 126 -5.097 14.409 -9.396 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.502 14.616 -8.867 1.00 0.00 C ATOM 1856 C LYS A 126 -6.831 13.554 -7.817 1.00 0.00 C ATOM 1857 O LYS A 126 -7.728 13.734 -7.011 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.507 14.525 -10.016 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.729 15.917 -10.613 1.00 0.00 C ATOM 1860 CD LYS A 126 -6.834 16.113 -11.845 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.284 15.183 -12.984 1.00 0.00 C ATOM 1862 NZ LYS A 126 -7.549 15.994 -14.209 1.00 0.00 N ATOM 0 H LYS A 126 -5.044 13.877 -10.265 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.563 15.603 -8.408 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.138 13.844 -10.783 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.452 14.118 -9.655 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.776 16.039 -10.892 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -7.507 16.680 -9.867 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -6.879 17.151 -12.174 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.796 15.906 -11.586 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.514 14.439 -13.187 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.183 14.640 -12.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -7.788 15.361 -14.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -8.343 16.642 -14.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.701 16.545 -14.451 1.00 0.00 H new ATOM 1876 N CYS A 127 -6.080 12.464 -7.804 1.00 0.00 N ATOM 1877 CA CYS A 127 -6.288 11.381 -6.789 1.00 0.00 C ATOM 1878 C CYS A 127 -5.467 11.757 -5.584 1.00 0.00 C ATOM 1879 O CYS A 127 -5.856 11.527 -4.468 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.795 10.049 -7.326 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.612 8.693 -6.445 1.00 0.00 S ATOM 0 H CYS A 127 -5.324 12.284 -8.465 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.346 11.281 -6.547 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -6.002 9.978 -8.394 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.714 9.975 -7.205 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.747 7.676 -7.243 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.323 12.373 -5.830 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.450 12.839 -4.741 1.00 0.00 C ATOM 1889 C TYR A 128 -4.189 13.985 -4.026 1.00 0.00 C ATOM 1890 O TYR A 128 -4.048 14.175 -2.827 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.145 13.328 -5.377 1.00 0.00 C ATOM 1892 CG TYR A 128 -1.170 13.826 -4.345 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -1.018 13.172 -3.111 1.00 0.00 C ATOM 1894 CD2 TYR A 128 -0.396 14.944 -4.647 1.00 0.00 C ATOM 1895 CE1 TYR A 128 -0.083 13.643 -2.182 1.00 0.00 C ATOM 1896 CE2 TYR A 128 0.539 15.422 -3.716 1.00 0.00 C ATOM 1897 CZ TYR A 128 0.695 14.769 -2.483 1.00 0.00 C ATOM 1898 OH TYR A 128 1.619 15.233 -1.570 1.00 0.00 O ATOM 0 H TYR A 128 -3.969 12.566 -6.767 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.218 12.057 -4.018 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.690 12.515 -5.943 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.364 14.127 -6.085 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.622 12.307 -2.879 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.515 15.443 -5.597 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.039 13.139 -1.234 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.137 16.291 -3.948 1.00 0.00 H new ATOM 0 HH TYR A 128 2.074 16.020 -1.936 1.00 0.00 H new ATOM 1908 N GLU A 129 -5.023 14.729 -4.776 1.00 0.00 N ATOM 1909 CA GLU A 129 -5.828 15.847 -4.169 1.00 0.00 C ATOM 1910 C GLU A 129 -7.123 15.251 -3.560 1.00 0.00 C ATOM 1911 O GLU A 129 -7.666 15.757 -2.572 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.185 16.873 -5.253 1.00 0.00 C ATOM 1913 CG GLU A 129 -4.989 17.805 -5.491 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.484 19.234 -5.732 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -5.840 19.536 -6.860 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.498 20.003 -4.785 1.00 0.00 O ATOM 0 H GLU A 129 -5.167 14.596 -5.777 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.249 16.345 -3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -6.451 16.362 -6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.056 17.453 -4.947 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.322 17.782 -4.630 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.413 17.460 -6.350 1.00 0.00 H new ATOM 1923 N MET A 130 -7.595 14.146 -4.126 1.00 0.00 N ATOM 1924 CA MET A 130 -8.820 13.457 -3.598 1.00 0.00 C ATOM 1925 C MET A 130 -8.462 12.997 -2.143 1.00 0.00 C ATOM 1926 O MET A 130 -9.209 13.209 -1.168 1.00 0.00 O ATOM 1927 CB MET A 130 -9.110 12.236 -4.534 1.00 0.00 C ATOM 1928 CG MET A 130 -10.624 11.930 -4.624 1.00 0.00 C ATOM 1929 SD MET A 130 -10.871 10.383 -5.526 1.00 0.00 S ATOM 1930 CE MET A 130 -12.556 10.064 -4.961 1.00 0.00 C ATOM 0 H MET A 130 -7.173 13.695 -4.938 1.00 0.00 H new ATOM 0 HA MET A 130 -9.706 14.091 -3.576 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.720 12.441 -5.531 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.583 11.358 -4.161 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.051 11.853 -3.624 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.142 12.745 -5.129 1.00 0.00 H new ATOM 0 HE1 MET A 130 -12.661 9.009 -4.707 1.00 0.00 H new ATOM 0 HE2 MET A 130 -12.766 10.672 -4.081 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.260 10.318 -5.754 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.275 12.431 -2.003 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.760 11.991 -0.672 1.00 0.00 C ATOM 1942 C ALA A 131 -6.225 13.200 0.075 1.00 0.00 C ATOM 1943 O ALA A 131 -6.078 13.152 1.275 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.635 10.973 -0.864 1.00 0.00 C ATOM 0 H ALA A 131 -6.635 12.256 -2.778 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.567 11.530 -0.102 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.262 10.655 0.110 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.016 10.108 -1.407 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.824 11.430 -1.431 1.00 0.00 H new ATOM 1950 N SER A 132 -5.948 14.319 -0.630 1.00 0.00 N ATOM 1951 CA SER A 132 -5.455 15.553 0.069 1.00 0.00 C ATOM 1952 C SER A 132 -6.525 15.959 1.062 1.00 0.00 C ATOM 1953 O SER A 132 -6.216 16.458 2.132 1.00 0.00 O ATOM 1954 CB SER A 132 -5.201 16.691 -0.918 1.00 0.00 C ATOM 1955 OG SER A 132 -3.969 16.461 -1.593 1.00 0.00 O ATOM 0 H SER A 132 -6.048 14.406 -1.641 1.00 0.00 H new ATOM 0 HA SER A 132 -4.508 15.345 0.567 1.00 0.00 H new ATOM 0 HB2 SER A 132 -6.017 16.753 -1.638 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.168 17.645 -0.391 1.00 0.00 H new ATOM 0 HG SER A 132 -3.900 15.514 -1.835 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.819 15.701 0.730 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.896 16.030 1.713 1.00 0.00 C ATOM 1963 C HIS A 133 -8.944 14.927 2.721 1.00 0.00 C ATOM 1964 O HIS A 133 -9.097 15.187 3.898 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.278 16.192 1.107 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.102 16.897 2.148 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.142 18.206 2.556 1.00 0.00 N flip ATOM 1968 CD2 HIS A 133 -12.000 16.218 2.956 1.00 0.00 C flip ATOM 1969 CE1 HIS A 133 -12.050 18.341 3.604 1.00 0.00 C flip ATOM 1970 NE2 HIS A 133 -12.539 17.113 3.805 1.00 0.00 N flip ATOM 0 H HIS A 133 -8.133 15.293 -0.151 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.644 16.997 2.148 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.235 16.771 0.184 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.711 15.224 0.856 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -12.226 15.163 2.913 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.304 19.244 4.139 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.235 16.883 4.514 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.787 13.661 2.283 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.792 12.532 3.283 1.00 0.00 C ATOM 1980 C LEU A 134 -7.521 12.582 4.153 1.00 0.00 C ATOM 1981 O LEU A 134 -7.410 11.877 5.147 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.907 11.206 2.555 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.337 11.068 2.030 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.398 11.439 0.554 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.822 9.631 2.213 1.00 0.00 C ATOM 0 H LEU A 134 -8.661 13.386 1.309 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.652 12.638 3.944 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.194 11.162 1.731 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.668 10.382 3.227 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.980 11.744 2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.422 11.336 0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.070 12.470 0.424 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.746 10.777 -0.015 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.841 9.540 1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -10.170 8.954 1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.802 9.372 3.272 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.600 13.460 3.813 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.363 13.652 4.621 1.00 0.00 C ATOM 1999 C ARG A 135 -5.671 14.780 5.582 1.00 0.00 C ATOM 2000 O ARG A 135 -5.350 14.718 6.760 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.208 14.025 3.702 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.520 12.753 3.219 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.597 12.234 4.316 1.00 0.00 C ATOM 2004 NE ARG A 135 -1.630 13.303 4.687 1.00 0.00 N ATOM 2005 CZ ARG A 135 -1.568 13.729 5.919 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -1.384 12.882 6.892 1.00 0.00 N ATOM 2007 NH2 ARG A 135 -1.691 15.003 6.175 1.00 0.00 N ATOM 0 H ARG A 135 -6.663 14.060 2.991 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.074 12.748 5.157 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.575 14.599 2.852 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.497 14.659 4.231 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.263 11.997 2.965 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -2.949 12.956 2.313 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -3.180 11.936 5.187 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.064 11.348 3.971 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.015 13.703 3.978 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -1.288 11.887 6.691 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -1.335 13.214 7.855 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -1.835 15.665 5.412 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -1.643 15.337 7.138 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.384 15.788 5.086 1.00 0.00 N ATOM 2022 CA ARG A 136 -6.833 16.903 5.953 1.00 0.00 C ATOM 2023 C ARG A 136 -8.050 16.409 6.766 1.00 0.00 C ATOM 2024 O ARG A 136 -8.521 17.083 7.672 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.250 18.105 5.094 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.010 18.825 4.561 1.00 0.00 C ATOM 2027 CD ARG A 136 -6.450 20.014 3.698 1.00 0.00 C ATOM 2028 NE ARG A 136 -5.261 20.819 3.304 1.00 0.00 N ATOM 2029 CZ ARG A 136 -4.514 20.437 2.306 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -5.065 20.070 1.179 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -3.219 20.423 2.435 1.00 0.00 N ATOM 0 H ARG A 136 -6.665 15.867 4.109 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.024 17.212 6.614 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.871 17.770 4.263 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.853 18.793 5.686 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.391 19.170 5.389 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.401 18.139 3.973 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.970 19.657 2.809 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.154 20.636 4.251 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.030 21.671 3.816 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.080 20.082 1.080 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -4.480 19.771 0.399 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -2.791 20.710 3.315 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -2.632 20.125 1.656 1.00 0.00 H new ATOM 2045 N SER A 137 -8.545 15.205 6.443 1.00 0.00 N ATOM 2046 CA SER A 137 -9.694 14.614 7.159 1.00 0.00 C ATOM 2047 C SER A 137 -9.190 13.995 8.488 1.00 0.00 C ATOM 2048 O SER A 137 -9.982 13.649 9.353 1.00 0.00 O ATOM 2049 CB SER A 137 -10.338 13.530 6.249 1.00 0.00 C ATOM 2050 OG SER A 137 -9.559 12.338 6.274 1.00 0.00 O ATOM 0 H SER A 137 -8.172 14.621 5.695 1.00 0.00 H new ATOM 0 HA SER A 137 -10.443 15.371 7.390 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.352 13.317 6.587 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.414 13.902 5.227 1.00 0.00 H new ATOM 0 HG SER A 137 -8.607 12.570 6.299 1.00 0.00 H new ATOM 2056 N GLN A 138 -7.855 13.853 8.643 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.279 13.263 9.897 1.00 0.00 C ATOM 2058 C GLN A 138 -7.731 11.804 10.029 1.00 0.00 C ATOM 2059 O GLN A 138 -7.810 11.262 11.126 1.00 0.00 O ATOM 2060 CB GLN A 138 -7.743 14.078 11.123 1.00 0.00 C ATOM 2061 CG GLN A 138 -6.753 15.222 11.383 1.00 0.00 C ATOM 2062 CD GLN A 138 -6.558 15.408 12.891 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -5.656 14.841 13.473 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -7.372 16.187 13.548 1.00 0.00 N ATOM 0 H GLN A 138 -7.164 14.126 7.944 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.191 13.297 9.847 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -8.741 14.480 10.949 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -7.807 13.432 11.999 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -5.797 15.003 10.908 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -7.125 16.145 10.939 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -8.129 16.663 13.058 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -7.251 16.320 14.552 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.017 11.158 8.900 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.457 9.726 8.921 1.00 0.00 C ATOM 2075 C TYR A 139 -7.262 8.833 8.599 1.00 0.00 C ATOM 2076 O TYR A 139 -6.821 8.850 7.460 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.554 9.511 7.873 1.00 0.00 C ATOM 2078 CG TYR A 139 -10.908 9.677 8.526 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.512 10.938 8.575 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.555 8.570 9.087 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.762 11.094 9.185 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -12.806 8.725 9.698 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.408 9.988 9.748 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.639 10.142 10.354 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.801 8.151 9.498 1.00 0.00 O ATOM 0 H TYR A 139 -7.960 11.573 7.970 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.848 9.476 9.907 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.440 10.226 7.058 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.467 8.516 7.438 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.013 11.792 8.142 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.090 7.596 9.049 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -13.228 12.068 9.221 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.306 7.871 10.130 1.00 0.00 H new ATOM 0 HH TYR A 139 -14.948 9.275 10.692 1.00 0.00 H new