USER MOD reduce.3.24.130724 H: found=0, std=0, add=1316, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1316 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 THR OG1 : rot 65:sc= 2.04 USER MOD Set 1.2: B 68 SER OG : rot 136:sc= 0.566 USER MOD Set 2.1: A 48 SER OG : rot -63:sc= 2 USER MOD Set 2.2: B 30 THR OG1 : rot -135:sc= 0.978 USER MOD Set 3.1: B 21 ASN : amide:sc= 0.0797 X(o=0.16,f=0) USER MOD Set 3.2: B 25 LYS NZ :NH3+ -118:sc= 0.0798 (180deg=0) USER MOD Set 4.1: A 75 HIS : no HD1:sc= 1.09 K(o=2,f=-4.6!) USER MOD Set 4.2: A 81 HIS : no HE2:sc= 0.887 K(o=2,f=-5.5!) USER MOD Set 5.1: A 66 GLN : amide:sc= 1.13 K(o=2.1,f=-0.03) USER MOD Set 5.2: B 59 ASN : amide:sc= 0.97 K(o=2.1,f=-0.28) USER MOD Set 6.1: A 26 HIS : no HD1:sc= -1.57! C(o=-2.5!,f=-5.5!) USER MOD Set 6.2: B 14 GLN :FLIP amide:sc= -0.958 F(o=-3.9!,f=-2.5) USER MOD Single : A 1 MET CE :methyl -157:sc= -0.186 (180deg=-0.96) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -151:sc= 0.219 USER MOD Single : A 11 GLN : amide:sc= -0.224 K(o=-0.22,f=-0.94) USER MOD Single : A 14 GLN : amide:sc= -1.18 K(o=-1.2,f=-5.7!) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 25 LYS NZ :NH3+ 167:sc= 0.383 (180deg=0.277) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0202 USER MOD Single : A 33 SER OG : rot -160:sc= -0.271 USER MOD Single : A 35 MET CE :methyl 167:sc= -0.0323 (180deg=-0.314) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 40 MET CE :methyl -152:sc= 0 (180deg=-0.317) USER MOD Single : A 43 ASN : amide:sc= 1.13 K(o=1.1,f=-0.004) USER MOD Single : A 46 ASN :FLIP amide:sc= -0.389 F(o=-4.5!,f=-0.39) USER MOD Single : A 47 THR OG1 : rot -71:sc= 1.21 USER MOD Single : A 53 GLN : amide:sc=-0.00916 K(o=-0.0092,f=-2.8!) USER MOD Single : A 55 GLN : amide:sc= -0.6 X(o=-0.6,f=-0.21) USER MOD Single : A 59 ASN : amide:sc= 0.982 K(o=0.98,f=0) USER MOD Single : A 60 SER OG : rot 84:sc= 1.2 USER MOD Single : A 67 SER OG : rot 91:sc= 1.23 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.0155 X(o=-0.016,f=0.04) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.0096) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl -159:sc= -0.149 (180deg=-0.763) USER MOD Single : B 1 MET N :NH3+ -107:sc= 0.0126 (180deg=0) USER MOD Single : B 3 GLN : amide:sc= 0.793 K(o=0.79,f=-1.1) USER MOD Single : B 5 SER OG : rot 180:sc= -0.0663 USER MOD Single : B 7 TYR OH : rot 180:sc=-0.00764 USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 11 GLN :FLIP amide:sc=-0.00444 F(o=-1,f=-0.0044) USER MOD Single : B 26 HIS : no HD1:sc= -0.988 K(o=-0.99,f=-8.2!) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 SER OG : rot 180:sc= -0.0827 USER MOD Single : B 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 39 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : B 40 MET CE :methyl -156:sc= 0 (180deg=-0.0126) USER MOD Single : B 42 THR OG1 : rot 78:sc= 1.25 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 46 ASN : amide:sc= -5.26! C(o=-5.3!,f=-9.8!) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 GLN : amide:sc= -0.283 K(o=-0.28,f=-1.9) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN :FLIP amide:sc= -0.197 F(o=-3.4!,f=-0.2) USER MOD Single : B 67 SER OG : rot 10:sc= 0.83 USER MOD Single : B 70 ASN : amide:sc= -0.0483 X(o=-0.048,f=0) USER MOD Single : B 73 LYS NZ :NH3+ 170:sc= -0.0213 (180deg=-0.148) USER MOD Single : B 75 HIS :FLIP no HD1:sc= 0.285 F(o=-1,f=0.28) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=-0.0073) USER MOD Single : B 83 HIS : no HD1:sc=-0.00546 X(o=-0.0055,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.536 -8.694 26.240 1.00 0.00 N ATOM 2 CA MET A 1 -10.602 -8.708 24.762 1.00 0.00 C ATOM 3 C MET A 1 -9.653 -7.664 24.187 1.00 0.00 C ATOM 4 O MET A 1 -9.845 -6.463 24.386 1.00 0.00 O ATOM 5 CB MET A 1 -12.036 -8.439 24.300 1.00 0.00 C ATOM 6 CG MET A 1 -12.215 -8.493 22.791 1.00 0.00 C ATOM 7 SD MET A 1 -13.941 -8.322 22.293 1.00 0.00 S ATOM 8 CE MET A 1 -14.654 -9.782 23.050 1.00 0.00 C ATOM 0 H1 MET A 1 -11.186 -9.409 26.623 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.566 -8.909 26.546 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.809 -7.754 26.591 1.00 0.00 H new ATOM 0 HA MET A 1 -10.298 -9.691 24.401 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.700 -9.170 24.762 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.345 -7.457 24.658 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.627 -7.699 22.330 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.824 -9.439 22.416 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.573 -10.051 22.528 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.945 -10.608 22.986 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.878 -9.576 24.097 1.00 0.00 H new ATOM 20 N PRO A 2 -8.616 -8.112 23.468 1.00 0.00 N ATOM 21 CA PRO A 2 -7.567 -7.229 22.952 1.00 0.00 C ATOM 22 C PRO A 2 -8.050 -6.340 21.812 1.00 0.00 C ATOM 23 O PRO A 2 -8.647 -6.814 20.844 1.00 0.00 O ATOM 24 CB PRO A 2 -6.497 -8.203 22.454 1.00 0.00 C ATOM 25 CG PRO A 2 -7.246 -9.447 22.117 1.00 0.00 C ATOM 26 CD PRO A 2 -8.386 -9.520 23.093 1.00 0.00 C ATOM 0 HA PRO A 2 -7.214 -6.535 23.715 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -5.975 -7.807 21.583 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.744 -8.389 23.220 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -7.612 -9.416 21.091 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -6.604 -10.324 22.200 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -9.273 -9.964 22.640 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -8.132 -10.129 23.961 1.00 0.00 H new ATOM 34 N GLN A 3 -7.808 -5.046 21.951 1.00 0.00 N ATOM 35 CA GLN A 3 -8.107 -4.084 20.904 1.00 0.00 C ATOM 36 C GLN A 3 -6.945 -3.115 20.755 1.00 0.00 C ATOM 37 O GLN A 3 -6.364 -2.679 21.751 1.00 0.00 O ATOM 38 CB GLN A 3 -9.396 -3.314 21.209 1.00 0.00 C ATOM 39 CG GLN A 3 -10.657 -4.158 21.093 1.00 0.00 C ATOM 40 CD GLN A 3 -11.926 -3.346 21.277 1.00 0.00 C ATOM 41 OE1 GLN A 3 -11.964 -2.152 20.974 1.00 0.00 O ATOM 42 NE2 GLN A 3 -12.974 -3.989 21.767 1.00 0.00 N ATOM 0 H GLN A 3 -7.400 -4.635 22.791 1.00 0.00 H new ATOM 0 HA GLN A 3 -8.253 -4.627 19.970 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -9.334 -2.906 22.218 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -9.473 -2.467 20.527 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -10.678 -4.640 20.116 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -10.627 -4.952 21.839 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -12.900 -4.978 22.005 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -13.856 -3.495 21.907 1.00 0.00 H new ATOM 51 N ILE A 4 -6.598 -2.795 19.517 1.00 0.00 N ATOM 52 CA ILE A 4 -5.501 -1.880 19.245 1.00 0.00 C ATOM 53 C ILE A 4 -5.853 -0.481 19.735 1.00 0.00 C ATOM 54 O ILE A 4 -5.263 0.019 20.694 1.00 0.00 O ATOM 55 CB ILE A 4 -5.168 -1.825 17.736 1.00 0.00 C ATOM 56 CG1 ILE A 4 -4.856 -3.230 17.210 1.00 0.00 C ATOM 57 CG2 ILE A 4 -3.993 -0.885 17.481 1.00 0.00 C ATOM 58 CD1 ILE A 4 -4.669 -3.291 15.709 1.00 0.00 C ATOM 0 H ILE A 4 -7.062 -3.157 18.684 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.624 -2.250 19.777 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.037 -1.439 17.203 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.952 -3.597 17.695 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -5.665 -3.903 17.494 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -3.773 -0.859 16.414 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.248 0.118 17.823 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.117 -1.242 18.023 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.451 -4.317 15.411 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.581 -2.955 15.215 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.840 -2.645 15.419 1.00 0.00 H new ATOM 70 N SER A 5 -6.832 0.131 19.079 1.00 0.00 N ATOM 71 CA SER A 5 -7.286 1.465 19.433 1.00 0.00 C ATOM 72 C SER A 5 -8.418 1.878 18.505 1.00 0.00 C ATOM 73 O SER A 5 -8.471 1.449 17.352 1.00 0.00 O ATOM 74 CB SER A 5 -6.132 2.473 19.324 1.00 0.00 C ATOM 75 OG SER A 5 -6.480 3.730 19.890 1.00 0.00 O ATOM 0 H SER A 5 -7.330 -0.283 18.291 1.00 0.00 H new ATOM 0 HA SER A 5 -7.642 1.454 20.463 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.252 2.076 19.831 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.863 2.607 18.276 1.00 0.00 H new ATOM 0 HG SER A 5 -5.724 4.347 19.806 1.00 0.00 H new ATOM 81 N ARG A 6 -9.318 2.707 19.004 1.00 0.00 N ATOM 82 CA ARG A 6 -10.370 3.260 18.181 1.00 0.00 C ATOM 83 C ARG A 6 -9.927 4.626 17.711 1.00 0.00 C ATOM 84 O ARG A 6 -10.353 5.651 18.242 1.00 0.00 O ATOM 85 CB ARG A 6 -11.698 3.371 18.932 1.00 0.00 C ATOM 86 CG ARG A 6 -12.172 2.069 19.551 1.00 0.00 C ATOM 87 CD ARG A 6 -13.622 2.162 20.003 1.00 0.00 C ATOM 88 NE ARG A 6 -13.904 3.413 20.709 1.00 0.00 N ATOM 89 CZ ARG A 6 -14.115 3.503 22.023 1.00 0.00 C ATOM 90 NH1 ARG A 6 -14.036 2.422 22.790 1.00 0.00 N ATOM 91 NH2 ARG A 6 -14.406 4.678 22.572 1.00 0.00 N ATOM 0 H ARG A 6 -9.338 3.010 19.978 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.542 2.591 17.338 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.597 4.119 19.719 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -12.462 3.733 18.245 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -12.067 1.261 18.827 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -11.540 1.818 20.403 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -14.277 2.081 19.135 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.852 1.319 20.655 1.00 0.00 H new ATOM 0 HE ARG A 6 -13.942 4.272 20.160 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -13.813 1.517 22.375 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -14.198 2.496 23.794 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -14.468 5.512 21.988 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -14.567 4.745 23.577 1.00 0.00 H new ATOM 105 N TYR A 7 -8.995 4.615 16.776 1.00 0.00 N ATOM 106 CA TYR A 7 -8.470 5.838 16.185 1.00 0.00 C ATOM 107 C TYR A 7 -9.613 6.731 15.713 1.00 0.00 C ATOM 108 O TYR A 7 -10.644 6.236 15.253 1.00 0.00 O ATOM 109 CB TYR A 7 -7.550 5.503 15.010 1.00 0.00 C ATOM 110 CG TYR A 7 -6.250 6.279 15.009 1.00 0.00 C ATOM 111 CD1 TYR A 7 -6.232 7.658 15.190 1.00 0.00 C ATOM 112 CD2 TYR A 7 -5.038 5.628 14.818 1.00 0.00 C ATOM 113 CE1 TYR A 7 -5.044 8.363 15.180 1.00 0.00 C ATOM 114 CE2 TYR A 7 -3.846 6.326 14.810 1.00 0.00 C ATOM 115 CZ TYR A 7 -3.854 7.693 14.991 1.00 0.00 C ATOM 116 OH TYR A 7 -2.671 8.392 14.972 1.00 0.00 O ATOM 0 H TYR A 7 -8.579 3.761 16.404 1.00 0.00 H new ATOM 0 HA TYR A 7 -7.897 6.372 16.943 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -7.325 4.437 15.030 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -8.080 5.700 14.078 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -7.162 8.186 15.341 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -5.027 4.558 14.673 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -5.047 9.434 15.320 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.912 5.804 14.663 1.00 0.00 H new ATOM 0 HH TYR A 7 -1.926 7.771 14.830 1.00 0.00 H new ATOM 126 N SER A 8 -9.428 8.036 15.863 1.00 0.00 N ATOM 127 CA SER A 8 -10.429 9.019 15.471 1.00 0.00 C ATOM 128 C SER A 8 -10.927 8.769 14.050 1.00 0.00 C ATOM 129 O SER A 8 -10.167 8.889 13.083 1.00 0.00 O ATOM 130 CB SER A 8 -9.847 10.434 15.585 1.00 0.00 C ATOM 131 OG SER A 8 -10.745 11.411 15.082 1.00 0.00 O ATOM 0 H SER A 8 -8.581 8.442 16.259 1.00 0.00 H new ATOM 0 HA SER A 8 -11.279 8.923 16.146 1.00 0.00 H new ATOM 0 HB2 SER A 8 -9.619 10.651 16.629 1.00 0.00 H new ATOM 0 HB3 SER A 8 -8.907 10.486 15.036 1.00 0.00 H new ATOM 0 HG SER A 8 -10.238 12.176 14.739 1.00 0.00 H new ATOM 137 N ASP A 9 -12.204 8.408 13.939 1.00 0.00 N ATOM 138 CA ASP A 9 -12.844 8.220 12.643 1.00 0.00 C ATOM 139 C ASP A 9 -12.747 9.509 11.850 1.00 0.00 C ATOM 140 O ASP A 9 -12.486 9.499 10.652 1.00 0.00 O ATOM 141 CB ASP A 9 -14.321 7.834 12.803 1.00 0.00 C ATOM 142 CG ASP A 9 -14.522 6.529 13.549 1.00 0.00 C ATOM 143 OD1 ASP A 9 -14.540 5.463 12.901 1.00 0.00 O ATOM 144 OD2 ASP A 9 -14.684 6.567 14.789 1.00 0.00 O ATOM 0 H ASP A 9 -12.817 8.240 14.737 1.00 0.00 H new ATOM 0 HA ASP A 9 -12.334 7.411 12.120 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.843 8.631 13.333 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.778 7.755 11.816 1.00 0.00 H new ATOM 149 N GLU A 10 -12.931 10.619 12.558 1.00 0.00 N ATOM 150 CA GLU A 10 -12.857 11.951 11.972 1.00 0.00 C ATOM 151 C GLU A 10 -11.495 12.182 11.322 1.00 0.00 C ATOM 152 O GLU A 10 -11.405 12.659 10.193 1.00 0.00 O ATOM 153 CB GLU A 10 -13.090 12.997 13.061 1.00 0.00 C ATOM 154 CG GLU A 10 -14.425 12.852 13.773 1.00 0.00 C ATOM 155 CD GLU A 10 -14.434 13.534 15.124 1.00 0.00 C ATOM 156 OE1 GLU A 10 -14.506 14.779 15.169 1.00 0.00 O ATOM 157 OE2 GLU A 10 -14.347 12.825 16.150 1.00 0.00 O ATOM 0 H GLU A 10 -13.136 10.619 13.557 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.625 12.038 11.204 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.287 12.929 13.795 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.032 13.990 12.616 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -15.214 13.274 13.150 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.652 11.794 13.901 1.00 0.00 H new ATOM 164 N GLN A 11 -10.442 11.826 12.048 1.00 0.00 N ATOM 165 CA GLN A 11 -9.073 12.024 11.584 1.00 0.00 C ATOM 166 C GLN A 11 -8.784 11.177 10.345 1.00 0.00 C ATOM 167 O GLN A 11 -8.239 11.672 9.359 1.00 0.00 O ATOM 168 CB GLN A 11 -8.091 11.680 12.707 1.00 0.00 C ATOM 169 CG GLN A 11 -6.636 11.976 12.379 1.00 0.00 C ATOM 170 CD GLN A 11 -5.721 11.728 13.564 1.00 0.00 C ATOM 171 OE1 GLN A 11 -6.132 11.867 14.718 1.00 0.00 O ATOM 172 NE2 GLN A 11 -4.478 11.374 13.295 1.00 0.00 N ATOM 0 H GLN A 11 -10.511 11.394 12.970 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.950 13.071 11.308 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.370 12.237 13.601 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -8.189 10.621 12.948 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.320 11.354 11.541 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.541 13.014 12.059 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.176 11.269 12.326 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -3.820 11.205 14.056 1.00 0.00 H new ATOM 181 N VAL A 12 -9.163 9.906 10.397 1.00 0.00 N ATOM 182 CA VAL A 12 -8.935 8.996 9.278 1.00 0.00 C ATOM 183 C VAL A 12 -9.790 9.395 8.077 1.00 0.00 C ATOM 184 O VAL A 12 -9.323 9.377 6.937 1.00 0.00 O ATOM 185 CB VAL A 12 -9.238 7.532 9.667 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.979 6.594 8.495 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.413 7.117 10.877 1.00 0.00 C ATOM 0 H VAL A 12 -9.629 9.481 11.199 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.881 9.069 9.010 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.294 7.463 9.930 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -9.199 5.569 8.794 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.618 6.873 7.657 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.934 6.667 8.194 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.641 6.083 11.135 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.352 7.207 10.643 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.654 7.763 11.721 1.00 0.00 H new ATOM 197 N GLU A 13 -11.033 9.774 8.348 1.00 0.00 N ATOM 198 CA GLU A 13 -11.962 10.196 7.307 1.00 0.00 C ATOM 199 C GLU A 13 -11.446 11.448 6.601 1.00 0.00 C ATOM 200 O GLU A 13 -11.551 11.571 5.379 1.00 0.00 O ATOM 201 CB GLU A 13 -13.341 10.452 7.923 1.00 0.00 C ATOM 202 CG GLU A 13 -14.413 10.855 6.927 1.00 0.00 C ATOM 203 CD GLU A 13 -15.779 10.945 7.571 1.00 0.00 C ATOM 204 OE1 GLU A 13 -16.055 11.954 8.254 1.00 0.00 O ATOM 205 OE2 GLU A 13 -16.581 10.001 7.410 1.00 0.00 O ATOM 0 H GLU A 13 -11.424 9.798 9.290 1.00 0.00 H new ATOM 0 HA GLU A 13 -12.047 9.403 6.564 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.666 9.550 8.441 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.249 11.236 8.675 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -14.155 11.818 6.487 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -14.443 10.130 6.113 1.00 0.00 H new ATOM 212 N GLN A 14 -10.877 12.365 7.378 1.00 0.00 N ATOM 213 CA GLN A 14 -10.303 13.587 6.829 1.00 0.00 C ATOM 214 C GLN A 14 -9.130 13.253 5.912 1.00 0.00 C ATOM 215 O GLN A 14 -9.079 13.707 4.769 1.00 0.00 O ATOM 216 CB GLN A 14 -9.845 14.514 7.960 1.00 0.00 C ATOM 217 CG GLN A 14 -9.376 15.885 7.490 1.00 0.00 C ATOM 218 CD GLN A 14 -10.503 16.749 6.944 1.00 0.00 C ATOM 219 OE1 GLN A 14 -11.489 16.251 6.399 1.00 0.00 O ATOM 220 NE2 GLN A 14 -10.370 18.057 7.097 1.00 0.00 N ATOM 0 H GLN A 14 -10.802 12.284 8.392 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.068 14.100 6.246 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.667 14.645 8.663 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -9.033 14.031 8.505 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -8.899 16.404 8.322 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -8.618 15.757 6.717 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -9.540 18.435 7.553 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -11.098 18.687 6.759 1.00 0.00 H new ATOM 229 N LEU A 15 -8.207 12.437 6.415 1.00 0.00 N ATOM 230 CA LEU A 15 -7.033 12.031 5.646 1.00 0.00 C ATOM 231 C LEU A 15 -7.438 11.337 4.349 1.00 0.00 C ATOM 232 O LEU A 15 -6.863 11.602 3.292 1.00 0.00 O ATOM 233 CB LEU A 15 -6.140 11.104 6.477 1.00 0.00 C ATOM 234 CG LEU A 15 -5.459 11.759 7.681 1.00 0.00 C ATOM 235 CD1 LEU A 15 -4.702 10.719 8.494 1.00 0.00 C ATOM 236 CD2 LEU A 15 -4.518 12.867 7.227 1.00 0.00 C ATOM 0 H LEU A 15 -8.250 12.043 7.355 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.473 12.932 5.394 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.743 10.268 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -5.370 10.689 5.826 1.00 0.00 H new ATOM 0 HG LEU A 15 -6.229 12.200 8.314 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.224 11.201 9.346 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -5.397 9.959 8.850 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.942 10.251 7.868 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -4.043 13.321 8.097 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.753 12.449 6.573 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -5.083 13.625 6.686 1.00 0.00 H new ATOM 248 N LEU A 16 -8.431 10.455 4.429 1.00 0.00 N ATOM 249 CA LEU A 16 -8.935 9.773 3.242 1.00 0.00 C ATOM 250 C LEU A 16 -9.469 10.780 2.236 1.00 0.00 C ATOM 251 O LEU A 16 -9.155 10.705 1.050 1.00 0.00 O ATOM 252 CB LEU A 16 -10.034 8.769 3.601 1.00 0.00 C ATOM 253 CG LEU A 16 -9.556 7.491 4.293 1.00 0.00 C ATOM 254 CD1 LEU A 16 -10.731 6.565 4.564 1.00 0.00 C ATOM 255 CD2 LEU A 16 -8.509 6.785 3.445 1.00 0.00 C ATOM 0 H LEU A 16 -8.900 10.197 5.298 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.103 9.227 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -10.757 9.264 4.249 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.562 8.492 2.688 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.101 7.763 5.245 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.375 5.660 5.057 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -11.451 7.070 5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -11.211 6.300 3.622 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.181 5.878 3.953 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.939 6.524 2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.656 7.446 3.295 1.00 0.00 H new ATOM 267 N ALA A 17 -10.264 11.729 2.722 1.00 0.00 N ATOM 268 CA ALA A 17 -10.849 12.748 1.862 1.00 0.00 C ATOM 269 C ALA A 17 -9.767 13.555 1.154 1.00 0.00 C ATOM 270 O ALA A 17 -9.853 13.798 -0.049 1.00 0.00 O ATOM 271 CB ALA A 17 -11.755 13.668 2.668 1.00 0.00 C ATOM 0 H ALA A 17 -10.517 11.812 3.707 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.447 12.245 1.102 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.184 14.424 2.010 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.556 13.084 3.121 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.174 14.156 3.451 1.00 0.00 H new ATOM 277 N GLU A 18 -8.742 13.950 1.903 1.00 0.00 N ATOM 278 CA GLU A 18 -7.637 14.721 1.345 1.00 0.00 C ATOM 279 C GLU A 18 -6.880 13.909 0.297 1.00 0.00 C ATOM 280 O GLU A 18 -6.689 14.365 -0.831 1.00 0.00 O ATOM 281 CB GLU A 18 -6.676 15.164 2.451 1.00 0.00 C ATOM 282 CG GLU A 18 -7.328 16.013 3.531 1.00 0.00 C ATOM 283 CD GLU A 18 -6.344 16.460 4.597 1.00 0.00 C ATOM 284 OE1 GLU A 18 -5.967 15.635 5.449 1.00 0.00 O ATOM 285 OE2 GLU A 18 -5.941 17.644 4.588 1.00 0.00 O ATOM 0 H GLU A 18 -8.654 13.748 2.899 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.057 15.605 0.865 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.237 14.280 2.913 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.858 15.729 2.003 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -7.784 16.890 3.072 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.131 15.444 3.999 1.00 0.00 H new ATOM 292 N LEU A 19 -6.469 12.698 0.666 1.00 0.00 N ATOM 293 CA LEU A 19 -5.690 11.843 -0.228 1.00 0.00 C ATOM 294 C LEU A 19 -6.466 11.505 -1.499 1.00 0.00 C ATOM 295 O LEU A 19 -5.916 11.544 -2.601 1.00 0.00 O ATOM 296 CB LEU A 19 -5.270 10.555 0.487 1.00 0.00 C ATOM 297 CG LEU A 19 -4.315 10.749 1.668 1.00 0.00 C ATOM 298 CD1 LEU A 19 -4.015 9.417 2.336 1.00 0.00 C ATOM 299 CD2 LEU A 19 -3.027 11.419 1.208 1.00 0.00 C ATOM 0 H LEU A 19 -6.662 12.286 1.579 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.797 12.399 -0.514 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.166 10.047 0.844 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.796 9.893 -0.238 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.798 11.398 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.335 9.575 3.173 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.943 8.976 2.700 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.552 8.744 1.614 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.360 11.549 2.060 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.540 10.795 0.458 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.258 12.393 0.776 1.00 0.00 H new ATOM 311 N LEU A 20 -7.744 11.181 -1.344 1.00 0.00 N ATOM 312 CA LEU A 20 -8.589 10.858 -2.486 1.00 0.00 C ATOM 313 C LEU A 20 -8.802 12.084 -3.362 1.00 0.00 C ATOM 314 O LEU A 20 -8.812 11.980 -4.588 1.00 0.00 O ATOM 315 CB LEU A 20 -9.936 10.291 -2.024 1.00 0.00 C ATOM 316 CG LEU A 20 -9.864 8.922 -1.340 1.00 0.00 C ATOM 317 CD1 LEU A 20 -11.237 8.497 -0.844 1.00 0.00 C ATOM 318 CD2 LEU A 20 -9.294 7.879 -2.294 1.00 0.00 C ATOM 0 H LEU A 20 -8.217 11.135 -0.441 1.00 0.00 H new ATOM 0 HA LEU A 20 -8.080 10.096 -3.077 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.394 11.001 -1.335 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.596 10.214 -2.888 1.00 0.00 H new ATOM 0 HG LEU A 20 -9.200 9.003 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -11.164 7.522 -0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.608 9.230 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -11.925 8.434 -1.687 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.250 6.912 -1.792 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -9.933 7.802 -3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -8.291 8.175 -2.600 1.00 0.00 H new ATOM 330 N ASN A 21 -8.952 13.244 -2.732 1.00 0.00 N ATOM 331 CA ASN A 21 -9.115 14.495 -3.463 1.00 0.00 C ATOM 332 C ASN A 21 -7.879 14.792 -4.301 1.00 0.00 C ATOM 333 O ASN A 21 -7.988 15.186 -5.459 1.00 0.00 O ATOM 334 CB ASN A 21 -9.386 15.656 -2.503 1.00 0.00 C ATOM 335 CG ASN A 21 -9.580 16.982 -3.221 1.00 0.00 C ATOM 336 OD1 ASN A 21 -8.632 17.743 -3.425 1.00 0.00 O ATOM 337 ND2 ASN A 21 -10.811 17.263 -3.617 1.00 0.00 N ATOM 0 H ASN A 21 -8.964 13.344 -1.717 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.972 14.385 -4.127 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.276 15.434 -1.914 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.554 15.745 -1.804 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -11.002 18.135 -4.110 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -11.569 16.607 -3.429 1.00 0.00 H new ATOM 344 N VAL A 22 -6.704 14.591 -3.713 1.00 0.00 N ATOM 345 CA VAL A 22 -5.447 14.793 -4.425 1.00 0.00 C ATOM 346 C VAL A 22 -5.367 13.877 -5.645 1.00 0.00 C ATOM 347 O VAL A 22 -5.069 14.326 -6.754 1.00 0.00 O ATOM 348 CB VAL A 22 -4.225 14.546 -3.510 1.00 0.00 C ATOM 349 CG1 VAL A 22 -2.926 14.635 -4.299 1.00 0.00 C ATOM 350 CG2 VAL A 22 -4.217 15.542 -2.359 1.00 0.00 C ATOM 0 H VAL A 22 -6.596 14.288 -2.745 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.425 15.833 -4.751 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.304 13.539 -3.102 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.082 14.457 -3.632 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.928 13.884 -5.089 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.836 15.627 -4.741 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.351 15.356 -1.723 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.165 16.556 -2.756 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.129 15.428 -1.773 1.00 0.00 H new ATOM 360 N LEU A 23 -5.662 12.600 -5.435 1.00 0.00 N ATOM 361 CA LEU A 23 -5.633 11.617 -6.513 1.00 0.00 C ATOM 362 C LEU A 23 -6.642 12.007 -7.597 1.00 0.00 C ATOM 363 O LEU A 23 -6.310 12.048 -8.779 1.00 0.00 O ATOM 364 CB LEU A 23 -5.943 10.218 -5.957 1.00 0.00 C ATOM 365 CG LEU A 23 -5.418 9.026 -6.778 1.00 0.00 C ATOM 366 CD1 LEU A 23 -5.570 7.739 -5.984 1.00 0.00 C ATOM 367 CD2 LEU A 23 -6.144 8.900 -8.110 1.00 0.00 C ATOM 0 H LEU A 23 -5.925 12.219 -4.526 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.638 11.597 -6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.528 10.150 -4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.024 10.119 -5.863 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.363 9.205 -6.986 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.196 6.902 -6.573 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.001 7.814 -5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.622 7.577 -5.751 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.747 8.048 -8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.209 8.752 -7.931 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.997 9.810 -8.692 1.00 0.00 H new ATOM 379 N GLU A 24 -7.862 12.316 -7.171 1.00 0.00 N ATOM 380 CA GLU A 24 -8.938 12.706 -8.080 1.00 0.00 C ATOM 381 C GLU A 24 -8.583 13.973 -8.859 1.00 0.00 C ATOM 382 O GLU A 24 -8.831 14.067 -10.064 1.00 0.00 O ATOM 383 CB GLU A 24 -10.217 12.937 -7.276 1.00 0.00 C ATOM 384 CG GLU A 24 -11.382 13.452 -8.098 1.00 0.00 C ATOM 385 CD GLU A 24 -12.533 13.898 -7.228 1.00 0.00 C ATOM 386 OE1 GLU A 24 -12.512 15.054 -6.758 1.00 0.00 O ATOM 387 OE2 GLU A 24 -13.465 13.098 -7.002 1.00 0.00 O ATOM 0 H GLU A 24 -8.134 12.304 -6.188 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.086 11.902 -8.800 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.508 12.000 -6.800 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.007 13.649 -6.477 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.050 14.286 -8.716 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.722 12.669 -8.776 1.00 0.00 H new ATOM 394 N LYS A 25 -8.006 14.939 -8.157 1.00 0.00 N ATOM 395 CA LYS A 25 -7.644 16.227 -8.740 1.00 0.00 C ATOM 396 C LYS A 25 -6.696 16.055 -9.928 1.00 0.00 C ATOM 397 O LYS A 25 -6.881 16.677 -10.974 1.00 0.00 O ATOM 398 CB LYS A 25 -7.003 17.112 -7.666 1.00 0.00 C ATOM 399 CG LYS A 25 -6.595 18.493 -8.153 1.00 0.00 C ATOM 400 CD LYS A 25 -6.020 19.333 -7.021 1.00 0.00 C ATOM 401 CE LYS A 25 -4.794 18.679 -6.402 1.00 0.00 C ATOM 402 NZ LYS A 25 -4.253 19.468 -5.265 1.00 0.00 N ATOM 0 H LYS A 25 -7.775 14.853 -7.167 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.550 16.706 -9.111 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.704 17.224 -6.839 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.123 16.604 -7.272 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.856 18.396 -8.948 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.460 19.000 -8.581 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.754 20.320 -7.399 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.781 19.480 -6.254 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.053 17.678 -6.057 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.022 18.564 -7.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.567 18.891 -4.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.782 20.321 -5.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.031 19.744 -4.633 1.00 0.00 H new ATOM 416 N HIS A 26 -5.698 15.199 -9.771 1.00 0.00 N ATOM 417 CA HIS A 26 -4.716 14.989 -10.829 1.00 0.00 C ATOM 418 C HIS A 26 -5.206 13.936 -11.817 1.00 0.00 C ATOM 419 O HIS A 26 -4.882 13.994 -13.004 1.00 0.00 O ATOM 420 CB HIS A 26 -3.365 14.556 -10.248 1.00 0.00 C ATOM 421 CG HIS A 26 -2.712 15.579 -9.364 1.00 0.00 C ATOM 422 ND1 HIS A 26 -1.634 16.349 -9.758 1.00 0.00 N ATOM 423 CD2 HIS A 26 -2.972 15.937 -8.087 1.00 0.00 C ATOM 424 CE1 HIS A 26 -1.267 17.129 -8.759 1.00 0.00 C ATOM 425 NE2 HIS A 26 -2.063 16.897 -7.735 1.00 0.00 N ATOM 0 H HIS A 26 -5.545 14.642 -8.930 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.586 15.937 -11.351 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.506 13.638 -9.677 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.689 14.320 -11.070 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.755 15.538 -7.459 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.452 17.838 -8.778 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.010 17.358 -6.827 1.00 0.00 H new ATOM 434 N LYS A 27 -6.005 13.000 -11.312 1.00 0.00 N ATOM 435 CA LYS A 27 -6.468 11.841 -12.075 1.00 0.00 C ATOM 436 C LYS A 27 -5.306 10.951 -12.490 1.00 0.00 C ATOM 437 O LYS A 27 -4.617 11.208 -13.481 1.00 0.00 O ATOM 438 CB LYS A 27 -7.302 12.235 -13.299 1.00 0.00 C ATOM 439 CG LYS A 27 -8.748 12.560 -12.964 1.00 0.00 C ATOM 440 CD LYS A 27 -9.682 12.213 -14.115 1.00 0.00 C ATOM 441 CE LYS A 27 -9.561 10.745 -14.499 1.00 0.00 C ATOM 442 NZ LYS A 27 -10.582 10.338 -15.498 1.00 0.00 N ATOM 0 H LYS A 27 -6.353 13.023 -10.354 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.119 11.277 -11.407 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.844 13.101 -13.778 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.279 11.420 -14.023 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.048 12.009 -12.073 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.838 13.621 -12.729 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -10.711 12.434 -13.831 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.448 12.838 -14.977 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -8.566 10.558 -14.903 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.664 10.128 -13.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -10.460 9.331 -15.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.533 10.491 -15.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.469 10.907 -16.361 1.00 0.00 H new ATOM 456 N ALA A 28 -5.093 9.905 -11.713 1.00 0.00 N ATOM 457 CA ALA A 28 -4.038 8.952 -11.986 1.00 0.00 C ATOM 458 C ALA A 28 -4.632 7.571 -12.217 1.00 0.00 C ATOM 459 O ALA A 28 -5.470 7.116 -11.436 1.00 0.00 O ATOM 460 CB ALA A 28 -3.041 8.920 -10.837 1.00 0.00 C ATOM 0 H ALA A 28 -5.644 9.695 -10.881 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.509 9.260 -12.888 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.254 8.199 -11.058 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.601 9.909 -10.709 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.553 8.629 -9.919 1.00 0.00 H new ATOM 466 N PRO A 29 -4.226 6.900 -13.307 1.00 0.00 N ATOM 467 CA PRO A 29 -4.678 5.540 -13.611 1.00 0.00 C ATOM 468 C PRO A 29 -4.337 4.564 -12.487 1.00 0.00 C ATOM 469 O PRO A 29 -3.398 4.799 -11.725 1.00 0.00 O ATOM 470 CB PRO A 29 -3.903 5.175 -14.881 1.00 0.00 C ATOM 471 CG PRO A 29 -3.519 6.482 -15.486 1.00 0.00 C ATOM 472 CD PRO A 29 -3.307 7.421 -14.333 1.00 0.00 C ATOM 0 HA PRO A 29 -5.760 5.487 -13.730 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.024 4.574 -14.648 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -4.518 4.589 -15.564 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.612 6.385 -16.083 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -4.301 6.850 -16.151 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.272 7.412 -13.990 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.544 8.450 -14.602 1.00 0.00 H new ATOM 480 N THR A 30 -5.090 3.472 -12.399 1.00 0.00 N ATOM 481 CA THR A 30 -4.901 2.478 -11.346 1.00 0.00 C ATOM 482 C THR A 30 -3.447 1.993 -11.291 1.00 0.00 C ATOM 483 O THR A 30 -2.873 1.843 -10.212 1.00 0.00 O ATOM 484 CB THR A 30 -5.843 1.277 -11.565 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.151 1.750 -11.930 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.943 0.425 -10.307 1.00 0.00 C ATOM 0 H THR A 30 -5.843 3.251 -13.050 1.00 0.00 H new ATOM 0 HA THR A 30 -5.140 2.954 -10.395 1.00 0.00 H new ATOM 0 HB THR A 30 -5.434 0.662 -12.367 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.748 0.986 -12.070 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.613 -0.415 -10.489 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.955 0.050 -10.042 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.333 1.030 -9.488 1.00 0.00 H new ATOM 494 N ASP A 31 -2.856 1.778 -12.464 1.00 0.00 N ATOM 495 CA ASP A 31 -1.465 1.340 -12.569 1.00 0.00 C ATOM 496 C ASP A 31 -0.531 2.361 -11.931 1.00 0.00 C ATOM 497 O ASP A 31 0.287 2.028 -11.074 1.00 0.00 O ATOM 498 CB ASP A 31 -1.075 1.156 -14.038 1.00 0.00 C ATOM 499 CG ASP A 31 -2.070 0.316 -14.803 1.00 0.00 C ATOM 500 OD1 ASP A 31 -3.116 0.863 -15.214 1.00 0.00 O ATOM 501 OD2 ASP A 31 -1.814 -0.887 -15.003 1.00 0.00 O ATOM 0 H ASP A 31 -3.323 1.901 -13.362 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.371 0.389 -12.044 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -0.990 2.134 -14.512 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.092 0.688 -14.093 1.00 0.00 H new ATOM 506 N LEU A 32 -0.671 3.611 -12.361 1.00 0.00 N ATOM 507 CA LEU A 32 0.157 4.699 -11.860 1.00 0.00 C ATOM 508 C LEU A 32 -0.071 4.903 -10.367 1.00 0.00 C ATOM 509 O LEU A 32 0.880 5.089 -9.613 1.00 0.00 O ATOM 510 CB LEU A 32 -0.150 5.992 -12.625 1.00 0.00 C ATOM 511 CG LEU A 32 0.640 7.227 -12.181 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.132 7.012 -12.377 1.00 0.00 C ATOM 513 CD2 LEU A 32 0.176 8.457 -12.946 1.00 0.00 C ATOM 0 H LEU A 32 -1.356 3.895 -13.061 1.00 0.00 H new ATOM 0 HA LEU A 32 1.204 4.437 -12.016 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.043 5.821 -13.684 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.214 6.208 -12.525 1.00 0.00 H new ATOM 0 HG LEU A 32 0.455 7.387 -11.119 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.673 7.902 -12.055 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.457 6.156 -11.786 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.337 6.824 -13.431 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.747 9.326 -12.619 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.331 8.302 -14.014 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.884 8.626 -12.755 1.00 0.00 H new ATOM 525 N SER A 33 -1.331 4.851 -9.952 1.00 0.00 N ATOM 526 CA SER A 33 -1.695 5.034 -8.555 1.00 0.00 C ATOM 527 C SER A 33 -0.963 4.030 -7.666 1.00 0.00 C ATOM 528 O SER A 33 -0.286 4.415 -6.711 1.00 0.00 O ATOM 529 CB SER A 33 -3.211 4.891 -8.388 1.00 0.00 C ATOM 530 OG SER A 33 -3.615 5.164 -7.060 1.00 0.00 O ATOM 0 H SER A 33 -2.124 4.682 -10.571 1.00 0.00 H new ATOM 0 HA SER A 33 -1.397 6.036 -8.247 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.719 5.572 -9.071 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.514 3.880 -8.661 1.00 0.00 H new ATOM 0 HG SER A 33 -4.498 4.770 -6.899 1.00 0.00 H new ATOM 536 N LEU A 34 -1.071 2.747 -8.006 1.00 0.00 N ATOM 537 CA LEU A 34 -0.431 1.692 -7.226 1.00 0.00 C ATOM 538 C LEU A 34 1.088 1.832 -7.251 1.00 0.00 C ATOM 539 O LEU A 34 1.759 1.552 -6.259 1.00 0.00 O ATOM 540 CB LEU A 34 -0.841 0.313 -7.751 1.00 0.00 C ATOM 541 CG LEU A 34 -2.314 -0.049 -7.545 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.626 -1.391 -8.186 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.651 -0.078 -6.062 1.00 0.00 C ATOM 0 H LEU A 34 -1.595 2.414 -8.815 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.766 1.791 -6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.617 0.266 -8.817 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.226 -0.442 -7.262 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.927 0.714 -8.025 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.677 -1.633 -8.030 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.420 -1.340 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.005 -2.164 -7.733 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.702 -0.337 -5.933 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.030 -0.821 -5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.463 0.904 -5.627 1.00 0.00 H new ATOM 555 N MET A 35 1.624 2.276 -8.379 1.00 0.00 N ATOM 556 CA MET A 35 3.063 2.453 -8.515 1.00 0.00 C ATOM 557 C MET A 35 3.549 3.611 -7.647 1.00 0.00 C ATOM 558 O MET A 35 4.580 3.507 -6.979 1.00 0.00 O ATOM 559 CB MET A 35 3.438 2.682 -9.983 1.00 0.00 C ATOM 560 CG MET A 35 4.936 2.779 -10.223 1.00 0.00 C ATOM 561 SD MET A 35 5.366 2.772 -11.975 1.00 0.00 S ATOM 562 CE MET A 35 4.518 4.241 -12.550 1.00 0.00 C ATOM 0 H MET A 35 1.086 2.520 -9.211 1.00 0.00 H new ATOM 0 HA MET A 35 3.555 1.543 -8.172 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.035 1.866 -10.583 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.963 3.599 -10.331 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.314 3.693 -9.765 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.433 1.945 -9.728 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.872 4.498 -13.548 1.00 0.00 H new ATOM 0 HE2 MET A 35 3.445 4.052 -12.583 1.00 0.00 H new ATOM 0 HE3 MET A 35 4.721 5.068 -11.869 1.00 0.00 H new ATOM 572 N VAL A 36 2.795 4.707 -7.644 1.00 0.00 N ATOM 573 CA VAL A 36 3.124 5.857 -6.809 1.00 0.00 C ATOM 574 C VAL A 36 2.993 5.499 -5.332 1.00 0.00 C ATOM 575 O VAL A 36 3.902 5.757 -4.543 1.00 0.00 O ATOM 576 CB VAL A 36 2.232 7.080 -7.130 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.510 8.226 -6.164 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.446 7.540 -8.564 1.00 0.00 C ATOM 0 H VAL A 36 1.954 4.822 -8.209 1.00 0.00 H new ATOM 0 HA VAL A 36 4.157 6.128 -7.028 1.00 0.00 H new ATOM 0 HB VAL A 36 1.192 6.775 -7.013 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.870 9.073 -6.411 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.304 7.901 -5.144 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.555 8.525 -6.245 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.809 8.401 -8.769 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.490 7.819 -8.705 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.192 6.730 -9.248 1.00 0.00 H new ATOM 588 N LEU A 37 1.870 4.883 -4.968 1.00 0.00 N ATOM 589 CA LEU A 37 1.641 4.458 -3.589 1.00 0.00 C ATOM 590 C LEU A 37 2.724 3.481 -3.144 1.00 0.00 C ATOM 591 O LEU A 37 3.247 3.587 -2.037 1.00 0.00 O ATOM 592 CB LEU A 37 0.259 3.811 -3.441 1.00 0.00 C ATOM 593 CG LEU A 37 -0.927 4.745 -3.684 1.00 0.00 C ATOM 594 CD1 LEU A 37 -2.238 3.981 -3.566 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.896 5.911 -2.709 1.00 0.00 C ATOM 0 H LEU A 37 1.106 4.667 -5.608 1.00 0.00 H new ATOM 0 HA LEU A 37 1.681 5.342 -2.953 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.191 2.975 -4.137 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.175 3.397 -2.436 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.852 5.144 -4.696 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.072 4.660 -3.742 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.260 3.180 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.322 3.554 -2.566 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.747 6.565 -2.897 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.947 5.533 -1.688 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.029 6.472 -2.842 1.00 0.00 H new ATOM 607 N GLY A 38 3.066 2.541 -4.018 1.00 0.00 N ATOM 608 CA GLY A 38 4.115 1.586 -3.716 1.00 0.00 C ATOM 609 C GLY A 38 5.450 2.258 -3.466 1.00 0.00 C ATOM 610 O GLY A 38 6.140 1.943 -2.493 1.00 0.00 O ATOM 0 H GLY A 38 2.633 2.423 -4.934 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.833 1.005 -2.838 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.214 0.884 -4.544 1.00 0.00 H new ATOM 614 N ASN A 39 5.809 3.201 -4.332 1.00 0.00 N ATOM 615 CA ASN A 39 7.056 3.950 -4.184 1.00 0.00 C ATOM 616 C ASN A 39 7.015 4.777 -2.901 1.00 0.00 C ATOM 617 O ASN A 39 8.009 4.881 -2.178 1.00 0.00 O ATOM 618 CB ASN A 39 7.272 4.866 -5.395 1.00 0.00 C ATOM 619 CG ASN A 39 8.672 5.453 -5.448 1.00 0.00 C ATOM 620 OD1 ASN A 39 8.947 6.496 -4.856 1.00 0.00 O ATOM 621 ND2 ASN A 39 9.562 4.795 -6.178 1.00 0.00 N ATOM 0 H ASN A 39 5.254 3.466 -5.146 1.00 0.00 H new ATOM 0 HA ASN A 39 7.886 3.246 -4.127 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.085 4.302 -6.309 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.544 5.677 -5.366 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.514 5.151 -6.264 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.295 3.933 -6.654 1.00 0.00 H new ATOM 628 N MET A 40 5.848 5.346 -2.625 1.00 0.00 N ATOM 629 CA MET A 40 5.621 6.128 -1.415 1.00 0.00 C ATOM 630 C MET A 40 5.830 5.273 -0.166 1.00 0.00 C ATOM 631 O MET A 40 6.597 5.641 0.725 1.00 0.00 O ATOM 632 CB MET A 40 4.203 6.701 -1.433 1.00 0.00 C ATOM 633 CG MET A 40 3.839 7.503 -0.196 1.00 0.00 C ATOM 634 SD MET A 40 2.168 8.174 -0.289 1.00 0.00 S ATOM 635 CE MET A 40 2.040 8.971 1.306 1.00 0.00 C ATOM 0 H MET A 40 5.032 5.279 -3.233 1.00 0.00 H new ATOM 0 HA MET A 40 6.341 6.946 -1.388 1.00 0.00 H new ATOM 0 HB2 MET A 40 4.092 7.338 -2.311 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.493 5.881 -1.542 1.00 0.00 H new ATOM 0 HG2 MET A 40 3.925 6.868 0.686 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.550 8.319 -0.072 1.00 0.00 H new ATOM 0 HE1 MET A 40 0.996 8.992 1.619 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.627 8.417 2.038 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.418 9.991 1.235 1.00 0.00 H new ATOM 645 N VAL A 41 5.153 4.127 -0.116 1.00 0.00 N ATOM 646 CA VAL A 41 5.279 3.200 1.005 1.00 0.00 C ATOM 647 C VAL A 41 6.731 2.764 1.182 1.00 0.00 C ATOM 648 O VAL A 41 7.245 2.736 2.301 1.00 0.00 O ATOM 649 CB VAL A 41 4.383 1.952 0.817 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.614 0.941 1.930 1.00 0.00 C ATOM 651 CG2 VAL A 41 2.915 2.350 0.763 1.00 0.00 C ATOM 0 H VAL A 41 4.508 3.818 -0.844 1.00 0.00 H new ATOM 0 HA VAL A 41 4.948 3.728 1.899 1.00 0.00 H new ATOM 0 HB VAL A 41 4.654 1.485 -0.130 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.972 0.074 1.773 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.657 0.625 1.924 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.379 1.398 2.891 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.301 1.459 0.630 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.638 2.846 1.693 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.753 3.030 -0.073 1.00 0.00 H new ATOM 661 N THR A 42 7.389 2.448 0.070 1.00 0.00 N ATOM 662 CA THR A 42 8.791 2.047 0.091 1.00 0.00 C ATOM 663 C THR A 42 9.650 3.104 0.792 1.00 0.00 C ATOM 664 O THR A 42 10.348 2.806 1.761 1.00 0.00 O ATOM 665 CB THR A 42 9.325 1.807 -1.341 1.00 0.00 C ATOM 666 OG1 THR A 42 8.543 0.795 -1.997 1.00 0.00 O ATOM 667 CG2 THR A 42 10.788 1.382 -1.318 1.00 0.00 C ATOM 0 H THR A 42 6.971 2.462 -0.860 1.00 0.00 H new ATOM 0 HA THR A 42 8.855 1.112 0.648 1.00 0.00 H new ATOM 0 HB THR A 42 9.245 2.745 -1.890 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.625 1.117 -2.117 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.136 1.220 -2.338 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.387 2.163 -0.850 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.889 0.458 -0.749 1.00 0.00 H new ATOM 675 N ASN A 43 9.562 4.346 0.325 1.00 0.00 N ATOM 676 CA ASN A 43 10.351 5.435 0.897 1.00 0.00 C ATOM 677 C ASN A 43 9.983 5.680 2.355 1.00 0.00 C ATOM 678 O ASN A 43 10.848 5.961 3.182 1.00 0.00 O ATOM 679 CB ASN A 43 10.166 6.728 0.099 1.00 0.00 C ATOM 680 CG ASN A 43 10.985 6.757 -1.176 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.138 7.189 -1.176 1.00 0.00 O ATOM 682 ND2 ASN A 43 10.400 6.305 -2.274 1.00 0.00 N ATOM 0 H ASN A 43 8.954 4.624 -0.446 1.00 0.00 H new ATOM 0 HA ASN A 43 11.397 5.133 0.846 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.112 6.848 -0.150 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.445 7.577 0.723 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.906 6.307 -3.159 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.443 5.955 -2.235 1.00 0.00 H new ATOM 689 N LEU A 44 8.699 5.565 2.663 1.00 0.00 N ATOM 690 CA LEU A 44 8.213 5.768 4.023 1.00 0.00 C ATOM 691 C LEU A 44 8.875 4.787 4.990 1.00 0.00 C ATOM 692 O LEU A 44 9.373 5.181 6.048 1.00 0.00 O ATOM 693 CB LEU A 44 6.689 5.609 4.065 1.00 0.00 C ATOM 694 CG LEU A 44 6.039 5.829 5.434 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.273 7.252 5.922 1.00 0.00 C ATOM 696 CD2 LEU A 44 4.548 5.529 5.366 1.00 0.00 C ATOM 0 H LEU A 44 7.971 5.331 1.987 1.00 0.00 H new ATOM 0 HA LEU A 44 8.473 6.780 4.334 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.249 6.311 3.357 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.436 4.607 3.720 1.00 0.00 H new ATOM 0 HG LEU A 44 6.501 5.145 6.146 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.802 7.385 6.896 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.344 7.435 6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.841 7.956 5.211 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.099 5.690 6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.077 6.190 4.639 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.399 4.492 5.064 1.00 0.00 H new ATOM 708 N ILE A 45 8.905 3.518 4.604 1.00 0.00 N ATOM 709 CA ILE A 45 9.481 2.471 5.441 1.00 0.00 C ATOM 710 C ILE A 45 11.007 2.589 5.503 1.00 0.00 C ATOM 711 O ILE A 45 11.633 2.190 6.482 1.00 0.00 O ATOM 712 CB ILE A 45 9.084 1.067 4.920 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.558 0.917 4.905 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.710 -0.027 5.777 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.082 -0.416 4.367 1.00 0.00 C ATOM 0 H ILE A 45 8.536 3.187 3.713 1.00 0.00 H new ATOM 0 HA ILE A 45 9.082 2.600 6.447 1.00 0.00 H new ATOM 0 HB ILE A 45 9.460 0.963 3.902 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.179 1.046 5.919 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.129 1.717 4.301 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.417 -1.004 5.392 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.796 0.064 5.747 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.366 0.075 6.806 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.993 -0.448 4.387 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.430 -0.540 3.341 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.481 -1.221 4.985 1.00 0.00 H new ATOM 727 N ASN A 46 11.607 3.154 4.464 1.00 0.00 N ATOM 728 CA ASN A 46 13.061 3.281 4.410 1.00 0.00 C ATOM 729 C ASN A 46 13.556 4.483 5.205 1.00 0.00 C ATOM 730 O ASN A 46 14.723 4.538 5.590 1.00 0.00 O ATOM 731 CB ASN A 46 13.561 3.388 2.963 1.00 0.00 C ATOM 732 CG ASN A 46 13.321 2.130 2.144 1.00 0.00 C ATOM 733 OD1 ASN A 46 13.193 0.991 2.809 1.00 0.00 O flip ATOM 734 ND2 ASN A 46 13.236 2.183 0.921 1.00 0.00 N flip ATOM 0 H ASN A 46 11.116 3.529 3.652 1.00 0.00 H new ATOM 0 HA ASN A 46 13.466 2.375 4.861 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.066 4.228 2.477 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.628 3.609 2.971 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.340 3.077 0.441 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.062 1.333 0.385 1.00 0.00 H new ATOM 741 N THR A 47 12.672 5.441 5.455 1.00 0.00 N ATOM 742 CA THR A 47 13.067 6.677 6.116 1.00 0.00 C ATOM 743 C THR A 47 12.651 6.709 7.584 1.00 0.00 C ATOM 744 O THR A 47 13.484 6.913 8.472 1.00 0.00 O ATOM 745 CB THR A 47 12.475 7.902 5.391 1.00 0.00 C ATOM 746 OG1 THR A 47 11.072 7.708 5.166 1.00 0.00 O ATOM 747 CG2 THR A 47 13.177 8.135 4.062 1.00 0.00 C ATOM 0 H THR A 47 11.683 5.386 5.212 1.00 0.00 H new ATOM 0 HA THR A 47 14.155 6.716 6.072 1.00 0.00 H new ATOM 0 HB THR A 47 12.625 8.778 6.023 1.00 0.00 H new ATOM 0 HG1 THR A 47 10.943 7.020 4.480 1.00 0.00 H new ATOM 0 HG21 THR A 47 12.742 9.004 3.568 1.00 0.00 H new ATOM 0 HG22 THR A 47 14.239 8.310 4.237 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.054 7.258 3.427 1.00 0.00 H new ATOM 755 N SER A 48 11.366 6.512 7.843 1.00 0.00 N ATOM 756 CA SER A 48 10.843 6.631 9.197 1.00 0.00 C ATOM 757 C SER A 48 11.024 5.334 9.982 1.00 0.00 C ATOM 758 O SER A 48 11.251 5.357 11.194 1.00 0.00 O ATOM 759 CB SER A 48 9.369 7.042 9.163 1.00 0.00 C ATOM 760 OG SER A 48 8.579 6.105 8.448 1.00 0.00 O ATOM 0 H SER A 48 10.670 6.270 7.138 1.00 0.00 H new ATOM 0 HA SER A 48 11.411 7.407 9.710 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.993 7.132 10.182 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.276 8.025 8.700 1.00 0.00 H new ATOM 0 HG SER A 48 8.872 6.076 7.513 1.00 0.00 H new ATOM 766 N ILE A 49 10.934 4.209 9.287 1.00 0.00 N ATOM 767 CA ILE A 49 11.107 2.906 9.914 1.00 0.00 C ATOM 768 C ILE A 49 12.587 2.540 9.935 1.00 0.00 C ATOM 769 O ILE A 49 13.325 2.869 9.006 1.00 0.00 O ATOM 770 CB ILE A 49 10.302 1.809 9.171 1.00 0.00 C ATOM 771 CG1 ILE A 49 8.810 2.160 9.144 1.00 0.00 C ATOM 772 CG2 ILE A 49 10.514 0.444 9.815 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.186 2.289 10.517 1.00 0.00 C ATOM 0 H ILE A 49 10.742 4.172 8.286 1.00 0.00 H new ATOM 0 HA ILE A 49 10.728 2.966 10.934 1.00 0.00 H new ATOM 0 HB ILE A 49 10.667 1.761 8.145 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.677 3.098 8.606 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.276 1.393 8.584 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.938 -0.307 9.274 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.572 0.185 9.779 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.184 0.476 10.853 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.130 2.539 10.415 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.286 1.345 11.052 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.693 3.077 11.074 1.00 0.00 H new ATOM 785 N ALA A 50 13.020 1.891 11.011 1.00 0.00 N ATOM 786 CA ALA A 50 14.410 1.478 11.147 1.00 0.00 C ATOM 787 C ALA A 50 14.807 0.530 10.018 1.00 0.00 C ATOM 788 O ALA A 50 14.193 -0.524 9.838 1.00 0.00 O ATOM 789 CB ALA A 50 14.636 0.821 12.500 1.00 0.00 C ATOM 0 H ALA A 50 12.427 1.640 11.802 1.00 0.00 H new ATOM 0 HA ALA A 50 15.040 2.365 11.082 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.679 0.518 12.587 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.397 1.529 13.293 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.994 -0.055 12.591 1.00 0.00 H new ATOM 795 N PRO A 51 15.844 0.900 9.247 1.00 0.00 N ATOM 796 CA PRO A 51 16.325 0.112 8.101 1.00 0.00 C ATOM 797 C PRO A 51 16.680 -1.325 8.473 1.00 0.00 C ATOM 798 O PRO A 51 16.678 -2.215 7.624 1.00 0.00 O ATOM 799 CB PRO A 51 17.577 0.868 7.648 1.00 0.00 C ATOM 800 CG PRO A 51 17.369 2.263 8.125 1.00 0.00 C ATOM 801 CD PRO A 51 16.624 2.140 9.423 1.00 0.00 C ATOM 0 HA PRO A 51 15.559 0.019 7.331 1.00 0.00 H new ATOM 0 HB2 PRO A 51 18.479 0.433 8.078 1.00 0.00 H new ATOM 0 HB3 PRO A 51 17.691 0.833 6.565 1.00 0.00 H new ATOM 0 HG2 PRO A 51 18.321 2.775 8.267 1.00 0.00 H new ATOM 0 HG3 PRO A 51 16.799 2.844 7.400 1.00 0.00 H new ATOM 0 HD2 PRO A 51 17.304 2.071 10.272 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.978 3.000 9.600 1.00 0.00 H new ATOM 809 N ALA A 52 16.972 -1.546 9.743 1.00 0.00 N ATOM 810 CA ALA A 52 17.328 -2.870 10.224 1.00 0.00 C ATOM 811 C ALA A 52 16.127 -3.815 10.214 1.00 0.00 C ATOM 812 O ALA A 52 16.274 -5.015 9.988 1.00 0.00 O ATOM 813 CB ALA A 52 17.905 -2.770 11.625 1.00 0.00 C ATOM 0 H ALA A 52 16.970 -0.823 10.462 1.00 0.00 H new ATOM 0 HA ALA A 52 18.078 -3.283 9.550 1.00 0.00 H new ATOM 0 HB1 ALA A 52 18.170 -3.765 11.981 1.00 0.00 H new ATOM 0 HB2 ALA A 52 18.795 -2.141 11.608 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.164 -2.331 12.293 1.00 0.00 H new ATOM 819 N GLN A 53 14.936 -3.275 10.441 1.00 0.00 N ATOM 820 CA GLN A 53 13.743 -4.107 10.553 1.00 0.00 C ATOM 821 C GLN A 53 12.703 -3.748 9.497 1.00 0.00 C ATOM 822 O GLN A 53 11.549 -4.166 9.584 1.00 0.00 O ATOM 823 CB GLN A 53 13.131 -3.988 11.953 1.00 0.00 C ATOM 824 CG GLN A 53 12.772 -2.567 12.351 1.00 0.00 C ATOM 825 CD GLN A 53 12.034 -2.508 13.673 1.00 0.00 C ATOM 826 OE1 GLN A 53 10.805 -2.554 13.717 1.00 0.00 O ATOM 827 NE2 GLN A 53 12.780 -2.419 14.761 1.00 0.00 N ATOM 0 H GLN A 53 14.770 -2.275 10.550 1.00 0.00 H new ATOM 0 HA GLN A 53 14.051 -5.139 10.384 1.00 0.00 H new ATOM 0 HB2 GLN A 53 12.234 -4.605 12.000 1.00 0.00 H new ATOM 0 HB3 GLN A 53 13.834 -4.392 12.681 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.682 -1.970 12.419 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.154 -2.119 11.573 1.00 0.00 H new ATOM 0 HE21 GLN A 53 13.796 -2.383 14.681 1.00 0.00 H new ATOM 0 HE22 GLN A 53 12.339 -2.386 15.680 1.00 0.00 H new ATOM 836 N ARG A 54 13.116 -3.003 8.479 1.00 0.00 N ATOM 837 CA ARG A 54 12.197 -2.584 7.422 1.00 0.00 C ATOM 838 C ARG A 54 11.596 -3.787 6.692 1.00 0.00 C ATOM 839 O ARG A 54 10.489 -3.710 6.162 1.00 0.00 O ATOM 840 CB ARG A 54 12.895 -1.649 6.431 1.00 0.00 C ATOM 841 CG ARG A 54 14.176 -2.210 5.834 1.00 0.00 C ATOM 842 CD ARG A 54 14.848 -1.193 4.927 1.00 0.00 C ATOM 843 NE ARG A 54 16.209 -1.581 4.574 1.00 0.00 N ATOM 844 CZ ARG A 54 17.198 -0.714 4.364 1.00 0.00 C ATOM 845 NH1 ARG A 54 16.968 0.593 4.400 1.00 0.00 N ATOM 846 NH2 ARG A 54 18.419 -1.160 4.116 1.00 0.00 N ATOM 0 H ARG A 54 14.075 -2.677 8.361 1.00 0.00 H new ATOM 0 HA ARG A 54 11.381 -2.039 7.896 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.203 -1.415 5.622 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.124 -0.710 6.935 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.859 -2.496 6.634 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.952 -3.114 5.268 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.259 -1.075 4.018 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.866 -0.223 5.423 1.00 0.00 H new ATOM 0 HE ARG A 54 16.416 -2.576 4.483 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.028 0.940 4.590 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.731 1.250 4.238 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.599 -2.164 4.086 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.180 -0.500 3.954 1.00 0.00 H new ATOM 860 N GLN A 55 12.320 -4.900 6.686 1.00 0.00 N ATOM 861 CA GLN A 55 11.830 -6.127 6.068 1.00 0.00 C ATOM 862 C GLN A 55 10.693 -6.737 6.881 1.00 0.00 C ATOM 863 O GLN A 55 9.774 -7.339 6.322 1.00 0.00 O ATOM 864 CB GLN A 55 12.966 -7.139 5.912 1.00 0.00 C ATOM 865 CG GLN A 55 13.855 -6.873 4.709 1.00 0.00 C ATOM 866 CD GLN A 55 13.122 -7.079 3.397 1.00 0.00 C ATOM 867 OE1 GLN A 55 13.092 -8.185 2.859 1.00 0.00 O ATOM 868 NE2 GLN A 55 12.528 -6.019 2.871 1.00 0.00 N ATOM 0 H GLN A 55 13.248 -4.979 7.102 1.00 0.00 H new ATOM 0 HA GLN A 55 11.445 -5.872 5.081 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.577 -7.129 6.814 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.541 -8.139 5.826 1.00 0.00 H new ATOM 0 HG2 GLN A 55 14.231 -5.851 4.756 1.00 0.00 H new ATOM 0 HG3 GLN A 55 14.721 -7.533 4.747 1.00 0.00 H new ATOM 0 HE21 GLN A 55 12.576 -5.119 3.348 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.023 -6.103 1.989 1.00 0.00 H new ATOM 877 N ALA A 56 10.752 -6.571 8.197 1.00 0.00 N ATOM 878 CA ALA A 56 9.724 -7.103 9.081 1.00 0.00 C ATOM 879 C ALA A 56 8.414 -6.350 8.888 1.00 0.00 C ATOM 880 O ALA A 56 7.345 -6.957 8.790 1.00 0.00 O ATOM 881 CB ALA A 56 10.179 -7.026 10.533 1.00 0.00 C ATOM 0 H ALA A 56 11.502 -6.072 8.675 1.00 0.00 H new ATOM 0 HA ALA A 56 9.558 -8.150 8.829 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.399 -7.427 11.180 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.092 -7.609 10.660 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.372 -5.987 10.799 1.00 0.00 H new ATOM 887 N ILE A 57 8.509 -5.028 8.817 1.00 0.00 N ATOM 888 CA ILE A 57 7.340 -4.185 8.589 1.00 0.00 C ATOM 889 C ILE A 57 6.746 -4.466 7.211 1.00 0.00 C ATOM 890 O ILE A 57 5.531 -4.627 7.070 1.00 0.00 O ATOM 891 CB ILE A 57 7.675 -2.673 8.731 1.00 0.00 C ATOM 892 CG1 ILE A 57 7.783 -2.270 10.209 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.631 -1.807 8.034 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.966 -2.868 10.937 1.00 0.00 C ATOM 0 H ILE A 57 9.385 -4.515 8.914 1.00 0.00 H new ATOM 0 HA ILE A 57 6.606 -4.431 9.356 1.00 0.00 H new ATOM 0 HB ILE A 57 8.639 -2.508 8.250 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.845 -1.184 10.273 1.00 0.00 H new ATOM 0 HG13 ILE A 57 6.868 -2.568 10.722 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.893 -0.756 8.151 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.600 -2.057 6.974 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.652 -1.988 8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.964 -2.531 11.973 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.898 -3.956 10.909 1.00 0.00 H new ATOM 0 HD13 ILE A 57 9.890 -2.550 10.454 1.00 0.00 H new ATOM 906 N ALA A 58 7.615 -4.555 6.205 1.00 0.00 N ATOM 907 CA ALA A 58 7.189 -4.833 4.837 1.00 0.00 C ATOM 908 C ALA A 58 6.407 -6.141 4.757 1.00 0.00 C ATOM 909 O ALA A 58 5.332 -6.198 4.159 1.00 0.00 O ATOM 910 CB ALA A 58 8.394 -4.877 3.908 1.00 0.00 C ATOM 0 H ALA A 58 8.622 -4.438 6.314 1.00 0.00 H new ATOM 0 HA ALA A 58 6.527 -4.027 4.519 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.062 -5.085 2.891 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.908 -3.916 3.932 1.00 0.00 H new ATOM 0 HB3 ALA A 58 9.077 -5.662 4.234 1.00 0.00 H new ATOM 916 N ASN A 59 6.946 -7.186 5.373 1.00 0.00 N ATOM 917 CA ASN A 59 6.282 -8.484 5.395 1.00 0.00 C ATOM 918 C ASN A 59 4.949 -8.402 6.126 1.00 0.00 C ATOM 919 O ASN A 59 3.936 -8.900 5.640 1.00 0.00 O ATOM 920 CB ASN A 59 7.171 -9.544 6.052 1.00 0.00 C ATOM 921 CG ASN A 59 8.063 -10.256 5.053 1.00 0.00 C ATOM 922 OD1 ASN A 59 7.690 -11.293 4.502 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.250 -9.714 4.816 1.00 0.00 N ATOM 0 H ASN A 59 7.840 -7.160 5.863 1.00 0.00 H new ATOM 0 HA ASN A 59 6.097 -8.775 4.361 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.790 -9.072 6.815 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.543 -10.276 6.559 1.00 0.00 H new ATOM 0 HD21 ASN A 59 9.891 -10.157 4.157 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.522 -8.854 5.292 1.00 0.00 H new ATOM 930 N SER A 60 4.947 -7.760 7.287 1.00 0.00 N ATOM 931 CA SER A 60 3.740 -7.640 8.093 1.00 0.00 C ATOM 932 C SER A 60 2.633 -6.910 7.333 1.00 0.00 C ATOM 933 O SER A 60 1.464 -7.285 7.421 1.00 0.00 O ATOM 934 CB SER A 60 4.058 -6.928 9.405 1.00 0.00 C ATOM 935 OG SER A 60 5.046 -7.643 10.129 1.00 0.00 O ATOM 0 H SER A 60 5.770 -7.314 7.692 1.00 0.00 H new ATOM 0 HA SER A 60 3.376 -8.643 8.315 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.408 -5.916 9.201 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.153 -6.837 10.005 1.00 0.00 H new ATOM 0 HG SER A 60 5.936 -7.388 9.807 1.00 0.00 H new ATOM 941 N PHE A 61 3.009 -5.890 6.566 1.00 0.00 N ATOM 942 CA PHE A 61 2.055 -5.156 5.743 1.00 0.00 C ATOM 943 C PHE A 61 1.438 -6.082 4.697 1.00 0.00 C ATOM 944 O PHE A 61 0.233 -6.039 4.444 1.00 0.00 O ATOM 945 CB PHE A 61 2.745 -3.967 5.063 1.00 0.00 C ATOM 946 CG PHE A 61 1.814 -3.100 4.259 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.028 -2.142 4.881 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.731 -3.237 2.882 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.171 -1.345 4.145 1.00 0.00 C ATOM 950 CE2 PHE A 61 0.877 -2.442 2.142 1.00 0.00 C ATOM 951 CZ PHE A 61 0.099 -1.492 2.773 1.00 0.00 C ATOM 0 H PHE A 61 3.969 -5.553 6.498 1.00 0.00 H new ATOM 0 HA PHE A 61 1.259 -4.776 6.384 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.228 -3.355 5.825 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.532 -4.342 4.409 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.086 -2.017 5.952 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.341 -3.974 2.382 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.442 -0.608 4.642 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.818 -2.564 1.070 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.564 -0.865 2.196 1.00 0.00 H new ATOM 961 N ALA A 62 2.273 -6.935 4.113 1.00 0.00 N ATOM 962 CA ALA A 62 1.828 -7.884 3.100 1.00 0.00 C ATOM 963 C ALA A 62 0.798 -8.857 3.670 1.00 0.00 C ATOM 964 O ALA A 62 -0.244 -9.096 3.058 1.00 0.00 O ATOM 965 CB ALA A 62 3.016 -8.642 2.532 1.00 0.00 C ATOM 0 H ALA A 62 3.269 -6.988 4.326 1.00 0.00 H new ATOM 0 HA ALA A 62 1.350 -7.323 2.297 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.670 -9.348 1.777 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.714 -7.938 2.079 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.518 -9.185 3.333 1.00 0.00 H new ATOM 971 N ARG A 63 1.088 -9.410 4.848 1.00 0.00 N ATOM 972 CA ARG A 63 0.161 -10.334 5.501 1.00 0.00 C ATOM 973 C ARG A 63 -1.142 -9.632 5.854 1.00 0.00 C ATOM 974 O ARG A 63 -2.222 -10.206 5.706 1.00 0.00 O ATOM 975 CB ARG A 63 0.766 -10.964 6.764 1.00 0.00 C ATOM 976 CG ARG A 63 1.695 -12.139 6.490 1.00 0.00 C ATOM 977 CD ARG A 63 3.146 -11.708 6.355 1.00 0.00 C ATOM 978 NE ARG A 63 3.663 -11.124 7.596 1.00 0.00 N ATOM 979 CZ ARG A 63 4.376 -11.801 8.501 1.00 0.00 C ATOM 980 NH1 ARG A 63 4.650 -13.088 8.308 1.00 0.00 N ATOM 981 NH2 ARG A 63 4.816 -11.182 9.593 1.00 0.00 N ATOM 0 H ARG A 63 1.950 -9.236 5.366 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.040 -11.134 4.789 1.00 0.00 H new ATOM 0 HB2 ARG A 63 1.317 -10.199 7.310 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.043 -11.298 7.413 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.608 -12.865 7.299 1.00 0.00 H new ATOM 0 HG3 ARG A 63 1.381 -12.642 5.575 1.00 0.00 H new ATOM 0 HD2 ARG A 63 3.755 -12.568 6.078 1.00 0.00 H new ATOM 0 HD3 ARG A 63 3.235 -10.981 5.548 1.00 0.00 H new ATOM 0 HE ARG A 63 3.466 -10.140 7.780 1.00 0.00 H new ATOM 0 HH11 ARG A 63 4.316 -13.560 7.468 1.00 0.00 H new ATOM 0 HH12 ARG A 63 5.194 -13.603 9.000 1.00 0.00 H new ATOM 0 HH21 ARG A 63 4.609 -10.194 9.737 1.00 0.00 H new ATOM 0 HH22 ARG A 63 5.360 -11.696 10.286 1.00 0.00 H new ATOM 995 N ALA A 64 -1.036 -8.390 6.312 1.00 0.00 N ATOM 996 CA ALA A 64 -2.207 -7.601 6.668 1.00 0.00 C ATOM 997 C ALA A 64 -3.091 -7.371 5.448 1.00 0.00 C ATOM 998 O ALA A 64 -4.297 -7.606 5.495 1.00 0.00 O ATOM 999 CB ALA A 64 -1.785 -6.273 7.281 1.00 0.00 C ATOM 0 H ALA A 64 -0.147 -7.907 6.446 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.784 -8.156 7.408 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.671 -5.695 7.542 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.195 -6.458 8.179 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.186 -5.714 6.562 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.474 -6.935 4.356 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.185 -6.678 3.107 1.00 0.00 C ATOM 1007 C LEU A 65 -3.906 -7.937 2.621 1.00 0.00 C ATOM 1008 O LEU A 65 -5.119 -7.927 2.393 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.197 -6.197 2.038 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.807 -5.849 0.678 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.758 -4.668 0.803 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.708 -5.549 -0.332 1.00 0.00 C ATOM 0 H LEU A 65 -1.472 -6.750 4.310 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.931 -5.904 3.287 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.678 -5.317 2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.444 -6.972 1.890 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.377 -6.708 0.324 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.181 -4.436 -0.175 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.561 -4.919 1.496 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.214 -3.801 1.178 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.156 -5.303 -1.295 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.113 -4.705 0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.067 -6.424 -0.443 1.00 0.00 H new ATOM 1024 N GLN A 66 -3.151 -9.022 2.491 1.00 0.00 N ATOM 1025 CA GLN A 66 -3.678 -10.282 1.975 1.00 0.00 C ATOM 1026 C GLN A 66 -4.834 -10.803 2.833 1.00 0.00 C ATOM 1027 O GLN A 66 -5.808 -11.353 2.314 1.00 0.00 O ATOM 1028 CB GLN A 66 -2.556 -11.322 1.915 1.00 0.00 C ATOM 1029 CG GLN A 66 -2.983 -12.659 1.334 1.00 0.00 C ATOM 1030 CD GLN A 66 -1.862 -13.680 1.344 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -1.686 -14.417 2.316 1.00 0.00 O ATOM 1032 NE2 GLN A 66 -1.095 -13.734 0.267 1.00 0.00 N ATOM 0 H GLN A 66 -2.162 -9.055 2.738 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.066 -10.103 0.972 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.736 -10.923 1.317 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -2.169 -11.482 2.921 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -3.828 -13.046 1.904 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -3.329 -12.513 0.311 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -1.273 -13.107 -0.518 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -0.326 -14.403 0.221 1.00 0.00 H new ATOM 1041 N SER A 67 -4.731 -10.613 4.143 1.00 0.00 N ATOM 1042 CA SER A 67 -5.743 -11.111 5.065 1.00 0.00 C ATOM 1043 C SER A 67 -6.943 -10.168 5.134 1.00 0.00 C ATOM 1044 O SER A 67 -8.065 -10.598 5.410 1.00 0.00 O ATOM 1045 CB SER A 67 -5.140 -11.301 6.455 1.00 0.00 C ATOM 1046 OG SER A 67 -3.998 -12.141 6.396 1.00 0.00 O ATOM 0 H SER A 67 -3.958 -10.119 4.589 1.00 0.00 H new ATOM 0 HA SER A 67 -6.094 -12.074 4.693 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.864 -10.333 6.873 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.883 -11.736 7.123 1.00 0.00 H new ATOM 0 HG SER A 67 -3.196 -11.594 6.259 1.00 0.00 H new ATOM 1052 N SER A 68 -6.705 -8.886 4.882 1.00 0.00 N ATOM 1053 CA SER A 68 -7.773 -7.896 4.893 1.00 0.00 C ATOM 1054 C SER A 68 -8.697 -8.119 3.700 1.00 0.00 C ATOM 1055 O SER A 68 -9.875 -7.752 3.727 1.00 0.00 O ATOM 1056 CB SER A 68 -7.187 -6.477 4.864 1.00 0.00 C ATOM 1057 OG SER A 68 -8.185 -5.499 5.107 1.00 0.00 O ATOM 0 H SER A 68 -5.782 -8.509 4.668 1.00 0.00 H new ATOM 0 HA SER A 68 -8.351 -8.007 5.810 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.401 -6.391 5.614 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.724 -6.293 3.895 1.00 0.00 H new ATOM 0 HG SER A 68 -7.781 -4.606 5.084 1.00 0.00 H new ATOM 1063 N ILE A 69 -8.155 -8.729 2.654 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.935 -9.068 1.477 1.00 0.00 C ATOM 1065 C ILE A 69 -9.931 -10.189 1.775 1.00 0.00 C ATOM 1066 O ILE A 69 -9.574 -11.368 1.798 1.00 0.00 O ATOM 1067 CB ILE A 69 -8.023 -9.485 0.301 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -7.113 -8.321 -0.096 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -8.854 -9.947 -0.889 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -6.166 -8.651 -1.228 1.00 0.00 C ATOM 0 H ILE A 69 -7.173 -8.999 2.600 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.488 -8.173 1.193 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.402 -10.321 0.623 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.730 -7.471 -0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.533 -8.012 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -8.192 -10.236 -1.705 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.464 -10.802 -0.597 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.502 -9.134 -1.218 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.553 -7.779 -1.455 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.523 -9.481 -0.934 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.739 -8.931 -2.112 1.00 0.00 H new ATOM 1082 N ASN A 70 -11.171 -9.803 2.033 1.00 0.00 N ATOM 1083 CA ASN A 70 -12.267 -10.755 2.186 1.00 0.00 C ATOM 1084 C ASN A 70 -13.360 -10.400 1.185 1.00 0.00 C ATOM 1085 O ASN A 70 -13.206 -9.441 0.427 1.00 0.00 O ATOM 1086 CB ASN A 70 -12.818 -10.740 3.620 1.00 0.00 C ATOM 1087 CG ASN A 70 -13.522 -9.440 3.974 1.00 0.00 C ATOM 1088 OD1 ASN A 70 -12.890 -8.474 4.402 1.00 0.00 O ATOM 1089 ND2 ASN A 70 -14.839 -9.408 3.815 1.00 0.00 N ATOM 0 H ASN A 70 -11.448 -8.827 2.142 1.00 0.00 H new ATOM 0 HA ASN A 70 -11.901 -11.763 1.992 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -13.515 -11.569 3.744 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -11.999 -10.905 4.320 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.361 -8.564 4.050 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -15.330 -10.228 3.458 1.00 0.00 H new ATOM 1096 N GLU A 71 -14.451 -11.156 1.158 1.00 0.00 N ATOM 1097 CA GLU A 71 -15.516 -10.874 0.205 1.00 0.00 C ATOM 1098 C GLU A 71 -16.890 -11.219 0.769 1.00 0.00 C ATOM 1099 O GLU A 71 -17.695 -10.332 1.055 1.00 0.00 O ATOM 1100 CB GLU A 71 -15.272 -11.655 -1.083 1.00 0.00 C ATOM 1101 CG GLU A 71 -16.114 -11.193 -2.256 1.00 0.00 C ATOM 1102 CD GLU A 71 -15.830 -11.997 -3.503 1.00 0.00 C ATOM 1103 OE1 GLU A 71 -14.642 -12.228 -3.808 1.00 0.00 O ATOM 1104 OE2 GLU A 71 -16.791 -12.420 -4.174 1.00 0.00 O ATOM 0 H GLU A 71 -14.620 -11.953 1.772 1.00 0.00 H new ATOM 0 HA GLU A 71 -15.504 -9.804 -0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -14.219 -11.573 -1.351 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.473 -12.710 -0.899 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -17.170 -11.279 -2.001 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -15.918 -10.139 -2.451 1.00 0.00 H new ATOM 1111 N ASP A 72 -17.151 -12.505 0.933 1.00 0.00 N ATOM 1112 CA ASP A 72 -18.475 -12.972 1.323 1.00 0.00 C ATOM 1113 C ASP A 72 -18.609 -13.053 2.837 1.00 0.00 C ATOM 1114 O ASP A 72 -17.614 -13.145 3.558 1.00 0.00 O ATOM 1115 CB ASP A 72 -18.764 -14.339 0.693 1.00 0.00 C ATOM 1116 CG ASP A 72 -17.887 -15.449 1.243 1.00 0.00 C ATOM 1117 OD1 ASP A 72 -16.653 -15.395 1.052 1.00 0.00 O ATOM 1118 OD2 ASP A 72 -18.433 -16.388 1.862 1.00 0.00 O ATOM 0 H ASP A 72 -16.464 -13.247 0.802 1.00 0.00 H new ATOM 0 HA ASP A 72 -19.205 -12.250 0.958 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -19.810 -14.595 0.860 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -18.621 -14.272 -0.385 1.00 0.00 H new ATOM 1123 N LYS A 73 -19.846 -12.995 3.311 1.00 0.00 N ATOM 1124 CA LYS A 73 -20.132 -13.075 4.735 1.00 0.00 C ATOM 1125 C LYS A 73 -20.475 -14.510 5.127 1.00 0.00 C ATOM 1126 O LYS A 73 -20.686 -15.364 4.266 1.00 0.00 O ATOM 1127 CB LYS A 73 -21.300 -12.147 5.097 1.00 0.00 C ATOM 1128 CG LYS A 73 -21.089 -10.693 4.700 1.00 0.00 C ATOM 1129 CD LYS A 73 -19.976 -10.035 5.502 1.00 0.00 C ATOM 1130 CE LYS A 73 -19.766 -8.592 5.067 1.00 0.00 C ATOM 1131 NZ LYS A 73 -18.723 -7.907 5.874 1.00 0.00 N ATOM 0 H LYS A 73 -20.673 -12.892 2.723 1.00 0.00 H new ATOM 0 HA LYS A 73 -19.244 -12.759 5.282 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -22.205 -12.516 4.614 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -21.469 -12.197 6.173 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -20.850 -10.639 3.638 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -22.017 -10.140 4.847 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -20.221 -10.066 6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -19.050 -10.595 5.372 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -19.482 -8.569 4.015 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -20.706 -8.048 5.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -18.615 -6.927 5.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -19.005 -7.904 6.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -17.818 -8.410 5.771 1.00 0.00 H new ATOM 1145 N ALA A 74 -20.531 -14.776 6.422 1.00 0.00 N ATOM 1146 CA ALA A 74 -20.904 -16.096 6.904 1.00 0.00 C ATOM 1147 C ALA A 74 -22.197 -16.021 7.699 1.00 0.00 C ATOM 1148 O ALA A 74 -22.195 -15.658 8.875 1.00 0.00 O ATOM 1149 CB ALA A 74 -19.787 -16.693 7.747 1.00 0.00 C ATOM 0 H ALA A 74 -20.324 -14.098 7.156 1.00 0.00 H new ATOM 0 HA ALA A 74 -21.065 -16.747 6.045 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -20.085 -17.681 8.099 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -18.883 -16.780 7.144 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -19.592 -16.047 8.603 1.00 0.00 H new ATOM 1155 N HIS A 75 -23.306 -16.345 7.052 1.00 0.00 N ATOM 1156 CA HIS A 75 -24.604 -16.287 7.704 1.00 0.00 C ATOM 1157 C HIS A 75 -24.938 -17.643 8.307 1.00 0.00 C ATOM 1158 O HIS A 75 -25.732 -18.405 7.755 1.00 0.00 O ATOM 1159 CB HIS A 75 -25.688 -15.854 6.711 1.00 0.00 C ATOM 1160 CG HIS A 75 -26.998 -15.517 7.355 1.00 0.00 C ATOM 1161 ND1 HIS A 75 -28.193 -16.102 6.994 1.00 0.00 N ATOM 1162 CD2 HIS A 75 -27.294 -14.636 8.336 1.00 0.00 C ATOM 1163 CE1 HIS A 75 -29.164 -15.594 7.725 1.00 0.00 C ATOM 1164 NE2 HIS A 75 -28.645 -14.704 8.544 1.00 0.00 N ATOM 0 H HIS A 75 -23.333 -16.650 6.079 1.00 0.00 H new ATOM 0 HA HIS A 75 -24.565 -15.547 8.503 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -25.333 -14.986 6.155 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -25.845 -16.654 5.987 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -26.596 -13.998 8.858 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -30.208 -15.862 7.663 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -29.167 -14.153 9.225 1.00 0.00 H new ATOM 1173 N LEU A 76 -24.295 -17.950 9.423 1.00 0.00 N ATOM 1174 CA LEU A 76 -24.480 -19.233 10.087 1.00 0.00 C ATOM 1175 C LEU A 76 -25.683 -19.190 11.018 1.00 0.00 C ATOM 1176 O LEU A 76 -25.665 -18.502 12.042 1.00 0.00 O ATOM 1177 CB LEU A 76 -23.226 -19.608 10.883 1.00 0.00 C ATOM 1178 CG LEU A 76 -21.940 -19.734 10.063 1.00 0.00 C ATOM 1179 CD1 LEU A 76 -20.763 -20.052 10.969 1.00 0.00 C ATOM 1180 CD2 LEU A 76 -22.093 -20.802 8.994 1.00 0.00 C ATOM 0 H LEU A 76 -23.637 -17.326 9.890 1.00 0.00 H new ATOM 0 HA LEU A 76 -24.656 -19.987 9.320 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -23.070 -18.857 11.658 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -23.408 -20.556 11.389 1.00 0.00 H new ATOM 0 HG LEU A 76 -21.749 -18.780 9.571 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -19.856 -20.138 10.371 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -20.640 -19.253 11.700 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -20.947 -20.993 11.487 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -21.169 -20.878 8.421 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -22.307 -21.761 9.466 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -22.913 -20.535 8.327 1.00 0.00 H new ATOM 1192 N GLU A 77 -26.723 -19.923 10.659 1.00 0.00 N ATOM 1193 CA GLU A 77 -27.924 -19.985 11.474 1.00 0.00 C ATOM 1194 C GLU A 77 -27.782 -21.078 12.520 1.00 0.00 C ATOM 1195 O GLU A 77 -27.181 -22.122 12.261 1.00 0.00 O ATOM 1196 CB GLU A 77 -29.145 -20.280 10.612 1.00 0.00 C ATOM 1197 CG GLU A 77 -29.293 -19.365 9.413 1.00 0.00 C ATOM 1198 CD GLU A 77 -30.453 -19.769 8.534 1.00 0.00 C ATOM 1199 OE1 GLU A 77 -30.599 -20.976 8.252 1.00 0.00 O ATOM 1200 OE2 GLU A 77 -31.231 -18.887 8.125 1.00 0.00 O ATOM 0 H GLU A 77 -26.760 -20.484 9.808 1.00 0.00 H new ATOM 0 HA GLU A 77 -28.056 -19.019 11.961 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -29.090 -21.311 10.264 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -30.040 -20.200 11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -29.437 -18.340 9.755 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -28.373 -19.381 8.829 1.00 0.00 H new ATOM 1207 N HIS A 78 -28.331 -20.846 13.695 1.00 0.00 N ATOM 1208 CA HIS A 78 -28.326 -21.857 14.741 1.00 0.00 C ATOM 1209 C HIS A 78 -29.720 -21.989 15.323 1.00 0.00 C ATOM 1210 O HIS A 78 -30.449 -22.928 15.005 1.00 0.00 O ATOM 1211 CB HIS A 78 -27.307 -21.514 15.835 1.00 0.00 C ATOM 1212 CG HIS A 78 -25.889 -21.493 15.348 1.00 0.00 C ATOM 1213 ND1 HIS A 78 -25.082 -20.379 15.426 1.00 0.00 N ATOM 1214 CD2 HIS A 78 -25.137 -22.458 14.765 1.00 0.00 C ATOM 1215 CE1 HIS A 78 -23.901 -20.657 14.910 1.00 0.00 C ATOM 1216 NE2 HIS A 78 -23.907 -21.910 14.502 1.00 0.00 N ATOM 0 H HIS A 78 -28.786 -19.970 13.952 1.00 0.00 H new ATOM 0 HA HIS A 78 -28.029 -22.812 14.307 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -27.552 -20.539 16.256 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -27.395 -22.241 16.642 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -25.448 -23.469 14.548 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -23.069 -19.973 14.834 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -23.124 -22.394 14.062 1.00 0.00 H new ATOM 1225 N HIS A 79 -30.097 -21.038 16.158 1.00 0.00 N ATOM 1226 CA HIS A 79 -31.455 -20.973 16.671 1.00 0.00 C ATOM 1227 C HIS A 79 -32.188 -19.820 16.007 1.00 0.00 C ATOM 1228 O HIS A 79 -33.410 -19.824 15.889 1.00 0.00 O ATOM 1229 CB HIS A 79 -31.469 -20.781 18.188 1.00 0.00 C ATOM 1230 CG HIS A 79 -30.808 -21.882 18.956 1.00 0.00 C ATOM 1231 ND1 HIS A 79 -29.954 -21.649 20.009 1.00 0.00 N ATOM 1232 CD2 HIS A 79 -30.899 -23.226 18.837 1.00 0.00 C ATOM 1233 CE1 HIS A 79 -29.547 -22.799 20.505 1.00 0.00 C ATOM 1234 NE2 HIS A 79 -30.106 -23.776 19.814 1.00 0.00 N ATOM 0 H HIS A 79 -29.481 -20.298 16.496 1.00 0.00 H new ATOM 0 HA HIS A 79 -31.952 -21.916 16.444 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -30.975 -19.840 18.428 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -32.503 -20.692 18.521 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -31.486 -23.766 18.109 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -28.870 -22.923 21.337 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -29.971 -24.774 19.979 1.00 0.00 H new ATOM 1243 N HIS A 80 -31.426 -18.828 15.578 1.00 0.00 N ATOM 1244 CA HIS A 80 -31.992 -17.653 14.939 1.00 0.00 C ATOM 1245 C HIS A 80 -31.559 -17.559 13.485 1.00 0.00 C ATOM 1246 O HIS A 80 -30.485 -18.038 13.111 1.00 0.00 O ATOM 1247 CB HIS A 80 -31.575 -16.383 15.687 1.00 0.00 C ATOM 1248 CG HIS A 80 -32.301 -16.179 16.981 1.00 0.00 C ATOM 1249 ND1 HIS A 80 -33.080 -15.075 17.236 1.00 0.00 N ATOM 1250 CD2 HIS A 80 -32.370 -16.948 18.094 1.00 0.00 C ATOM 1251 CE1 HIS A 80 -33.600 -15.173 18.443 1.00 0.00 C ATOM 1252 NE2 HIS A 80 -33.185 -16.301 18.986 1.00 0.00 N ATOM 0 H HIS A 80 -30.410 -18.814 15.661 1.00 0.00 H new ATOM 0 HA HIS A 80 -33.077 -17.747 14.971 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -30.504 -16.424 15.884 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -31.748 -15.520 15.044 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -31.875 -17.895 18.250 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -34.255 -14.452 18.909 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -33.430 -16.637 19.917 1.00 0.00 H new ATOM 1261 N HIS A 81 -32.414 -16.954 12.676 1.00 0.00 N ATOM 1262 CA HIS A 81 -32.104 -16.671 11.283 1.00 0.00 C ATOM 1263 C HIS A 81 -31.396 -15.327 11.194 1.00 0.00 C ATOM 1264 O HIS A 81 -30.264 -15.249 10.729 1.00 0.00 O ATOM 1265 CB HIS A 81 -33.397 -16.674 10.448 1.00 0.00 C ATOM 1266 CG HIS A 81 -33.264 -16.118 9.057 1.00 0.00 C ATOM 1267 ND1 HIS A 81 -32.671 -16.796 8.018 1.00 0.00 N ATOM 1268 CD2 HIS A 81 -33.684 -14.939 8.537 1.00 0.00 C ATOM 1269 CE1 HIS A 81 -32.733 -16.065 6.922 1.00 0.00 C ATOM 1270 NE2 HIS A 81 -33.343 -14.933 7.208 1.00 0.00 N ATOM 0 H HIS A 81 -33.342 -16.645 12.966 1.00 0.00 H new ATOM 0 HA HIS A 81 -31.445 -17.441 10.883 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -33.763 -17.698 10.379 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -34.155 -16.100 10.980 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -32.248 -17.722 8.085 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -34.193 -14.150 9.070 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -32.348 -16.347 5.953 1.00 0.00 H new ATOM 1279 N HIS A 82 -32.077 -14.283 11.671 1.00 0.00 N ATOM 1280 CA HIS A 82 -31.526 -12.925 11.718 1.00 0.00 C ATOM 1281 C HIS A 82 -31.098 -12.429 10.333 1.00 0.00 C ATOM 1282 O HIS A 82 -30.025 -12.770 9.839 1.00 0.00 O ATOM 1283 CB HIS A 82 -30.345 -12.855 12.697 1.00 0.00 C ATOM 1284 CG HIS A 82 -29.734 -11.490 12.801 1.00 0.00 C ATOM 1285 ND1 HIS A 82 -28.496 -11.181 12.283 1.00 0.00 N ATOM 1286 CD2 HIS A 82 -30.201 -10.346 13.358 1.00 0.00 C ATOM 1287 CE1 HIS A 82 -28.227 -9.913 12.515 1.00 0.00 C ATOM 1288 NE2 HIS A 82 -29.245 -9.379 13.164 1.00 0.00 N ATOM 0 H HIS A 82 -33.027 -14.354 12.036 1.00 0.00 H new ATOM 0 HA HIS A 82 -32.320 -12.267 12.071 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -30.683 -13.169 13.685 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -29.579 -13.564 12.382 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -31.148 -10.219 13.861 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -27.325 -9.396 12.223 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -29.311 -8.408 13.471 1.00 0.00 H new ATOM 1297 N HIS A 83 -31.939 -11.622 9.716 1.00 0.00 N ATOM 1298 CA HIS A 83 -31.620 -11.055 8.414 1.00 0.00 C ATOM 1299 C HIS A 83 -31.178 -9.606 8.571 1.00 0.00 C ATOM 1300 O HIS A 83 -32.053 -8.741 8.766 1.00 0.00 O ATOM 1301 CB HIS A 83 -32.827 -11.149 7.478 1.00 0.00 C ATOM 1302 CG HIS A 83 -32.548 -10.695 6.074 1.00 0.00 C ATOM 1303 ND1 HIS A 83 -31.580 -11.264 5.280 1.00 0.00 N ATOM 1304 CD2 HIS A 83 -33.130 -9.733 5.319 1.00 0.00 C ATOM 1305 CE1 HIS A 83 -31.577 -10.675 4.100 1.00 0.00 C ATOM 1306 NE2 HIS A 83 -32.509 -9.742 4.094 1.00 0.00 N ATOM 1307 OXT HIS A 83 -29.959 -9.343 8.506 1.00 0.00 O ATOM 0 H HIS A 83 -32.846 -11.343 10.091 1.00 0.00 H new ATOM 0 HA HIS A 83 -30.802 -11.625 7.974 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -33.175 -12.182 7.453 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -33.639 -10.549 7.888 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -33.934 -9.079 5.624 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -30.921 -10.916 3.277 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -32.732 -9.129 3.310 1.00 0.00 H new TER 1316 HIS A 83 ATOM 1317 N MET B 1 11.470 -6.075 -22.448 1.00 0.00 N ATOM 1318 CA MET B 1 11.631 -5.587 -21.059 1.00 0.00 C ATOM 1319 C MET B 1 10.309 -5.022 -20.549 1.00 0.00 C ATOM 1320 O MET B 1 9.619 -4.315 -21.283 1.00 0.00 O ATOM 1321 CB MET B 1 12.727 -4.517 -21.007 1.00 0.00 C ATOM 1322 CG MET B 1 13.033 -4.013 -19.606 1.00 0.00 C ATOM 1323 SD MET B 1 14.387 -2.825 -19.576 1.00 0.00 S ATOM 1324 CE MET B 1 15.745 -3.840 -20.155 1.00 0.00 C ATOM 0 H1 MET B 1 11.471 -7.115 -22.453 1.00 0.00 H new ATOM 0 H2 MET B 1 10.570 -5.728 -22.836 1.00 0.00 H new ATOM 0 H3 MET B 1 12.256 -5.725 -23.032 1.00 0.00 H new ATOM 0 HA MET B 1 11.924 -6.419 -20.418 1.00 0.00 H new ATOM 0 HB2 MET B 1 13.639 -4.924 -21.443 1.00 0.00 H new ATOM 0 HB3 MET B 1 12.426 -3.673 -21.628 1.00 0.00 H new ATOM 0 HG2 MET B 1 12.139 -3.550 -19.187 1.00 0.00 H new ATOM 0 HG3 MET B 1 13.283 -4.859 -18.966 1.00 0.00 H new ATOM 0 HE1 MET B 1 16.690 -3.392 -19.849 1.00 0.00 H new ATOM 0 HE2 MET B 1 15.661 -4.839 -19.727 1.00 0.00 H new ATOM 0 HE3 MET B 1 15.711 -3.908 -21.242 1.00 0.00 H new ATOM 1336 N PRO B 2 9.931 -5.342 -19.293 1.00 0.00 N ATOM 1337 CA PRO B 2 8.666 -4.892 -18.690 1.00 0.00 C ATOM 1338 C PRO B 2 8.388 -3.404 -18.910 1.00 0.00 C ATOM 1339 O PRO B 2 7.476 -3.051 -19.661 1.00 0.00 O ATOM 1340 CB PRO B 2 8.863 -5.190 -17.205 1.00 0.00 C ATOM 1341 CG PRO B 2 9.783 -6.360 -17.182 1.00 0.00 C ATOM 1342 CD PRO B 2 10.702 -6.194 -18.363 1.00 0.00 C ATOM 0 HA PRO B 2 7.807 -5.394 -19.136 1.00 0.00 H new ATOM 0 HB2 PRO B 2 9.293 -4.336 -16.682 1.00 0.00 H new ATOM 0 HB3 PRO B 2 7.916 -5.419 -16.717 1.00 0.00 H new ATOM 0 HG2 PRO B 2 10.348 -6.393 -16.250 1.00 0.00 H new ATOM 0 HG3 PRO B 2 9.226 -7.295 -17.250 1.00 0.00 H new ATOM 0 HD2 PRO B 2 11.642 -5.723 -18.075 1.00 0.00 H new ATOM 0 HD3 PRO B 2 10.951 -7.155 -18.814 1.00 0.00 H new ATOM 1350 N GLN B 3 9.183 -2.549 -18.252 1.00 0.00 N ATOM 1351 CA GLN B 3 9.064 -1.086 -18.371 1.00 0.00 C ATOM 1352 C GLN B 3 7.793 -0.555 -17.693 1.00 0.00 C ATOM 1353 O GLN B 3 7.861 0.365 -16.879 1.00 0.00 O ATOM 1354 CB GLN B 3 9.111 -0.651 -19.843 1.00 0.00 C ATOM 1355 CG GLN B 3 10.474 -0.835 -20.493 1.00 0.00 C ATOM 1356 CD GLN B 3 11.499 0.169 -19.997 1.00 0.00 C ATOM 1357 OE1 GLN B 3 11.157 1.296 -19.640 1.00 0.00 O ATOM 1358 NE2 GLN B 3 12.763 -0.222 -19.982 1.00 0.00 N ATOM 0 H GLN B 3 9.927 -2.850 -17.622 1.00 0.00 H new ATOM 0 HA GLN B 3 9.918 -0.652 -17.851 1.00 0.00 H new ATOM 0 HB2 GLN B 3 8.371 -1.221 -20.405 1.00 0.00 H new ATOM 0 HB3 GLN B 3 8.824 0.398 -19.912 1.00 0.00 H new ATOM 0 HG2 GLN B 3 10.834 -1.844 -20.294 1.00 0.00 H new ATOM 0 HG3 GLN B 3 10.372 -0.741 -21.574 1.00 0.00 H new ATOM 0 HE21 GLN B 3 13.009 -1.164 -20.285 1.00 0.00 H new ATOM 0 HE22 GLN B 3 13.491 0.419 -19.667 1.00 0.00 H new ATOM 1367 N ILE B 4 6.651 -1.148 -18.034 1.00 0.00 N ATOM 1368 CA ILE B 4 5.350 -0.763 -17.485 1.00 0.00 C ATOM 1369 C ILE B 4 4.899 0.591 -18.029 1.00 0.00 C ATOM 1370 O ILE B 4 4.050 0.657 -18.919 1.00 0.00 O ATOM 1371 CB ILE B 4 5.349 -0.729 -15.934 1.00 0.00 C ATOM 1372 CG1 ILE B 4 5.791 -2.083 -15.369 1.00 0.00 C ATOM 1373 CG2 ILE B 4 3.967 -0.362 -15.407 1.00 0.00 C ATOM 1374 CD1 ILE B 4 5.937 -2.094 -13.861 1.00 0.00 C ATOM 0 H ILE B 4 6.601 -1.915 -18.704 1.00 0.00 H new ATOM 0 HA ILE B 4 4.645 -1.530 -17.804 1.00 0.00 H new ATOM 0 HB ILE B 4 6.057 0.033 -15.607 1.00 0.00 H new ATOM 0 HG12 ILE B 4 5.066 -2.843 -15.661 1.00 0.00 H new ATOM 0 HG13 ILE B 4 6.744 -2.362 -15.820 1.00 0.00 H new ATOM 0 HG21 ILE B 4 3.986 -0.343 -14.317 1.00 0.00 H new ATOM 0 HG22 ILE B 4 3.684 0.622 -15.782 1.00 0.00 H new ATOM 0 HG23 ILE B 4 3.241 -1.102 -15.744 1.00 0.00 H new ATOM 0 HD11 ILE B 4 6.252 -3.085 -13.533 1.00 0.00 H new ATOM 0 HD12 ILE B 4 6.684 -1.358 -13.562 1.00 0.00 H new ATOM 0 HD13 ILE B 4 4.980 -1.847 -13.401 1.00 0.00 H new ATOM 1386 N SER B 5 5.474 1.665 -17.509 1.00 0.00 N ATOM 1387 CA SER B 5 5.096 3.010 -17.910 1.00 0.00 C ATOM 1388 C SER B 5 6.229 3.991 -17.633 1.00 0.00 C ATOM 1389 O SER B 5 7.094 3.734 -16.796 1.00 0.00 O ATOM 1390 CB SER B 5 3.831 3.451 -17.166 1.00 0.00 C ATOM 1391 OG SER B 5 2.726 2.622 -17.490 1.00 0.00 O ATOM 0 H SER B 5 6.209 1.629 -16.803 1.00 0.00 H new ATOM 0 HA SER B 5 4.894 3.003 -18.981 1.00 0.00 H new ATOM 0 HB2 SER B 5 4.009 3.419 -16.091 1.00 0.00 H new ATOM 0 HB3 SER B 5 3.599 4.485 -17.420 1.00 0.00 H new ATOM 0 HG SER B 5 1.934 2.926 -17.000 1.00 0.00 H new ATOM 1397 N ARG B 6 6.222 5.108 -18.347 1.00 0.00 N ATOM 1398 CA ARG B 6 7.209 6.158 -18.136 1.00 0.00 C ATOM 1399 C ARG B 6 6.568 7.356 -17.453 1.00 0.00 C ATOM 1400 O ARG B 6 6.872 7.667 -16.300 1.00 0.00 O ATOM 1401 CB ARG B 6 7.820 6.606 -19.465 1.00 0.00 C ATOM 1402 CG ARG B 6 8.702 5.571 -20.141 1.00 0.00 C ATOM 1403 CD ARG B 6 9.247 6.114 -21.452 1.00 0.00 C ATOM 1404 NE ARG B 6 10.211 5.215 -22.082 1.00 0.00 N ATOM 1405 CZ ARG B 6 11.104 5.602 -22.991 1.00 0.00 C ATOM 1406 NH1 ARG B 6 11.150 6.870 -23.385 1.00 0.00 N ATOM 1407 NH2 ARG B 6 11.946 4.716 -23.507 1.00 0.00 N ATOM 0 H ARG B 6 5.542 5.311 -19.079 1.00 0.00 H new ATOM 0 HA ARG B 6 7.997 5.753 -17.501 1.00 0.00 H new ATOM 0 HB2 ARG B 6 7.014 6.877 -20.147 1.00 0.00 H new ATOM 0 HB3 ARG B 6 8.408 7.507 -19.293 1.00 0.00 H new ATOM 0 HG2 ARG B 6 9.526 5.300 -19.482 1.00 0.00 H new ATOM 0 HG3 ARG B 6 8.130 4.662 -20.326 1.00 0.00 H new ATOM 0 HD2 ARG B 6 8.419 6.290 -22.139 1.00 0.00 H new ATOM 0 HD3 ARG B 6 9.722 7.078 -21.271 1.00 0.00 H new ATOM 0 HE ARG B 6 10.199 4.232 -21.809 1.00 0.00 H new ATOM 0 HH11 ARG B 6 10.500 7.550 -22.991 1.00 0.00 H new ATOM 0 HH12 ARG B 6 11.835 7.163 -24.081 1.00 0.00 H new ATOM 0 HH21 ARG B 6 11.908 3.742 -23.207 1.00 0.00 H new ATOM 0 HH22 ARG B 6 12.631 5.009 -24.203 1.00 0.00 H new ATOM 1421 N TYR B 7 5.667 8.007 -18.189 1.00 0.00 N ATOM 1422 CA TYR B 7 5.007 9.235 -17.749 1.00 0.00 C ATOM 1423 C TYR B 7 6.013 10.364 -17.560 1.00 0.00 C ATOM 1424 O TYR B 7 7.218 10.185 -17.749 1.00 0.00 O ATOM 1425 CB TYR B 7 4.209 9.014 -16.456 1.00 0.00 C ATOM 1426 CG TYR B 7 2.984 8.148 -16.636 1.00 0.00 C ATOM 1427 CD1 TYR B 7 1.935 8.565 -17.445 1.00 0.00 C ATOM 1428 CD2 TYR B 7 2.876 6.917 -16.005 1.00 0.00 C ATOM 1429 CE1 TYR B 7 0.812 7.782 -17.615 1.00 0.00 C ATOM 1430 CE2 TYR B 7 1.754 6.127 -16.170 1.00 0.00 C ATOM 1431 CZ TYR B 7 0.727 6.562 -16.979 1.00 0.00 C ATOM 1432 OH TYR B 7 -0.388 5.776 -17.155 1.00 0.00 O ATOM 0 H TYR B 7 5.373 7.694 -19.114 1.00 0.00 H new ATOM 0 HA TYR B 7 4.308 9.522 -18.535 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.860 8.556 -15.712 1.00 0.00 H new ATOM 0 HB3 TYR B 7 3.903 9.982 -16.059 1.00 0.00 H new ATOM 0 HD1 TYR B 7 1.999 9.518 -17.949 1.00 0.00 H new ATOM 0 HD2 TYR B 7 3.682 6.571 -15.375 1.00 0.00 H new ATOM 0 HE1 TYR B 7 0.003 8.123 -18.244 1.00 0.00 H new ATOM 0 HE2 TYR B 7 1.683 5.174 -15.667 1.00 0.00 H new ATOM 0 HH TYR B 7 -0.290 4.949 -16.639 1.00 0.00 H new ATOM 1442 N SER B 8 5.508 11.537 -17.225 1.00 0.00 N ATOM 1443 CA SER B 8 6.364 12.656 -16.896 1.00 0.00 C ATOM 1444 C SER B 8 6.805 12.545 -15.443 1.00 0.00 C ATOM 1445 O SER B 8 5.968 12.497 -14.536 1.00 0.00 O ATOM 1446 CB SER B 8 5.626 13.973 -17.138 1.00 0.00 C ATOM 1447 OG SER B 8 5.104 14.024 -18.456 1.00 0.00 O ATOM 0 H SER B 8 4.509 11.737 -17.174 1.00 0.00 H new ATOM 0 HA SER B 8 7.246 12.639 -17.536 1.00 0.00 H new ATOM 0 HB2 SER B 8 4.815 14.079 -16.417 1.00 0.00 H new ATOM 0 HB3 SER B 8 6.305 14.810 -16.979 1.00 0.00 H new ATOM 0 HG SER B 8 4.634 14.874 -18.589 1.00 0.00 H new ATOM 1453 N ASP B 9 8.115 12.487 -15.238 1.00 0.00 N ATOM 1454 CA ASP B 9 8.691 12.344 -13.901 1.00 0.00 C ATOM 1455 C ASP B 9 8.204 13.456 -12.994 1.00 0.00 C ATOM 1456 O ASP B 9 7.976 13.251 -11.803 1.00 0.00 O ATOM 1457 CB ASP B 9 10.221 12.382 -13.960 1.00 0.00 C ATOM 1458 CG ASP B 9 10.806 11.335 -14.879 1.00 0.00 C ATOM 1459 OD1 ASP B 9 10.745 10.135 -14.540 1.00 0.00 O ATOM 1460 OD2 ASP B 9 11.346 11.713 -15.942 1.00 0.00 O ATOM 0 H ASP B 9 8.806 12.537 -15.986 1.00 0.00 H new ATOM 0 HA ASP B 9 8.372 11.381 -13.503 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.541 13.369 -14.294 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.621 12.240 -12.956 1.00 0.00 H new ATOM 1465 N GLU B 10 8.027 14.629 -13.583 1.00 0.00 N ATOM 1466 CA GLU B 10 7.586 15.814 -12.863 1.00 0.00 C ATOM 1467 C GLU B 10 6.222 15.578 -12.223 1.00 0.00 C ATOM 1468 O GLU B 10 5.976 15.998 -11.091 1.00 0.00 O ATOM 1469 CB GLU B 10 7.514 17.022 -13.809 1.00 0.00 C ATOM 1470 CG GLU B 10 8.829 17.365 -14.505 1.00 0.00 C ATOM 1471 CD GLU B 10 9.292 16.289 -15.473 1.00 0.00 C ATOM 1472 OE1 GLU B 10 8.473 15.824 -16.291 1.00 0.00 O ATOM 1473 OE2 GLU B 10 10.466 15.880 -15.396 1.00 0.00 O ATOM 0 H GLU B 10 8.186 14.786 -14.578 1.00 0.00 H new ATOM 0 HA GLU B 10 8.312 16.022 -12.077 1.00 0.00 H new ATOM 0 HB2 GLU B 10 6.757 16.827 -14.568 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.181 17.891 -13.242 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.713 18.305 -15.045 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.601 17.524 -13.752 1.00 0.00 H new ATOM 1480 N GLN B 11 5.349 14.883 -12.946 1.00 0.00 N ATOM 1481 CA GLN B 11 4.004 14.603 -12.461 1.00 0.00 C ATOM 1482 C GLN B 11 4.048 13.609 -11.309 1.00 0.00 C ATOM 1483 O GLN B 11 3.436 13.832 -10.267 1.00 0.00 O ATOM 1484 CB GLN B 11 3.123 14.055 -13.588 1.00 0.00 C ATOM 1485 CG GLN B 11 1.700 13.741 -13.146 1.00 0.00 C ATOM 1486 CD GLN B 11 0.842 13.168 -14.258 1.00 0.00 C ATOM 1487 OE1 GLN B 11 1.459 12.435 -15.174 1.00 0.00 O flip ATOM 1488 NE2 GLN B 11 -0.370 13.378 -14.291 1.00 0.00 N flip ATOM 0 H GLN B 11 5.551 14.503 -13.871 1.00 0.00 H new ATOM 0 HA GLN B 11 3.573 15.539 -12.105 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.091 14.781 -14.400 1.00 0.00 H new ATOM 0 HB3 GLN B 11 3.579 13.150 -13.988 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.731 13.033 -12.318 1.00 0.00 H new ATOM 0 HG3 GLN B 11 1.234 14.651 -12.769 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.809 13.948 -13.568 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.936 12.982 -15.042 1.00 0.00 H new ATOM 1497 N VAL B 12 4.785 12.517 -11.502 1.00 0.00 N ATOM 1498 CA VAL B 12 4.927 11.493 -10.472 1.00 0.00 C ATOM 1499 C VAL B 12 5.552 12.098 -9.220 1.00 0.00 C ATOM 1500 O VAL B 12 5.130 11.818 -8.095 1.00 0.00 O ATOM 1501 CB VAL B 12 5.803 10.318 -10.966 1.00 0.00 C ATOM 1502 CG1 VAL B 12 5.914 9.233 -9.902 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.248 9.741 -12.261 1.00 0.00 C ATOM 0 H VAL B 12 5.293 12.319 -12.364 1.00 0.00 H new ATOM 0 HA VAL B 12 3.933 11.110 -10.241 1.00 0.00 H new ATOM 0 HB VAL B 12 6.803 10.704 -11.161 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.535 8.419 -10.276 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.366 9.651 -9.002 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.920 8.852 -9.666 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.879 8.916 -12.591 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.234 9.378 -12.092 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.233 10.516 -13.028 1.00 0.00 H new ATOM 1513 N GLU B 13 6.548 12.945 -9.437 1.00 0.00 N ATOM 1514 CA GLU B 13 7.211 13.653 -8.358 1.00 0.00 C ATOM 1515 C GLU B 13 6.226 14.557 -7.624 1.00 0.00 C ATOM 1516 O GLU B 13 6.182 14.567 -6.395 1.00 0.00 O ATOM 1517 CB GLU B 13 8.367 14.477 -8.922 1.00 0.00 C ATOM 1518 CG GLU B 13 9.188 15.204 -7.873 1.00 0.00 C ATOM 1519 CD GLU B 13 10.289 16.029 -8.497 1.00 0.00 C ATOM 1520 OE1 GLU B 13 11.356 15.461 -8.814 1.00 0.00 O ATOM 1521 OE2 GLU B 13 10.081 17.243 -8.702 1.00 0.00 O ATOM 0 H GLU B 13 6.916 13.158 -10.364 1.00 0.00 H new ATOM 0 HA GLU B 13 7.601 12.926 -7.645 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.025 13.818 -9.488 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.967 15.208 -9.624 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.537 15.851 -7.286 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.622 14.479 -7.184 1.00 0.00 H new ATOM 1528 N GLN B 14 5.423 15.300 -8.386 1.00 0.00 N ATOM 1529 CA GLN B 14 4.444 16.209 -7.798 1.00 0.00 C ATOM 1530 C GLN B 14 3.408 15.427 -7.003 1.00 0.00 C ATOM 1531 O GLN B 14 3.004 15.843 -5.920 1.00 0.00 O ATOM 1532 CB GLN B 14 3.740 17.038 -8.875 1.00 0.00 C ATOM 1533 CG GLN B 14 2.912 18.180 -8.301 1.00 0.00 C ATOM 1534 CD GLN B 14 2.027 18.852 -9.331 1.00 0.00 C ATOM 1535 OE1 GLN B 14 0.933 19.440 -8.874 1.00 0.00 O flip ATOM 1536 NE2 GLN B 14 2.328 18.859 -10.524 1.00 0.00 N flip ATOM 0 H GLN B 14 5.432 15.289 -9.406 1.00 0.00 H new ATOM 0 HA GLN B 14 4.979 16.887 -7.133 1.00 0.00 H new ATOM 0 HB2 GLN B 14 4.486 17.445 -9.558 1.00 0.00 H new ATOM 0 HB3 GLN B 14 3.093 16.386 -9.462 1.00 0.00 H new ATOM 0 HG2 GLN B 14 2.290 17.798 -7.491 1.00 0.00 H new ATOM 0 HG3 GLN B 14 3.581 18.923 -7.866 1.00 0.00 H new ATOM 0 HE21 GLN B 14 3.180 18.394 -10.838 1.00 0.00 H new ATOM 0 HE22 GLN B 14 1.725 19.329 -11.199 1.00 0.00 H new ATOM 1545 N LEU B 15 2.979 14.293 -7.549 1.00 0.00 N ATOM 1546 CA LEU B 15 2.029 13.426 -6.864 1.00 0.00 C ATOM 1547 C LEU B 15 2.569 13.026 -5.500 1.00 0.00 C ATOM 1548 O LEU B 15 1.924 13.245 -4.478 1.00 0.00 O ATOM 1549 CB LEU B 15 1.740 12.171 -7.695 1.00 0.00 C ATOM 1550 CG LEU B 15 1.039 12.417 -9.031 1.00 0.00 C ATOM 1551 CD1 LEU B 15 0.832 11.110 -9.776 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -0.289 13.120 -8.815 1.00 0.00 C ATOM 0 H LEU B 15 3.275 13.954 -8.464 1.00 0.00 H new ATOM 0 HA LEU B 15 1.099 13.979 -6.733 1.00 0.00 H new ATOM 0 HB2 LEU B 15 2.682 11.658 -7.887 1.00 0.00 H new ATOM 0 HB3 LEU B 15 1.125 11.496 -7.100 1.00 0.00 H new ATOM 0 HG LEU B 15 1.676 13.061 -9.637 1.00 0.00 H new ATOM 0 HD11 LEU B 15 0.332 11.307 -10.724 1.00 0.00 H new ATOM 0 HD12 LEU B 15 1.798 10.642 -9.966 1.00 0.00 H new ATOM 0 HD13 LEU B 15 0.217 10.441 -9.173 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -0.773 13.287 -9.777 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.931 12.501 -8.188 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -0.118 14.078 -8.324 1.00 0.00 H new ATOM 1564 N LEU B 16 3.771 12.462 -5.499 1.00 0.00 N ATOM 1565 CA LEU B 16 4.424 12.032 -4.270 1.00 0.00 C ATOM 1566 C LEU B 16 4.592 13.204 -3.304 1.00 0.00 C ATOM 1567 O LEU B 16 4.233 13.107 -2.130 1.00 0.00 O ATOM 1568 CB LEU B 16 5.790 11.418 -4.589 1.00 0.00 C ATOM 1569 CG LEU B 16 6.591 10.928 -3.380 1.00 0.00 C ATOM 1570 CD1 LEU B 16 5.841 9.822 -2.652 1.00 0.00 C ATOM 1571 CD2 LEU B 16 7.967 10.447 -3.818 1.00 0.00 C ATOM 0 H LEU B 16 4.317 12.291 -6.344 1.00 0.00 H new ATOM 0 HA LEU B 16 3.795 11.281 -3.793 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.642 10.579 -5.269 1.00 0.00 H new ATOM 0 HB3 LEU B 16 6.386 12.159 -5.122 1.00 0.00 H new ATOM 0 HG LEU B 16 6.720 11.761 -2.689 1.00 0.00 H new ATOM 0 HD11 LEU B 16 6.427 9.487 -1.796 1.00 0.00 H new ATOM 0 HD12 LEU B 16 4.879 10.201 -2.307 1.00 0.00 H new ATOM 0 HD13 LEU B 16 5.679 8.984 -3.331 1.00 0.00 H new ATOM 0 HD21 LEU B 16 8.526 10.101 -2.948 1.00 0.00 H new ATOM 0 HD22 LEU B 16 7.857 9.627 -4.528 1.00 0.00 H new ATOM 0 HD23 LEU B 16 8.505 11.268 -4.292 1.00 0.00 H new ATOM 1583 N ALA B 17 5.119 14.311 -3.814 1.00 0.00 N ATOM 1584 CA ALA B 17 5.384 15.490 -2.998 1.00 0.00 C ATOM 1585 C ALA B 17 4.103 16.053 -2.389 1.00 0.00 C ATOM 1586 O ALA B 17 4.092 16.481 -1.233 1.00 0.00 O ATOM 1587 CB ALA B 17 6.086 16.555 -3.828 1.00 0.00 C ATOM 0 H ALA B 17 5.373 14.417 -4.796 1.00 0.00 H new ATOM 0 HA ALA B 17 6.035 15.188 -2.177 1.00 0.00 H new ATOM 0 HB1 ALA B 17 6.279 17.431 -3.208 1.00 0.00 H new ATOM 0 HB2 ALA B 17 7.031 16.160 -4.203 1.00 0.00 H new ATOM 0 HB3 ALA B 17 5.452 16.838 -4.668 1.00 0.00 H new ATOM 1593 N GLU B 18 3.025 16.045 -3.163 1.00 0.00 N ATOM 1594 CA GLU B 18 1.752 16.585 -2.705 1.00 0.00 C ATOM 1595 C GLU B 18 1.078 15.620 -1.730 1.00 0.00 C ATOM 1596 O GLU B 18 0.442 16.048 -0.768 1.00 0.00 O ATOM 1597 CB GLU B 18 0.838 16.889 -3.898 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.398 17.697 -3.534 1.00 0.00 C ATOM 1599 CD GLU B 18 -1.096 18.269 -4.752 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -0.692 19.353 -5.222 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -2.056 17.647 -5.247 1.00 0.00 O ATOM 0 H GLU B 18 3.007 15.670 -4.111 1.00 0.00 H new ATOM 0 HA GLU B 18 1.942 17.519 -2.177 1.00 0.00 H new ATOM 0 HB2 GLU B 18 1.408 17.434 -4.651 1.00 0.00 H new ATOM 0 HB3 GLU B 18 0.525 15.949 -4.353 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -1.094 17.063 -2.985 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.113 18.511 -2.867 1.00 0.00 H new ATOM 1608 N LEU B 19 1.236 14.320 -1.965 1.00 0.00 N ATOM 1609 CA LEU B 19 0.725 13.316 -1.036 1.00 0.00 C ATOM 1610 C LEU B 19 1.441 13.424 0.304 1.00 0.00 C ATOM 1611 O LEU B 19 0.810 13.416 1.362 1.00 0.00 O ATOM 1612 CB LEU B 19 0.890 11.905 -1.605 1.00 0.00 C ATOM 1613 CG LEU B 19 -0.018 11.565 -2.789 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.293 10.174 -3.316 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.483 11.663 -2.387 1.00 0.00 C ATOM 0 H LEU B 19 1.710 13.939 -2.784 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.339 13.503 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU B 19 1.927 11.775 -1.915 1.00 0.00 H new ATOM 0 HB3 LEU B 19 0.704 11.186 -0.808 1.00 0.00 H new ATOM 0 HG LEU B 19 0.171 12.288 -3.583 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -0.362 9.949 -4.158 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.332 10.133 -3.644 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.133 9.441 -2.525 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -2.112 11.418 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.685 10.964 -1.575 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.702 12.678 -2.055 1.00 0.00 H new ATOM 1627 N LEU B 20 2.764 13.542 0.250 1.00 0.00 N ATOM 1628 CA LEU B 20 3.563 13.731 1.455 1.00 0.00 C ATOM 1629 C LEU B 20 3.178 15.034 2.142 1.00 0.00 C ATOM 1630 O LEU B 20 3.163 15.119 3.369 1.00 0.00 O ATOM 1631 CB LEU B 20 5.057 13.745 1.120 1.00 0.00 C ATOM 1632 CG LEU B 20 5.608 12.444 0.532 1.00 0.00 C ATOM 1633 CD1 LEU B 20 7.075 12.607 0.160 1.00 0.00 C ATOM 1634 CD2 LEU B 20 5.435 11.296 1.517 1.00 0.00 C ATOM 0 H LEU B 20 3.305 13.510 -0.614 1.00 0.00 H new ATOM 0 HA LEU B 20 3.365 12.897 2.128 1.00 0.00 H new ATOM 0 HB2 LEU B 20 5.246 14.553 0.413 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.614 13.979 2.027 1.00 0.00 H new ATOM 0 HG LEU B 20 5.045 12.211 -0.372 1.00 0.00 H new ATOM 0 HD11 LEU B 20 7.451 11.672 -0.257 1.00 0.00 H new ATOM 0 HD12 LEU B 20 7.177 13.401 -0.580 1.00 0.00 H new ATOM 0 HD13 LEU B 20 7.650 12.865 1.050 1.00 0.00 H new ATOM 0 HD21 LEU B 20 5.833 10.380 1.081 1.00 0.00 H new ATOM 0 HD22 LEU B 20 5.972 11.523 2.438 1.00 0.00 H new ATOM 0 HD23 LEU B 20 4.376 11.163 1.738 1.00 0.00 H new ATOM 1646 N ASN B 21 2.854 16.040 1.334 1.00 0.00 N ATOM 1647 CA ASN B 21 2.417 17.336 1.841 1.00 0.00 C ATOM 1648 C ASN B 21 1.140 17.192 2.666 1.00 0.00 C ATOM 1649 O ASN B 21 0.963 17.881 3.666 1.00 0.00 O ATOM 1650 CB ASN B 21 2.203 18.311 0.676 1.00 0.00 C ATOM 1651 CG ASN B 21 1.612 19.641 1.104 1.00 0.00 C ATOM 1652 OD1 ASN B 21 0.399 19.844 1.043 1.00 0.00 O ATOM 1653 ND2 ASN B 21 2.461 20.553 1.546 1.00 0.00 N ATOM 0 H ASN B 21 2.887 15.980 0.316 1.00 0.00 H new ATOM 0 HA ASN B 21 3.194 17.735 2.493 1.00 0.00 H new ATOM 0 HB2 ASN B 21 3.158 18.489 0.181 1.00 0.00 H new ATOM 0 HB3 ASN B 21 1.544 17.849 -0.059 1.00 0.00 H new ATOM 0 HD21 ASN B 21 2.118 21.464 1.852 1.00 0.00 H new ATOM 0 HD22 ASN B 21 3.459 20.346 1.581 1.00 0.00 H new ATOM 1660 N VAL B 22 0.260 16.282 2.253 1.00 0.00 N ATOM 1661 CA VAL B 22 -0.958 16.000 3.007 1.00 0.00 C ATOM 1662 C VAL B 22 -0.614 15.432 4.382 1.00 0.00 C ATOM 1663 O VAL B 22 -1.138 15.884 5.404 1.00 0.00 O ATOM 1664 CB VAL B 22 -1.878 15.006 2.264 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -3.127 14.710 3.084 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.258 15.548 0.893 1.00 0.00 C ATOM 0 H VAL B 22 0.368 15.729 1.403 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.491 16.944 3.118 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.329 14.074 2.127 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.760 14.008 2.542 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -2.839 14.275 4.041 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.676 15.635 3.257 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -2.906 14.833 0.386 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.784 16.496 1.009 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.356 15.704 0.301 1.00 0.00 H new ATOM 1676 N LEU B 23 0.283 14.453 4.403 1.00 0.00 N ATOM 1677 CA LEU B 23 0.710 13.837 5.656 1.00 0.00 C ATOM 1678 C LEU B 23 1.440 14.843 6.537 1.00 0.00 C ATOM 1679 O LEU B 23 1.247 14.868 7.748 1.00 0.00 O ATOM 1680 CB LEU B 23 1.606 12.618 5.401 1.00 0.00 C ATOM 1681 CG LEU B 23 0.874 11.306 5.088 1.00 0.00 C ATOM 1682 CD1 LEU B 23 0.180 11.366 3.735 1.00 0.00 C ATOM 1683 CD2 LEU B 23 1.840 10.135 5.140 1.00 0.00 C ATOM 0 H LEU B 23 0.728 14.069 3.570 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.188 13.502 6.176 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.272 12.848 4.570 1.00 0.00 H new ATOM 0 HB3 LEU B 23 2.233 12.462 6.278 1.00 0.00 H new ATOM 0 HG LEU B 23 0.107 11.162 5.848 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -0.329 10.421 3.545 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.549 12.177 3.736 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.920 11.544 2.954 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.305 9.212 4.916 1.00 0.00 H new ATOM 0 HD22 LEU B 23 2.632 10.283 4.405 1.00 0.00 H new ATOM 0 HD23 LEU B 23 2.277 10.068 6.136 1.00 0.00 H new ATOM 1695 N GLU B 24 2.271 15.674 5.920 1.00 0.00 N ATOM 1696 CA GLU B 24 3.010 16.711 6.636 1.00 0.00 C ATOM 1697 C GLU B 24 2.056 17.778 7.175 1.00 0.00 C ATOM 1698 O GLU B 24 2.251 18.308 8.269 1.00 0.00 O ATOM 1699 CB GLU B 24 4.049 17.340 5.699 1.00 0.00 C ATOM 1700 CG GLU B 24 4.889 18.436 6.336 1.00 0.00 C ATOM 1701 CD GLU B 24 5.651 17.964 7.556 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.545 17.106 7.411 1.00 0.00 O ATOM 1703 OE2 GLU B 24 5.375 18.468 8.664 1.00 0.00 O ATOM 0 H GLU B 24 2.452 15.650 4.916 1.00 0.00 H new ATOM 0 HA GLU B 24 3.523 16.260 7.485 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.713 16.556 5.334 1.00 0.00 H new ATOM 0 HB3 GLU B 24 3.535 17.752 4.831 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.595 18.819 5.599 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.241 19.266 6.618 1.00 0.00 H new ATOM 1710 N LYS B 25 1.006 18.048 6.405 1.00 0.00 N ATOM 1711 CA LYS B 25 0.006 19.065 6.737 1.00 0.00 C ATOM 1712 C LYS B 25 -0.538 18.875 8.153 1.00 0.00 C ATOM 1713 O LYS B 25 -0.762 19.843 8.877 1.00 0.00 O ATOM 1714 CB LYS B 25 -1.149 18.986 5.732 1.00 0.00 C ATOM 1715 CG LYS B 25 -2.051 20.213 5.705 1.00 0.00 C ATOM 1716 CD LYS B 25 -3.333 19.951 4.924 1.00 0.00 C ATOM 1717 CE LYS B 25 -3.062 19.327 3.558 1.00 0.00 C ATOM 1718 NZ LYS B 25 -2.294 20.229 2.657 1.00 0.00 N ATOM 0 H LYS B 25 0.821 17.565 5.526 1.00 0.00 H new ATOM 0 HA LYS B 25 0.485 20.043 6.688 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -0.736 18.833 4.735 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.756 18.110 5.964 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.299 20.505 6.725 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.515 21.049 5.256 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -3.979 19.289 5.501 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -3.873 20.888 4.792 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -2.510 18.397 3.691 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.010 19.070 3.086 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -2.867 20.451 1.818 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -2.063 21.109 3.161 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -1.415 19.758 2.361 1.00 0.00 H new ATOM 1732 N HIS B 26 -0.746 17.621 8.542 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.326 17.314 9.847 1.00 0.00 C ATOM 1734 C HIS B 26 -0.342 16.526 10.706 1.00 0.00 C ATOM 1735 O HIS B 26 -0.621 16.243 11.870 1.00 0.00 O ATOM 1736 CB HIS B 26 -2.613 16.489 9.692 1.00 0.00 C ATOM 1737 CG HIS B 26 -3.624 17.079 8.753 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -4.667 17.874 9.166 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -3.746 16.971 7.410 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -5.388 18.227 8.118 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -4.851 17.693 7.039 1.00 0.00 N ATOM 0 H HIS B 26 -0.523 16.803 7.975 1.00 0.00 H new ATOM 0 HA HIS B 26 -1.556 18.263 10.332 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.349 15.491 9.341 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.073 16.370 10.673 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.093 16.418 6.751 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -6.270 18.849 8.141 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.200 17.799 6.086 1.00 0.00 H new ATOM 1750 N LYS B 27 0.807 16.192 10.120 1.00 0.00 N ATOM 1751 CA LYS B 27 1.760 15.251 10.713 1.00 0.00 C ATOM 1752 C LYS B 27 1.078 13.930 11.073 1.00 0.00 C ATOM 1753 O LYS B 27 0.528 13.762 12.165 1.00 0.00 O ATOM 1754 CB LYS B 27 2.493 15.840 11.928 1.00 0.00 C ATOM 1755 CG LYS B 27 3.292 14.794 12.700 1.00 0.00 C ATOM 1756 CD LYS B 27 4.400 15.395 13.547 1.00 0.00 C ATOM 1757 CE LYS B 27 5.610 15.759 12.702 1.00 0.00 C ATOM 1758 NZ LYS B 27 6.821 15.986 13.535 1.00 0.00 N ATOM 0 H LYS B 27 1.105 16.566 9.219 1.00 0.00 H new ATOM 0 HA LYS B 27 2.517 15.053 9.954 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.165 16.630 11.593 1.00 0.00 H new ATOM 0 HB3 LYS B 27 1.766 16.302 12.596 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.616 14.231 13.344 1.00 0.00 H new ATOM 0 HG3 LYS B 27 3.726 14.084 11.996 1.00 0.00 H new ATOM 0 HD2 LYS B 27 4.029 16.285 14.056 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.695 14.685 14.320 1.00 0.00 H new ATOM 0 HE2 LYS B 27 5.806 14.961 11.986 1.00 0.00 H new ATOM 0 HE3 LYS B 27 5.393 16.658 12.125 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 7.624 16.232 12.921 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 6.643 16.765 14.201 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 7.044 15.120 14.066 1.00 0.00 H new ATOM 1772 N ALA B 28 1.090 13.006 10.128 1.00 0.00 N ATOM 1773 CA ALA B 28 0.534 11.685 10.350 1.00 0.00 C ATOM 1774 C ALA B 28 1.652 10.682 10.598 1.00 0.00 C ATOM 1775 O ALA B 28 2.561 10.547 9.776 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.312 11.261 9.159 1.00 0.00 C ATOM 0 H ALA B 28 1.481 13.148 9.197 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.106 11.716 11.232 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.723 10.268 9.340 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.127 11.971 9.021 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.307 11.240 8.262 1.00 0.00 H new ATOM 1782 N PRO B 29 1.618 9.989 11.746 1.00 0.00 N ATOM 1783 CA PRO B 29 2.617 8.973 12.087 1.00 0.00 C ATOM 1784 C PRO B 29 2.632 7.826 11.081 1.00 0.00 C ATOM 1785 O PRO B 29 1.619 7.543 10.438 1.00 0.00 O ATOM 1786 CB PRO B 29 2.175 8.466 13.466 1.00 0.00 C ATOM 1787 CG PRO B 29 1.276 9.526 14.002 1.00 0.00 C ATOM 1788 CD PRO B 29 0.610 10.146 12.807 1.00 0.00 C ATOM 0 HA PRO B 29 3.627 9.382 12.080 1.00 0.00 H new ATOM 0 HB2 PRO B 29 1.655 7.512 13.386 1.00 0.00 H new ATOM 0 HB3 PRO B 29 3.032 8.308 14.121 1.00 0.00 H new ATOM 0 HG2 PRO B 29 0.538 9.104 14.685 1.00 0.00 H new ATOM 0 HG3 PRO B 29 1.841 10.270 14.564 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.322 9.639 12.556 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.366 11.194 12.980 1.00 0.00 H new ATOM 1796 N THR B 30 3.778 7.171 10.951 1.00 0.00 N ATOM 1797 CA THR B 30 3.936 6.069 10.010 1.00 0.00 C ATOM 1798 C THR B 30 2.939 4.950 10.306 1.00 0.00 C ATOM 1799 O THR B 30 2.364 4.360 9.388 1.00 0.00 O ATOM 1800 CB THR B 30 5.369 5.509 10.062 1.00 0.00 C ATOM 1801 OG1 THR B 30 6.306 6.587 9.947 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.606 4.501 8.943 1.00 0.00 C ATOM 0 H THR B 30 4.617 7.385 11.489 1.00 0.00 H new ATOM 0 HA THR B 30 3.742 6.458 9.011 1.00 0.00 H new ATOM 0 HB THR B 30 5.506 4.998 11.015 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.009 6.342 9.310 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.626 4.122 9.005 1.00 0.00 H new ATOM 0 HG22 THR B 30 4.905 3.673 9.045 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.457 4.986 7.978 1.00 0.00 H new ATOM 1810 N ASP B 31 2.728 4.679 11.592 1.00 0.00 N ATOM 1811 CA ASP B 31 1.770 3.663 12.024 1.00 0.00 C ATOM 1812 C ASP B 31 0.383 3.975 11.469 1.00 0.00 C ATOM 1813 O ASP B 31 -0.300 3.101 10.928 1.00 0.00 O ATOM 1814 CB ASP B 31 1.723 3.601 13.555 1.00 0.00 C ATOM 1815 CG ASP B 31 0.878 2.450 14.071 1.00 0.00 C ATOM 1816 OD1 ASP B 31 -0.350 2.610 14.190 1.00 0.00 O ATOM 1817 OD2 ASP B 31 1.446 1.377 14.376 1.00 0.00 O ATOM 0 H ASP B 31 3.210 5.151 12.357 1.00 0.00 H new ATOM 0 HA ASP B 31 2.090 2.694 11.641 1.00 0.00 H new ATOM 0 HB2 ASP B 31 2.737 3.503 13.942 1.00 0.00 H new ATOM 0 HB3 ASP B 31 1.325 4.540 13.940 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.006 5.242 11.574 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.286 5.704 11.056 1.00 0.00 C ATOM 1824 C LEU B 32 -1.285 5.704 9.530 1.00 0.00 C ATOM 1825 O LEU B 32 -2.273 5.332 8.902 1.00 0.00 O ATOM 1826 CB LEU B 32 -1.589 7.112 11.579 1.00 0.00 C ATOM 1827 CG LEU B 32 -2.817 7.790 10.963 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -4.089 7.029 11.306 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -2.912 9.232 11.429 1.00 0.00 C ATOM 0 H LEU B 32 0.553 5.971 12.017 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.062 5.020 11.400 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -1.728 7.058 12.659 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -0.718 7.743 11.400 1.00 0.00 H new ATOM 0 HG LEU B 32 -2.704 7.782 9.879 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.946 7.531 10.857 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.020 6.012 10.919 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.213 6.998 12.388 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.789 9.701 10.983 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.999 9.258 12.515 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.016 9.773 11.123 1.00 0.00 H new ATOM 1841 N SER B 33 -0.170 6.122 8.940 1.00 0.00 N ATOM 1842 CA SER B 33 -0.041 6.173 7.493 1.00 0.00 C ATOM 1843 C SER B 33 -0.266 4.791 6.884 1.00 0.00 C ATOM 1844 O SER B 33 -0.961 4.659 5.878 1.00 0.00 O ATOM 1845 CB SER B 33 1.334 6.715 7.094 1.00 0.00 C ATOM 1846 OG SER B 33 1.440 6.863 5.688 1.00 0.00 O ATOM 0 H SER B 33 0.659 6.431 9.447 1.00 0.00 H new ATOM 0 HA SER B 33 -0.804 6.848 7.106 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.502 7.678 7.577 1.00 0.00 H new ATOM 0 HB3 SER B 33 2.111 6.039 7.451 1.00 0.00 H new ATOM 0 HG SER B 33 2.327 7.212 5.462 1.00 0.00 H new ATOM 1852 N LEU B 34 0.312 3.764 7.502 1.00 0.00 N ATOM 1853 CA LEU B 34 0.131 2.395 7.036 1.00 0.00 C ATOM 1854 C LEU B 34 -1.323 1.963 7.193 1.00 0.00 C ATOM 1855 O LEU B 34 -1.867 1.259 6.343 1.00 0.00 O ATOM 1856 CB LEU B 34 1.051 1.443 7.803 1.00 0.00 C ATOM 1857 CG LEU B 34 2.550 1.704 7.625 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.363 0.721 8.449 1.00 0.00 C ATOM 1859 CD2 LEU B 34 2.939 1.614 6.158 1.00 0.00 C ATOM 0 H LEU B 34 0.908 3.855 8.325 1.00 0.00 H new ATOM 0 HA LEU B 34 0.392 2.356 5.978 1.00 0.00 H new ATOM 0 HB2 LEU B 34 0.810 1.506 8.864 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.836 0.422 7.488 1.00 0.00 H new ATOM 0 HG LEU B 34 2.765 2.713 7.977 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.425 0.921 8.310 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.108 0.831 9.503 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.140 -0.296 8.126 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.007 1.802 6.053 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.707 0.618 5.781 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.382 2.357 5.588 1.00 0.00 H new ATOM 1871 N MET B 35 -1.946 2.399 8.282 1.00 0.00 N ATOM 1872 CA MET B 35 -3.354 2.108 8.533 1.00 0.00 C ATOM 1873 C MET B 35 -4.236 2.734 7.449 1.00 0.00 C ATOM 1874 O MET B 35 -5.106 2.073 6.878 1.00 0.00 O ATOM 1875 CB MET B 35 -3.755 2.640 9.913 1.00 0.00 C ATOM 1876 CG MET B 35 -5.203 2.370 10.292 1.00 0.00 C ATOM 1877 SD MET B 35 -5.636 3.065 11.900 1.00 0.00 S ATOM 1878 CE MET B 35 -7.343 2.543 12.054 1.00 0.00 C ATOM 0 H MET B 35 -1.497 2.957 9.008 1.00 0.00 H new ATOM 0 HA MET B 35 -3.498 1.028 8.510 1.00 0.00 H new ATOM 0 HB2 MET B 35 -3.105 2.192 10.665 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.579 3.715 9.940 1.00 0.00 H new ATOM 0 HG2 MET B 35 -5.859 2.790 9.530 1.00 0.00 H new ATOM 0 HG3 MET B 35 -5.377 1.294 10.306 1.00 0.00 H new ATOM 0 HE1 MET B 35 -7.748 2.899 13.001 1.00 0.00 H new ATOM 0 HE2 MET B 35 -7.926 2.957 11.231 1.00 0.00 H new ATOM 0 HE3 MET B 35 -7.395 1.455 12.024 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.990 4.010 7.163 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.760 4.742 6.160 1.00 0.00 C ATOM 1890 C VAL B 36 -4.509 4.192 4.758 1.00 0.00 C ATOM 1891 O VAL B 36 -5.449 3.830 4.050 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.430 6.252 6.187 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.191 6.999 5.102 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -4.744 6.846 7.553 1.00 0.00 C ATOM 0 H VAL B 36 -3.260 4.561 7.614 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.813 4.608 6.409 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.363 6.363 5.994 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -4.939 8.059 5.145 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.917 6.600 4.125 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.263 6.874 5.257 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -4.505 7.909 7.551 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -5.803 6.713 7.773 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.149 6.342 8.315 1.00 0.00 H new ATOM 1904 N LEU B 37 -3.238 4.113 4.368 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.876 3.637 3.034 1.00 0.00 C ATOM 1906 C LEU B 37 -3.319 2.192 2.835 1.00 0.00 C ATOM 1907 O LEU B 37 -3.747 1.817 1.748 1.00 0.00 O ATOM 1908 CB LEU B 37 -1.367 3.757 2.800 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.823 5.188 2.774 1.00 0.00 C ATOM 1910 CD1 LEU B 37 0.688 5.179 2.599 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -1.482 5.991 1.663 1.00 0.00 C ATOM 0 H LEU B 37 -2.444 4.371 4.954 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.392 4.265 2.308 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.849 3.203 3.583 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -1.123 3.275 1.853 1.00 0.00 H new ATOM 0 HG LEU B 37 -1.058 5.662 3.727 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.058 6.204 2.583 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.147 4.640 3.428 1.00 0.00 H new ATOM 0 HD13 LEU B 37 0.943 4.686 1.661 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -1.082 7.005 1.661 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -1.278 5.518 0.702 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.559 6.026 1.829 1.00 0.00 H new ATOM 1923 N GLY B 38 -3.222 1.392 3.893 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.662 0.011 3.828 1.00 0.00 C ATOM 1925 C GLY B 38 -5.126 -0.101 3.453 1.00 0.00 C ATOM 1926 O GLY B 38 -5.491 -0.866 2.559 1.00 0.00 O ATOM 0 H GLY B 38 -2.845 1.678 4.797 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -3.058 -0.528 3.098 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.497 -0.468 4.793 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.962 0.678 4.130 1.00 0.00 N ATOM 1931 CA ASN B 39 -7.394 0.705 3.845 1.00 0.00 C ATOM 1932 C ASN B 39 -7.646 1.227 2.434 1.00 0.00 C ATOM 1933 O ASN B 39 -8.447 0.666 1.682 1.00 0.00 O ATOM 1934 CB ASN B 39 -8.119 1.588 4.868 1.00 0.00 C ATOM 1935 CG ASN B 39 -9.620 1.635 4.645 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -10.126 2.474 3.903 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -10.344 0.743 5.302 1.00 0.00 N ATOM 0 H ASN B 39 -5.672 1.302 4.883 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.781 -0.311 3.916 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.917 1.214 5.872 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.717 2.600 4.818 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -11.359 0.736 5.202 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -9.887 0.062 5.909 1.00 0.00 H new ATOM 1944 N MET B 40 -6.932 2.293 2.084 1.00 0.00 N ATOM 1945 CA MET B 40 -7.048 2.923 0.773 1.00 0.00 C ATOM 1946 C MET B 40 -6.741 1.929 -0.348 1.00 0.00 C ATOM 1947 O MET B 40 -7.516 1.789 -1.296 1.00 0.00 O ATOM 1948 CB MET B 40 -6.094 4.120 0.700 1.00 0.00 C ATOM 1949 CG MET B 40 -6.115 4.861 -0.626 1.00 0.00 C ATOM 1950 SD MET B 40 -4.993 6.272 -0.634 1.00 0.00 S ATOM 1951 CE MET B 40 -5.198 6.861 -2.311 1.00 0.00 C ATOM 0 H MET B 40 -6.257 2.744 2.701 1.00 0.00 H new ATOM 0 HA MET B 40 -8.074 3.265 0.639 1.00 0.00 H new ATOM 0 HB2 MET B 40 -6.347 4.819 1.497 1.00 0.00 H new ATOM 0 HB3 MET B 40 -5.079 3.772 0.892 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.840 4.176 -1.428 1.00 0.00 H new ATOM 0 HG3 MET B 40 -7.129 5.204 -0.833 1.00 0.00 H new ATOM 0 HE1 MET B 40 -4.312 7.421 -2.611 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.335 6.012 -2.981 1.00 0.00 H new ATOM 0 HE3 MET B 40 -6.072 7.510 -2.364 1.00 0.00 H new ATOM 1961 N VAL B 41 -5.613 1.233 -0.227 1.00 0.00 N ATOM 1962 CA VAL B 41 -5.210 0.245 -1.223 1.00 0.00 C ATOM 1963 C VAL B 41 -6.191 -0.925 -1.259 1.00 0.00 C ATOM 1964 O VAL B 41 -6.561 -1.402 -2.334 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.776 -0.275 -0.957 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -3.401 -1.377 -1.935 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.768 0.863 -1.041 1.00 0.00 C ATOM 0 H VAL B 41 -4.962 1.335 0.552 1.00 0.00 H new ATOM 0 HA VAL B 41 -5.219 0.742 -2.193 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.756 -0.690 0.051 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -2.389 -1.722 -1.724 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -4.097 -2.209 -1.830 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -3.447 -0.991 -2.953 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.767 0.477 -0.851 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.803 1.307 -2.036 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -3.012 1.621 -0.296 1.00 0.00 H new ATOM 1977 N THR B 42 -6.628 -1.365 -0.082 1.00 0.00 N ATOM 1978 CA THR B 42 -7.566 -2.475 0.024 1.00 0.00 C ATOM 1979 C THR B 42 -8.858 -2.187 -0.743 1.00 0.00 C ATOM 1980 O THR B 42 -9.302 -3.008 -1.548 1.00 0.00 O ATOM 1981 CB THR B 42 -7.893 -2.791 1.500 1.00 0.00 C ATOM 1982 OG1 THR B 42 -6.699 -3.186 2.184 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.933 -3.900 1.617 1.00 0.00 C ATOM 0 H THR B 42 -6.345 -0.967 0.814 1.00 0.00 H new ATOM 0 HA THR B 42 -7.084 -3.345 -0.422 1.00 0.00 H new ATOM 0 HB THR B 42 -8.304 -1.889 1.953 1.00 0.00 H new ATOM 0 HG1 THR B 42 -6.164 -2.392 2.394 1.00 0.00 H new ATOM 0 HG21 THR B 42 -9.139 -4.096 2.669 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.852 -3.591 1.119 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.553 -4.807 1.147 1.00 0.00 H new ATOM 1991 N ASN B 43 -9.443 -1.016 -0.512 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.693 -0.645 -1.176 1.00 0.00 C ATOM 1993 C ASN B 43 -10.484 -0.517 -2.681 1.00 0.00 C ATOM 1994 O ASN B 43 -11.356 -0.867 -3.474 1.00 0.00 O ATOM 1995 CB ASN B 43 -11.247 0.664 -0.595 1.00 0.00 C ATOM 1996 CG ASN B 43 -12.589 1.063 -1.191 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -13.634 0.564 -0.778 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -12.575 1.994 -2.134 1.00 0.00 N ATOM 0 H ASN B 43 -9.076 -0.310 0.126 1.00 0.00 H new ATOM 0 HA ASN B 43 -11.422 -1.435 -0.997 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -11.353 0.559 0.485 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.527 1.464 -0.768 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -13.451 2.320 -2.542 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.688 2.385 -2.452 1.00 0.00 H new ATOM 2005 N LEU B 44 -9.312 -0.041 -3.073 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.990 0.113 -4.484 1.00 0.00 C ATOM 2007 C LEU B 44 -8.914 -1.248 -5.181 1.00 0.00 C ATOM 2008 O LEU B 44 -9.593 -1.479 -6.177 1.00 0.00 O ATOM 2009 CB LEU B 44 -7.664 0.864 -4.647 1.00 0.00 C ATOM 2010 CG LEU B 44 -7.255 1.172 -6.092 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -8.274 2.083 -6.756 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -5.873 1.807 -6.128 1.00 0.00 C ATOM 0 H LEU B 44 -8.569 0.245 -2.435 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.786 0.692 -4.952 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.728 1.803 -4.098 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.873 0.276 -4.181 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.222 0.234 -6.646 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.965 2.289 -7.781 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.249 1.595 -6.762 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.341 3.019 -6.202 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.597 2.020 -7.161 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.884 2.735 -5.557 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.146 1.122 -5.692 1.00 0.00 H new ATOM 2024 N ILE B 45 -8.108 -2.151 -4.642 1.00 0.00 N ATOM 2025 CA ILE B 45 -7.889 -3.449 -5.277 1.00 0.00 C ATOM 2026 C ILE B 45 -9.135 -4.340 -5.207 1.00 0.00 C ATOM 2027 O ILE B 45 -9.473 -5.026 -6.169 1.00 0.00 O ATOM 2028 CB ILE B 45 -6.687 -4.192 -4.646 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.409 -3.358 -4.793 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -6.503 -5.562 -5.288 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.174 -4.030 -4.233 1.00 0.00 C ATOM 0 H ILE B 45 -7.596 -2.013 -3.771 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.670 -3.245 -6.325 1.00 0.00 H new ATOM 0 HB ILE B 45 -6.891 -4.336 -3.585 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.247 -3.142 -5.849 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.551 -2.401 -4.290 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.653 -6.067 -4.830 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -7.403 -6.158 -5.138 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.321 -5.442 -6.356 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.311 -3.380 -4.374 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.315 -4.221 -3.169 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.006 -4.973 -4.752 1.00 0.00 H new ATOM 2043 N ASN B 46 -9.829 -4.311 -4.079 1.00 0.00 N ATOM 2044 CA ASN B 46 -10.977 -5.197 -3.868 1.00 0.00 C ATOM 2045 C ASN B 46 -12.227 -4.697 -4.584 1.00 0.00 C ATOM 2046 O ASN B 46 -13.042 -5.493 -5.053 1.00 0.00 O ATOM 2047 CB ASN B 46 -11.281 -5.351 -2.372 1.00 0.00 C ATOM 2048 CG ASN B 46 -10.322 -6.289 -1.665 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -10.570 -7.489 -1.566 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -9.224 -5.751 -1.165 1.00 0.00 N ATOM 0 H ASN B 46 -9.624 -3.690 -3.297 1.00 0.00 H new ATOM 0 HA ASN B 46 -10.704 -6.165 -4.288 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.239 -4.371 -1.896 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -12.299 -5.722 -2.250 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -8.546 -6.336 -0.676 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -9.054 -4.751 -1.268 1.00 0.00 H new ATOM 2057 N THR B 47 -12.382 -3.386 -4.663 1.00 0.00 N ATOM 2058 CA THR B 47 -13.619 -2.797 -5.157 1.00 0.00 C ATOM 2059 C THR B 47 -13.476 -2.225 -6.572 1.00 0.00 C ATOM 2060 O THR B 47 -14.403 -2.313 -7.378 1.00 0.00 O ATOM 2061 CB THR B 47 -14.093 -1.696 -4.186 1.00 0.00 C ATOM 2062 OG1 THR B 47 -14.305 -2.264 -2.884 1.00 0.00 O ATOM 2063 CG2 THR B 47 -15.371 -1.026 -4.661 1.00 0.00 C ATOM 0 H THR B 47 -11.669 -2.709 -4.392 1.00 0.00 H new ATOM 0 HA THR B 47 -14.361 -3.594 -5.210 1.00 0.00 H new ATOM 0 HB THR B 47 -13.315 -0.933 -4.145 1.00 0.00 H new ATOM 0 HG1 THR B 47 -14.604 -1.564 -2.267 1.00 0.00 H new ATOM 0 HG21 THR B 47 -15.667 -0.258 -3.946 1.00 0.00 H new ATOM 0 HG22 THR B 47 -15.201 -0.568 -5.636 1.00 0.00 H new ATOM 0 HG23 THR B 47 -16.163 -1.770 -4.743 1.00 0.00 H new ATOM 2071 N SER B 48 -12.319 -1.658 -6.884 1.00 0.00 N ATOM 2072 CA SER B 48 -12.135 -0.984 -8.164 1.00 0.00 C ATOM 2073 C SER B 48 -11.474 -1.912 -9.188 1.00 0.00 C ATOM 2074 O SER B 48 -11.538 -1.668 -10.396 1.00 0.00 O ATOM 2075 CB SER B 48 -11.302 0.287 -7.972 1.00 0.00 C ATOM 2076 OG SER B 48 -11.433 1.164 -9.076 1.00 0.00 O ATOM 0 H SER B 48 -11.500 -1.650 -6.276 1.00 0.00 H new ATOM 0 HA SER B 48 -13.116 -0.709 -8.551 1.00 0.00 H new ATOM 0 HB2 SER B 48 -11.618 0.796 -7.062 1.00 0.00 H new ATOM 0 HB3 SER B 48 -10.253 0.020 -7.840 1.00 0.00 H new ATOM 0 HG SER B 48 -10.891 1.966 -8.923 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.848 -2.977 -8.709 1.00 0.00 N ATOM 2083 CA ILE B 49 -10.183 -3.927 -9.589 1.00 0.00 C ATOM 2084 C ILE B 49 -10.971 -5.237 -9.642 1.00 0.00 C ATOM 2085 O ILE B 49 -11.708 -5.553 -8.708 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.729 -4.194 -9.124 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.964 -2.871 -9.012 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -8.012 -5.140 -10.081 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -6.526 -3.025 -8.557 1.00 0.00 C ATOM 0 H ILE B 49 -10.787 -3.205 -7.717 1.00 0.00 H new ATOM 0 HA ILE B 49 -10.144 -3.495 -10.589 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.765 -4.670 -8.144 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.976 -2.373 -9.982 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -8.487 -2.219 -8.313 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.994 -5.310 -9.730 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.545 -6.090 -10.121 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.984 -4.698 -11.077 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -6.054 -2.044 -8.503 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.504 -3.493 -7.573 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.984 -3.649 -9.268 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.830 -5.972 -10.748 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.514 -7.251 -10.935 1.00 0.00 C ATOM 2103 C ALA B 50 -11.269 -8.178 -9.747 1.00 0.00 C ATOM 2104 O ALA B 50 -10.127 -8.551 -9.463 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.052 -7.908 -12.226 1.00 0.00 C ATOM 0 H ALA B 50 -10.241 -5.698 -11.535 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.585 -7.062 -11.000 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.568 -8.860 -12.355 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.280 -7.255 -13.068 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.977 -8.081 -12.182 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.346 -8.563 -9.048 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.263 -9.330 -7.802 1.00 0.00 C ATOM 2113 C PRO B 51 -11.511 -10.653 -7.943 1.00 0.00 C ATOM 2114 O PRO B 51 -10.884 -11.113 -6.989 1.00 0.00 O ATOM 2115 CB PRO B 51 -13.726 -9.586 -7.417 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.524 -9.283 -8.639 1.00 0.00 C ATOM 2117 CD PRO B 51 -13.739 -8.263 -9.412 1.00 0.00 C ATOM 0 HA PRO B 51 -11.700 -8.777 -7.050 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -13.872 -10.619 -7.100 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -14.029 -8.951 -6.584 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -14.683 -10.183 -9.233 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -15.509 -8.897 -8.375 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -13.904 -8.357 -10.485 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -14.017 -7.246 -9.135 1.00 0.00 H new ATOM 2125 N ALA B 52 -11.563 -11.257 -9.123 1.00 0.00 N ATOM 2126 CA ALA B 52 -10.907 -12.542 -9.350 1.00 0.00 C ATOM 2127 C ALA B 52 -9.387 -12.409 -9.355 1.00 0.00 C ATOM 2128 O ALA B 52 -8.675 -13.316 -8.928 1.00 0.00 O ATOM 2129 CB ALA B 52 -11.380 -13.155 -10.658 1.00 0.00 C ATOM 0 H ALA B 52 -12.050 -10.881 -9.936 1.00 0.00 H new ATOM 0 HA ALA B 52 -11.182 -13.199 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -10.882 -14.112 -10.812 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -12.458 -13.309 -10.619 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -11.140 -12.484 -11.482 1.00 0.00 H new ATOM 2135 N GLN B 53 -8.891 -11.268 -9.810 1.00 0.00 N ATOM 2136 CA GLN B 53 -7.453 -11.070 -9.959 1.00 0.00 C ATOM 2137 C GLN B 53 -6.888 -10.225 -8.823 1.00 0.00 C ATOM 2138 O GLN B 53 -5.695 -9.925 -8.803 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.142 -10.396 -11.297 1.00 0.00 C ATOM 2140 CG GLN B 53 -7.483 -11.248 -12.507 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.215 -10.531 -13.815 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -6.117 -10.604 -14.368 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -8.219 -9.833 -14.319 1.00 0.00 N ATOM 0 H GLN B 53 -9.459 -10.466 -10.082 1.00 0.00 H new ATOM 0 HA GLN B 53 -6.982 -12.053 -9.928 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -7.694 -9.458 -11.358 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -6.082 -10.144 -11.329 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -6.900 -12.169 -12.475 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -8.534 -11.534 -12.462 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -9.113 -9.799 -13.829 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -8.099 -9.329 -15.198 1.00 0.00 H new ATOM 2152 N ARG B 54 -7.737 -9.860 -7.868 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.335 -8.931 -6.816 1.00 0.00 C ATOM 2154 C ARG B 54 -6.327 -9.568 -5.859 1.00 0.00 C ATOM 2155 O ARG B 54 -5.499 -8.874 -5.273 1.00 0.00 O ATOM 2156 CB ARG B 54 -8.564 -8.405 -6.062 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.160 -9.367 -5.050 1.00 0.00 C ATOM 2158 CD ARG B 54 -10.513 -8.867 -4.572 1.00 0.00 C ATOM 2159 NE ARG B 54 -10.976 -9.552 -3.368 1.00 0.00 N ATOM 2160 CZ ARG B 54 -11.923 -10.489 -3.356 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -12.407 -10.969 -4.493 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -12.367 -10.972 -2.203 1.00 0.00 N ATOM 0 H ARG B 54 -8.700 -10.189 -7.800 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.838 -8.084 -7.289 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.288 -7.485 -5.547 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -9.333 -8.145 -6.789 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.269 -10.355 -5.499 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.485 -9.475 -4.201 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.451 -7.797 -4.375 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.247 -9.002 -5.367 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.547 -9.296 -2.479 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.054 -10.621 -5.385 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.132 -11.686 -4.476 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -11.983 -10.626 -1.324 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.092 -11.689 -2.196 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.380 -10.889 -5.717 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.414 -11.600 -4.887 1.00 0.00 C ATOM 2178 C GLN B 55 -4.040 -11.598 -5.548 1.00 0.00 C ATOM 2179 O GLN B 55 -3.040 -11.264 -4.917 1.00 0.00 O ATOM 2180 CB GLN B 55 -5.871 -13.037 -4.625 1.00 0.00 C ATOM 2181 CG GLN B 55 -6.784 -13.189 -3.416 1.00 0.00 C ATOM 2182 CD GLN B 55 -6.078 -12.872 -2.107 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -4.865 -13.031 -1.989 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -6.834 -12.445 -1.108 1.00 0.00 N ATOM 0 H GLN B 55 -7.077 -11.485 -6.163 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.345 -11.082 -3.930 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -6.391 -13.408 -5.508 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -4.992 -13.666 -4.484 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -7.644 -12.529 -3.530 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -7.167 -14.209 -3.380 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -7.838 -12.325 -1.243 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -6.413 -12.236 -0.203 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.005 -11.954 -6.826 1.00 0.00 N ATOM 2194 CA ALA B 56 -2.755 -11.995 -7.576 1.00 0.00 C ATOM 2195 C ALA B 56 -2.080 -10.627 -7.607 1.00 0.00 C ATOM 2196 O ALA B 56 -0.867 -10.522 -7.421 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.005 -12.496 -8.990 1.00 0.00 C ATOM 0 H ALA B 56 -4.829 -12.219 -7.366 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.082 -12.687 -7.070 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.064 -12.522 -9.539 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.430 -13.499 -8.951 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -3.701 -11.827 -9.495 1.00 0.00 H new ATOM 2203 N ILE B 57 -2.870 -9.584 -7.828 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.346 -8.225 -7.872 1.00 0.00 C ATOM 2205 C ILE B 57 -1.837 -7.791 -6.498 1.00 0.00 C ATOM 2206 O ILE B 57 -0.781 -7.164 -6.390 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.410 -7.229 -8.383 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -3.802 -7.581 -9.823 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -2.891 -5.798 -8.304 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -4.870 -6.683 -10.408 1.00 0.00 C ATOM 0 H ILE B 57 -3.876 -9.653 -7.980 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.510 -8.221 -8.571 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.293 -7.302 -7.748 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -2.914 -7.530 -10.453 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -4.154 -8.612 -9.851 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.656 -5.113 -8.669 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.650 -5.555 -7.269 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -1.995 -5.701 -8.918 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -5.091 -6.997 -11.428 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -5.774 -6.751 -9.803 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.515 -5.652 -10.415 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.574 -8.143 -5.450 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.164 -7.816 -4.088 1.00 0.00 C ATOM 2224 C ALA B 58 -0.841 -8.490 -3.745 1.00 0.00 C ATOM 2225 O ALA B 58 0.069 -7.858 -3.205 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.238 -8.230 -3.096 1.00 0.00 C ATOM 0 H ALA B 58 -3.455 -8.653 -5.516 1.00 0.00 H new ATOM 0 HA ALA B 58 -2.027 -6.737 -4.024 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.916 -7.979 -2.085 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.165 -7.704 -3.323 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.404 -9.305 -3.167 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.738 -9.773 -4.072 1.00 0.00 N ATOM 2233 CA ASN B 59 0.487 -10.528 -3.834 1.00 0.00 C ATOM 2234 C ASN B 59 1.633 -9.956 -4.655 1.00 0.00 C ATOM 2235 O ASN B 59 2.765 -9.867 -4.181 1.00 0.00 O ATOM 2236 CB ASN B 59 0.292 -12.010 -4.168 1.00 0.00 C ATOM 2237 CG ASN B 59 -0.691 -12.693 -3.238 1.00 0.00 C ATOM 2238 OD1 ASN B 59 -0.836 -12.309 -2.079 1.00 0.00 O ATOM 2239 ND2 ASN B 59 -1.369 -13.715 -3.735 1.00 0.00 N ATOM 0 H ASN B 59 -1.489 -10.313 -4.503 1.00 0.00 H new ATOM 0 HA ASN B 59 0.733 -10.443 -2.776 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.060 -12.104 -5.195 1.00 0.00 H new ATOM 0 HB3 ASN B 59 1.253 -12.521 -4.113 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -2.040 -14.214 -3.151 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -1.221 -14.004 -4.702 1.00 0.00 H new ATOM 2246 N SER B 60 1.331 -9.555 -5.883 1.00 0.00 N ATOM 2247 CA SER B 60 2.327 -8.954 -6.753 1.00 0.00 C ATOM 2248 C SER B 60 2.797 -7.619 -6.178 1.00 0.00 C ATOM 2249 O SER B 60 3.977 -7.281 -6.257 1.00 0.00 O ATOM 2250 CB SER B 60 1.756 -8.761 -8.161 1.00 0.00 C ATOM 2251 OG SER B 60 2.746 -8.280 -9.057 1.00 0.00 O ATOM 0 H SER B 60 0.402 -9.636 -6.297 1.00 0.00 H new ATOM 0 HA SER B 60 3.185 -9.624 -6.817 1.00 0.00 H new ATOM 0 HB2 SER B 60 1.359 -9.708 -8.528 1.00 0.00 H new ATOM 0 HB3 SER B 60 0.923 -8.059 -8.125 1.00 0.00 H new ATOM 0 HG SER B 60 2.354 -8.168 -9.948 1.00 0.00 H new ATOM 2257 N PHE B 61 1.867 -6.872 -5.588 1.00 0.00 N ATOM 2258 CA PHE B 61 2.192 -5.601 -4.950 1.00 0.00 C ATOM 2259 C PHE B 61 3.130 -5.830 -3.770 1.00 0.00 C ATOM 2260 O PHE B 61 4.126 -5.127 -3.610 1.00 0.00 O ATOM 2261 CB PHE B 61 0.911 -4.895 -4.484 1.00 0.00 C ATOM 2262 CG PHE B 61 1.144 -3.535 -3.880 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.285 -2.419 -4.689 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.217 -3.373 -2.503 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.497 -1.169 -4.139 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.428 -2.126 -1.949 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.567 -1.022 -2.768 1.00 0.00 C ATOM 0 H PHE B 61 0.880 -7.127 -5.539 1.00 0.00 H new ATOM 0 HA PHE B 61 2.694 -4.963 -5.677 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.236 -4.793 -5.333 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.408 -5.525 -3.751 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.229 -2.527 -5.762 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.107 -4.232 -1.858 1.00 0.00 H new ATOM 0 HE1 PHE B 61 1.608 -0.308 -4.781 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.484 -2.014 -0.876 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.730 -0.046 -2.336 1.00 0.00 H new ATOM 2277 N ALA B 62 2.805 -6.826 -2.953 1.00 0.00 N ATOM 2278 CA ALA B 62 3.643 -7.196 -1.818 1.00 0.00 C ATOM 2279 C ALA B 62 5.033 -7.607 -2.287 1.00 0.00 C ATOM 2280 O ALA B 62 6.042 -7.188 -1.717 1.00 0.00 O ATOM 2281 CB ALA B 62 2.990 -8.324 -1.035 1.00 0.00 C ATOM 0 H ALA B 62 1.964 -7.394 -3.056 1.00 0.00 H new ATOM 0 HA ALA B 62 3.748 -6.329 -1.165 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.623 -8.594 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.016 -7.997 -0.670 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.862 -9.191 -1.684 1.00 0.00 H new ATOM 2287 N ARG B 63 5.074 -8.417 -3.337 1.00 0.00 N ATOM 2288 CA ARG B 63 6.332 -8.856 -3.931 1.00 0.00 C ATOM 2289 C ARG B 63 7.121 -7.671 -4.475 1.00 0.00 C ATOM 2290 O ARG B 63 8.335 -7.586 -4.288 1.00 0.00 O ATOM 2291 CB ARG B 63 6.066 -9.866 -5.047 1.00 0.00 C ATOM 2292 CG ARG B 63 5.668 -11.244 -4.544 1.00 0.00 C ATOM 2293 CD ARG B 63 5.196 -12.144 -5.678 1.00 0.00 C ATOM 2294 NE ARG B 63 6.069 -12.067 -6.850 1.00 0.00 N ATOM 2295 CZ ARG B 63 7.130 -12.853 -7.056 1.00 0.00 C ATOM 2296 NH1 ARG B 63 7.470 -13.774 -6.161 1.00 0.00 N ATOM 2297 NH2 ARG B 63 7.842 -12.716 -8.169 1.00 0.00 N ATOM 0 H ARG B 63 4.243 -8.787 -3.799 1.00 0.00 H new ATOM 0 HA ARG B 63 6.926 -9.334 -3.152 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.275 -9.482 -5.691 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.961 -9.958 -5.662 1.00 0.00 H new ATOM 0 HG2 ARG B 63 6.517 -11.707 -4.042 1.00 0.00 H new ATOM 0 HG3 ARG B 63 4.874 -11.146 -3.803 1.00 0.00 H new ATOM 0 HD2 ARG B 63 5.154 -13.175 -5.327 1.00 0.00 H new ATOM 0 HD3 ARG B 63 4.182 -11.863 -5.964 1.00 0.00 H new ATOM 0 HE ARG B 63 5.853 -11.365 -7.558 1.00 0.00 H new ATOM 0 HH11 ARG B 63 6.920 -13.885 -5.309 1.00 0.00 H new ATOM 0 HH12 ARG B 63 8.281 -14.370 -6.326 1.00 0.00 H new ATOM 0 HH21 ARG B 63 7.578 -12.014 -8.860 1.00 0.00 H new ATOM 0 HH22 ARG B 63 8.653 -13.313 -8.332 1.00 0.00 H new ATOM 2311 N ALA B 64 6.423 -6.755 -5.138 1.00 0.00 N ATOM 2312 CA ALA B 64 7.049 -5.552 -5.674 1.00 0.00 C ATOM 2313 C ALA B 64 7.649 -4.718 -4.550 1.00 0.00 C ATOM 2314 O ALA B 64 8.732 -4.153 -4.693 1.00 0.00 O ATOM 2315 CB ALA B 64 6.040 -4.732 -6.465 1.00 0.00 C ATOM 0 H ALA B 64 5.421 -6.823 -5.317 1.00 0.00 H new ATOM 0 HA ALA B 64 7.852 -5.853 -6.347 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.525 -3.838 -6.857 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.655 -5.328 -7.292 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.216 -4.441 -5.813 1.00 0.00 H new ATOM 2321 N LEU B 65 6.946 -4.665 -3.426 1.00 0.00 N ATOM 2322 CA LEU B 65 7.425 -3.949 -2.253 1.00 0.00 C ATOM 2323 C LEU B 65 8.712 -4.586 -1.728 1.00 0.00 C ATOM 2324 O LEU B 65 9.587 -3.904 -1.194 1.00 0.00 O ATOM 2325 CB LEU B 65 6.351 -3.949 -1.161 1.00 0.00 C ATOM 2326 CG LEU B 65 6.666 -3.102 0.077 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.727 -1.627 -0.289 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.630 -3.341 1.165 1.00 0.00 C ATOM 0 H LEU B 65 6.038 -5.112 -3.303 1.00 0.00 H new ATOM 0 HA LEU B 65 7.639 -2.919 -2.537 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.417 -3.593 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.182 -4.978 -0.842 1.00 0.00 H new ATOM 0 HG LEU B 65 7.641 -3.402 0.461 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.952 -1.040 0.602 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.507 -1.469 -1.034 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.766 -1.313 -0.697 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.870 -2.731 2.036 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.642 -3.069 0.793 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.635 -4.394 1.447 1.00 0.00 H new ATOM 2340 N GLN B 66 8.832 -5.899 -1.898 1.00 0.00 N ATOM 2341 CA GLN B 66 10.016 -6.615 -1.440 1.00 0.00 C ATOM 2342 C GLN B 66 11.187 -6.378 -2.386 1.00 0.00 C ATOM 2343 O GLN B 66 12.348 -6.494 -1.992 1.00 0.00 O ATOM 2344 CB GLN B 66 9.749 -8.122 -1.325 1.00 0.00 C ATOM 2345 CG GLN B 66 8.586 -8.491 -0.415 1.00 0.00 C ATOM 2346 CD GLN B 66 8.588 -7.724 0.893 1.00 0.00 C ATOM 2347 OE1 GLN B 66 7.845 -6.630 0.936 1.00 0.00 O flip ATOM 2348 NE2 GLN B 66 9.230 -8.126 1.864 1.00 0.00 N flip ATOM 0 H GLN B 66 8.128 -6.485 -2.347 1.00 0.00 H new ATOM 0 HA GLN B 66 10.266 -6.230 -0.452 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.555 -8.520 -2.321 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.651 -8.611 -0.956 1.00 0.00 H new ATOM 0 HG2 GLN B 66 7.649 -8.302 -0.939 1.00 0.00 H new ATOM 0 HG3 GLN B 66 8.623 -9.560 -0.203 1.00 0.00 H new ATOM 0 HE21 GLN B 66 9.791 -8.975 1.789 1.00 0.00 H new ATOM 0 HE22 GLN B 66 9.201 -7.610 2.744 1.00 0.00 H new ATOM 2357 N SER B 67 10.887 -6.056 -3.637 1.00 0.00 N ATOM 2358 CA SER B 67 11.932 -5.797 -4.614 1.00 0.00 C ATOM 2359 C SER B 67 12.360 -4.330 -4.590 1.00 0.00 C ATOM 2360 O SER B 67 13.504 -4.008 -4.913 1.00 0.00 O ATOM 2361 CB SER B 67 11.475 -6.212 -6.018 1.00 0.00 C ATOM 2362 OG SER B 67 10.219 -5.644 -6.351 1.00 0.00 O ATOM 0 H SER B 67 9.936 -5.969 -3.996 1.00 0.00 H new ATOM 0 HA SER B 67 12.800 -6.399 -4.346 1.00 0.00 H new ATOM 0 HB2 SER B 67 12.220 -5.901 -6.750 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.409 -7.299 -6.073 1.00 0.00 H new ATOM 0 HG SER B 67 9.976 -4.972 -5.681 1.00 0.00 H new ATOM 2368 N SER B 68 11.450 -3.445 -4.192 1.00 0.00 N ATOM 2369 CA SER B 68 11.756 -2.024 -4.129 1.00 0.00 C ATOM 2370 C SER B 68 12.577 -1.708 -2.881 1.00 0.00 C ATOM 2371 O SER B 68 13.537 -0.939 -2.939 1.00 0.00 O ATOM 2372 CB SER B 68 10.466 -1.194 -4.159 1.00 0.00 C ATOM 2373 OG SER B 68 9.554 -1.624 -3.163 1.00 0.00 O ATOM 0 H SER B 68 10.500 -3.688 -3.910 1.00 0.00 H new ATOM 0 HA SER B 68 12.351 -1.759 -5.003 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.705 -0.141 -4.007 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.001 -1.276 -5.141 1.00 0.00 H new ATOM 0 HG SER B 68 9.166 -0.843 -2.716 1.00 0.00 H new ATOM 2379 N ILE B 69 12.208 -2.317 -1.758 1.00 0.00 N ATOM 2380 CA ILE B 69 12.949 -2.140 -0.521 1.00 0.00 C ATOM 2381 C ILE B 69 14.204 -3.007 -0.524 1.00 0.00 C ATOM 2382 O ILE B 69 14.144 -4.215 -0.285 1.00 0.00 O ATOM 2383 CB ILE B 69 12.092 -2.483 0.718 1.00 0.00 C ATOM 2384 CG1 ILE B 69 10.869 -1.563 0.796 1.00 0.00 C ATOM 2385 CG2 ILE B 69 12.923 -2.369 1.990 1.00 0.00 C ATOM 2386 CD1 ILE B 69 9.961 -1.858 1.972 1.00 0.00 C ATOM 0 H ILE B 69 11.401 -2.936 -1.683 1.00 0.00 H new ATOM 0 HA ILE B 69 13.228 -1.088 -0.462 1.00 0.00 H new ATOM 0 HB ILE B 69 11.746 -3.512 0.622 1.00 0.00 H new ATOM 0 HG12 ILE B 69 11.207 -0.529 0.859 1.00 0.00 H new ATOM 0 HG13 ILE B 69 10.296 -1.655 -0.127 1.00 0.00 H new ATOM 0 HG21 ILE B 69 12.303 -2.614 2.853 1.00 0.00 H new ATOM 0 HG22 ILE B 69 13.764 -3.061 1.939 1.00 0.00 H new ATOM 0 HG23 ILE B 69 13.297 -1.350 2.090 1.00 0.00 H new ATOM 0 HD11 ILE B 69 9.117 -1.168 1.962 1.00 0.00 H new ATOM 0 HD12 ILE B 69 9.593 -2.882 1.900 1.00 0.00 H new ATOM 0 HD13 ILE B 69 10.518 -1.737 2.901 1.00 0.00 H new ATOM 2398 N ASN B 70 15.336 -2.394 -0.826 1.00 0.00 N ATOM 2399 CA ASN B 70 16.607 -3.099 -0.804 1.00 0.00 C ATOM 2400 C ASN B 70 17.524 -2.482 0.241 1.00 0.00 C ATOM 2401 O ASN B 70 17.375 -1.312 0.598 1.00 0.00 O ATOM 2402 CB ASN B 70 17.281 -3.078 -2.182 1.00 0.00 C ATOM 2403 CG ASN B 70 17.779 -1.702 -2.583 1.00 0.00 C ATOM 2404 OD1 ASN B 70 17.040 -0.907 -3.160 1.00 0.00 O ATOM 2405 ND2 ASN B 70 19.041 -1.417 -2.304 1.00 0.00 N ATOM 0 H ASN B 70 15.401 -1.411 -1.089 1.00 0.00 H new ATOM 0 HA ASN B 70 16.414 -4.140 -0.544 1.00 0.00 H new ATOM 0 HB2 ASN B 70 18.120 -3.774 -2.180 1.00 0.00 H new ATOM 0 HB3 ASN B 70 16.573 -3.434 -2.931 1.00 0.00 H new ATOM 0 HD21 ASN B 70 19.430 -0.512 -2.569 1.00 0.00 H new ATOM 0 HD22 ASN B 70 19.624 -2.102 -1.824 1.00 0.00 H new ATOM 2412 N GLU B 71 18.455 -3.280 0.741 1.00 0.00 N ATOM 2413 CA GLU B 71 19.411 -2.810 1.728 1.00 0.00 C ATOM 2414 C GLU B 71 20.420 -1.859 1.093 1.00 0.00 C ATOM 2415 O GLU B 71 20.383 -0.653 1.341 1.00 0.00 O ATOM 2416 CB GLU B 71 20.117 -3.993 2.402 1.00 0.00 C ATOM 2417 CG GLU B 71 19.367 -4.554 3.606 1.00 0.00 C ATOM 2418 CD GLU B 71 17.892 -4.794 3.338 1.00 0.00 C ATOM 2419 OE1 GLU B 71 17.557 -5.788 2.658 1.00 0.00 O ATOM 2420 OE2 GLU B 71 17.063 -3.990 3.815 1.00 0.00 O ATOM 0 H GLU B 71 18.568 -4.259 0.478 1.00 0.00 H new ATOM 0 HA GLU B 71 18.869 -2.259 2.496 1.00 0.00 H new ATOM 0 HB2 GLU B 71 20.254 -4.788 1.669 1.00 0.00 H new ATOM 0 HB3 GLU B 71 21.111 -3.678 2.720 1.00 0.00 H new ATOM 0 HG2 GLU B 71 19.831 -5.492 3.909 1.00 0.00 H new ATOM 0 HG3 GLU B 71 19.469 -3.863 4.443 1.00 0.00 H new ATOM 2427 N ASP B 72 21.312 -2.392 0.272 1.00 0.00 N ATOM 2428 CA ASP B 72 22.284 -1.567 -0.433 1.00 0.00 C ATOM 2429 C ASP B 72 22.690 -2.254 -1.731 1.00 0.00 C ATOM 2430 O ASP B 72 22.077 -3.244 -2.131 1.00 0.00 O ATOM 2431 CB ASP B 72 23.517 -1.319 0.446 1.00 0.00 C ATOM 2432 CG ASP B 72 24.169 0.027 0.176 1.00 0.00 C ATOM 2433 OD1 ASP B 72 24.754 0.211 -0.912 1.00 0.00 O ATOM 2434 OD2 ASP B 72 24.085 0.916 1.052 1.00 0.00 O ATOM 0 H ASP B 72 21.384 -3.391 0.077 1.00 0.00 H new ATOM 0 HA ASP B 72 21.830 -0.603 -0.664 1.00 0.00 H new ATOM 0 HB2 ASP B 72 23.227 -1.374 1.495 1.00 0.00 H new ATOM 0 HB3 ASP B 72 24.245 -2.112 0.275 1.00 0.00 H new ATOM 2439 N LYS B 73 23.709 -1.725 -2.388 1.00 0.00 N ATOM 2440 CA LYS B 73 24.213 -2.306 -3.625 1.00 0.00 C ATOM 2441 C LYS B 73 25.540 -3.004 -3.360 1.00 0.00 C ATOM 2442 O LYS B 73 26.433 -2.430 -2.738 1.00 0.00 O ATOM 2443 CB LYS B 73 24.397 -1.232 -4.710 1.00 0.00 C ATOM 2444 CG LYS B 73 23.097 -0.696 -5.305 1.00 0.00 C ATOM 2445 CD LYS B 73 22.341 0.209 -4.342 1.00 0.00 C ATOM 2446 CE LYS B 73 23.134 1.459 -3.992 1.00 0.00 C ATOM 2447 NZ LYS B 73 23.406 2.310 -5.183 1.00 0.00 N ATOM 0 H LYS B 73 24.207 -0.889 -2.084 1.00 0.00 H new ATOM 0 HA LYS B 73 23.482 -3.030 -3.985 1.00 0.00 H new ATOM 0 HB2 LYS B 73 24.957 -0.399 -4.286 1.00 0.00 H new ATOM 0 HB3 LYS B 73 25.004 -1.648 -5.514 1.00 0.00 H new ATOM 0 HG2 LYS B 73 23.320 -0.143 -6.218 1.00 0.00 H new ATOM 0 HG3 LYS B 73 22.459 -1.533 -5.588 1.00 0.00 H new ATOM 0 HD2 LYS B 73 21.389 0.497 -4.787 1.00 0.00 H new ATOM 0 HD3 LYS B 73 22.113 -0.343 -3.430 1.00 0.00 H new ATOM 0 HE2 LYS B 73 22.584 2.040 -3.252 1.00 0.00 H new ATOM 0 HE3 LYS B 73 24.079 1.170 -3.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 23.796 3.224 -4.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 24.092 1.832 -5.802 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 22.521 2.470 -5.705 1.00 0.00 H new ATOM 2461 N ALA B 74 25.662 -4.242 -3.820 1.00 0.00 N ATOM 2462 CA ALA B 74 26.883 -5.012 -3.627 1.00 0.00 C ATOM 2463 C ALA B 74 28.077 -4.348 -4.302 1.00 0.00 C ATOM 2464 O ALA B 74 27.973 -3.842 -5.423 1.00 0.00 O ATOM 2465 CB ALA B 74 26.702 -6.423 -4.160 1.00 0.00 C ATOM 0 H ALA B 74 24.929 -4.735 -4.330 1.00 0.00 H new ATOM 0 HA ALA B 74 27.084 -5.053 -2.556 1.00 0.00 H new ATOM 0 HB1 ALA B 74 27.621 -6.989 -4.010 1.00 0.00 H new ATOM 0 HB2 ALA B 74 25.885 -6.911 -3.629 1.00 0.00 H new ATOM 0 HB3 ALA B 74 26.470 -6.383 -5.224 1.00 0.00 H new ATOM 2471 N HIS B 75 29.204 -4.337 -3.608 1.00 0.00 N ATOM 2472 CA HIS B 75 30.441 -3.817 -4.169 1.00 0.00 C ATOM 2473 C HIS B 75 31.160 -4.929 -4.923 1.00 0.00 C ATOM 2474 O HIS B 75 31.892 -5.721 -4.333 1.00 0.00 O ATOM 2475 CB HIS B 75 31.329 -3.242 -3.059 1.00 0.00 C ATOM 2476 CG HIS B 75 32.608 -2.621 -3.547 1.00 0.00 C ATOM 2477 ND1 HIS B 75 33.842 -3.154 -3.724 1.00 0.00 N flip ATOM 2478 CD2 HIS B 75 32.720 -1.290 -3.893 1.00 0.00 C flip ATOM 2479 CE1 HIS B 75 34.661 -2.147 -4.166 1.00 0.00 C flip ATOM 2480 NE2 HIS B 75 33.960 -1.036 -4.259 1.00 0.00 N flip ATOM 0 H HIS B 75 29.288 -4.683 -2.652 1.00 0.00 H new ATOM 0 HA HIS B 75 30.214 -3.010 -4.866 1.00 0.00 H new ATOM 0 HB2 HIS B 75 30.762 -2.491 -2.509 1.00 0.00 H new ATOM 0 HB3 HIS B 75 31.571 -4.038 -2.355 1.00 0.00 H new ATOM 0 HD2 HIS B 75 31.916 -0.569 -3.868 1.00 0.00 H new ATOM 0 HE1 HIS B 75 35.710 -2.248 -4.400 1.00 0.00 H new ATOM 0 HE2 HIS B 75 34.317 -0.130 -4.563 1.00 0.00 H new ATOM 2489 N LEU B 76 30.921 -4.993 -6.224 1.00 0.00 N ATOM 2490 CA LEU B 76 31.455 -6.063 -7.054 1.00 0.00 C ATOM 2491 C LEU B 76 32.754 -5.635 -7.717 1.00 0.00 C ATOM 2492 O LEU B 76 32.777 -4.686 -8.507 1.00 0.00 O ATOM 2493 CB LEU B 76 30.430 -6.454 -8.120 1.00 0.00 C ATOM 2494 CG LEU B 76 29.080 -6.929 -7.578 1.00 0.00 C ATOM 2495 CD1 LEU B 76 28.102 -7.157 -8.720 1.00 0.00 C ATOM 2496 CD2 LEU B 76 29.250 -8.201 -6.760 1.00 0.00 C ATOM 0 H LEU B 76 30.357 -4.311 -6.731 1.00 0.00 H new ATOM 0 HA LEU B 76 31.661 -6.924 -6.418 1.00 0.00 H new ATOM 0 HB2 LEU B 76 30.261 -5.597 -8.772 1.00 0.00 H new ATOM 0 HB3 LEU B 76 30.855 -7.245 -8.738 1.00 0.00 H new ATOM 0 HG LEU B 76 28.677 -6.154 -6.926 1.00 0.00 H new ATOM 0 HD11 LEU B 76 27.146 -7.495 -8.319 1.00 0.00 H new ATOM 0 HD12 LEU B 76 27.957 -6.225 -9.267 1.00 0.00 H new ATOM 0 HD13 LEU B 76 28.500 -7.915 -9.394 1.00 0.00 H new ATOM 0 HD21 LEU B 76 28.279 -8.524 -6.383 1.00 0.00 H new ATOM 0 HD22 LEU B 76 29.673 -8.984 -7.389 1.00 0.00 H new ATOM 0 HD23 LEU B 76 29.919 -8.008 -5.921 1.00 0.00 H new ATOM 2508 N GLU B 77 33.834 -6.325 -7.392 1.00 0.00 N ATOM 2509 CA GLU B 77 35.127 -6.025 -7.977 1.00 0.00 C ATOM 2510 C GLU B 77 35.587 -7.152 -8.894 1.00 0.00 C ATOM 2511 O GLU B 77 36.147 -8.148 -8.437 1.00 0.00 O ATOM 2512 CB GLU B 77 36.172 -5.793 -6.886 1.00 0.00 C ATOM 2513 CG GLU B 77 37.512 -5.332 -7.431 1.00 0.00 C ATOM 2514 CD GLU B 77 38.614 -5.383 -6.399 1.00 0.00 C ATOM 2515 OE1 GLU B 77 38.567 -4.597 -5.429 1.00 0.00 O ATOM 2516 OE2 GLU B 77 39.538 -6.209 -6.556 1.00 0.00 O ATOM 0 H GLU B 77 33.840 -7.097 -6.726 1.00 0.00 H new ATOM 0 HA GLU B 77 35.019 -5.115 -8.567 1.00 0.00 H new ATOM 0 HB2 GLU B 77 35.796 -5.048 -6.184 1.00 0.00 H new ATOM 0 HB3 GLU B 77 36.313 -6.717 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU B 77 37.787 -5.957 -8.281 1.00 0.00 H new ATOM 0 HG3 GLU B 77 37.416 -4.312 -7.803 1.00 0.00 H new ATOM 2523 N HIS B 78 35.320 -7.009 -10.183 1.00 0.00 N ATOM 2524 CA HIS B 78 35.844 -7.942 -11.169 1.00 0.00 C ATOM 2525 C HIS B 78 37.336 -7.725 -11.350 1.00 0.00 C ATOM 2526 O HIS B 78 38.151 -8.545 -10.932 1.00 0.00 O ATOM 2527 CB HIS B 78 35.128 -7.780 -12.511 1.00 0.00 C ATOM 2528 CG HIS B 78 34.012 -8.754 -12.716 1.00 0.00 C ATOM 2529 ND1 HIS B 78 32.745 -8.566 -12.213 1.00 0.00 N ATOM 2530 CD2 HIS B 78 33.981 -9.936 -13.375 1.00 0.00 C ATOM 2531 CE1 HIS B 78 31.985 -9.591 -12.551 1.00 0.00 C ATOM 2532 NE2 HIS B 78 32.710 -10.437 -13.258 1.00 0.00 N ATOM 0 H HIS B 78 34.746 -6.260 -10.570 1.00 0.00 H new ATOM 0 HA HIS B 78 35.668 -8.955 -10.806 1.00 0.00 H new ATOM 0 HB2 HIS B 78 34.732 -6.767 -12.582 1.00 0.00 H new ATOM 0 HB3 HIS B 78 35.853 -7.896 -13.316 1.00 0.00 H new ATOM 0 HD2 HIS B 78 34.805 -10.399 -13.897 1.00 0.00 H new ATOM 0 HE1 HIS B 78 30.944 -9.716 -12.292 1.00 0.00 H new ATOM 0 HE2 HIS B 78 32.380 -11.318 -13.652 1.00 0.00 H new ATOM 2541 N HIS B 79 37.680 -6.592 -11.944 1.00 0.00 N ATOM 2542 CA HIS B 79 39.069 -6.238 -12.204 1.00 0.00 C ATOM 2543 C HIS B 79 39.131 -4.779 -12.628 1.00 0.00 C ATOM 2544 O HIS B 79 40.025 -4.036 -12.230 1.00 0.00 O ATOM 2545 CB HIS B 79 39.658 -7.133 -13.299 1.00 0.00 C ATOM 2546 CG HIS B 79 41.157 -7.127 -13.356 1.00 0.00 C ATOM 2547 ND1 HIS B 79 41.877 -6.369 -14.250 1.00 0.00 N ATOM 2548 CD2 HIS B 79 42.069 -7.818 -12.634 1.00 0.00 C ATOM 2549 CE1 HIS B 79 43.165 -6.594 -14.079 1.00 0.00 C ATOM 2550 NE2 HIS B 79 43.313 -7.472 -13.104 1.00 0.00 N ATOM 0 H HIS B 79 37.007 -5.893 -12.259 1.00 0.00 H new ATOM 0 HA HIS B 79 39.656 -6.385 -11.298 1.00 0.00 H new ATOM 0 HB2 HIS B 79 39.315 -8.156 -13.141 1.00 0.00 H new ATOM 0 HB3 HIS B 79 39.267 -6.812 -14.265 1.00 0.00 H new ATOM 0 HD2 HIS B 79 41.858 -8.514 -11.835 1.00 0.00 H new ATOM 0 HE1 HIS B 79 43.965 -6.137 -14.642 1.00 0.00 H new ATOM 0 HE2 HIS B 79 44.202 -7.833 -12.758 1.00 0.00 H new ATOM 2559 N HIS B 80 38.160 -4.387 -13.444 1.00 0.00 N ATOM 2560 CA HIS B 80 38.001 -3.000 -13.862 1.00 0.00 C ATOM 2561 C HIS B 80 37.351 -2.203 -12.729 1.00 0.00 C ATOM 2562 O HIS B 80 36.133 -2.244 -12.549 1.00 0.00 O ATOM 2563 CB HIS B 80 37.138 -2.952 -15.130 1.00 0.00 C ATOM 2564 CG HIS B 80 37.130 -1.632 -15.838 1.00 0.00 C ATOM 2565 ND1 HIS B 80 37.933 -1.358 -16.918 1.00 0.00 N ATOM 2566 CD2 HIS B 80 36.376 -0.526 -15.645 1.00 0.00 C ATOM 2567 CE1 HIS B 80 37.676 -0.145 -17.362 1.00 0.00 C ATOM 2568 NE2 HIS B 80 36.731 0.388 -16.608 1.00 0.00 N ATOM 0 H HIS B 80 37.462 -5.020 -13.834 1.00 0.00 H new ATOM 0 HA HIS B 80 38.972 -2.558 -14.084 1.00 0.00 H new ATOM 0 HB2 HIS B 80 37.492 -3.717 -15.822 1.00 0.00 H new ATOM 0 HB3 HIS B 80 36.113 -3.212 -14.864 1.00 0.00 H new ATOM 0 HD2 HIS B 80 35.631 -0.387 -14.875 1.00 0.00 H new ATOM 0 HE1 HIS B 80 38.157 0.334 -18.202 1.00 0.00 H new ATOM 0 HE2 HIS B 80 36.332 1.320 -16.721 1.00 0.00 H new ATOM 2577 N HIS B 81 38.174 -1.508 -11.952 1.00 0.00 N ATOM 2578 CA HIS B 81 37.705 -0.816 -10.751 1.00 0.00 C ATOM 2579 C HIS B 81 36.860 0.404 -11.110 1.00 0.00 C ATOM 2580 O HIS B 81 37.234 1.201 -11.972 1.00 0.00 O ATOM 2581 CB HIS B 81 38.897 -0.393 -9.879 1.00 0.00 C ATOM 2582 CG HIS B 81 38.519 0.042 -8.490 1.00 0.00 C ATOM 2583 ND1 HIS B 81 38.767 1.307 -7.994 1.00 0.00 N ATOM 2584 CD2 HIS B 81 37.927 -0.642 -7.480 1.00 0.00 C ATOM 2585 CE1 HIS B 81 38.343 1.379 -6.745 1.00 0.00 C ATOM 2586 NE2 HIS B 81 37.829 0.212 -6.410 1.00 0.00 N ATOM 0 H HIS B 81 39.173 -1.407 -12.131 1.00 0.00 H new ATOM 0 HA HIS B 81 37.079 -1.509 -10.188 1.00 0.00 H new ATOM 0 HB2 HIS B 81 39.596 -1.226 -9.809 1.00 0.00 H new ATOM 0 HB3 HIS B 81 39.423 0.424 -10.373 1.00 0.00 H new ATOM 0 HD2 HIS B 81 37.594 -1.669 -7.512 1.00 0.00 H new ATOM 0 HE1 HIS B 81 38.407 2.247 -6.106 1.00 0.00 H new ATOM 0 HE2 HIS B 81 37.424 -0.019 -5.503 1.00 0.00 H new ATOM 2595 N HIS B 82 35.712 0.526 -10.456 1.00 0.00 N ATOM 2596 CA HIS B 82 34.839 1.680 -10.636 1.00 0.00 C ATOM 2597 C HIS B 82 35.102 2.710 -9.551 1.00 0.00 C ATOM 2598 O HIS B 82 35.677 3.769 -9.802 1.00 0.00 O ATOM 2599 CB HIS B 82 33.364 1.264 -10.590 1.00 0.00 C ATOM 2600 CG HIS B 82 32.824 0.737 -11.883 1.00 0.00 C ATOM 2601 ND1 HIS B 82 31.930 1.441 -12.654 1.00 0.00 N ATOM 2602 CD2 HIS B 82 33.027 -0.438 -12.522 1.00 0.00 C ATOM 2603 CE1 HIS B 82 31.606 0.726 -13.713 1.00 0.00 C ATOM 2604 NE2 HIS B 82 32.256 -0.424 -13.662 1.00 0.00 N ATOM 0 H HIS B 82 35.362 -0.165 -9.792 1.00 0.00 H new ATOM 0 HA HIS B 82 35.053 2.113 -11.613 1.00 0.00 H new ATOM 0 HB2 HIS B 82 33.239 0.501 -9.822 1.00 0.00 H new ATOM 0 HB3 HIS B 82 32.767 2.124 -10.286 1.00 0.00 H new ATOM 0 HD2 HIS B 82 33.675 -1.239 -12.197 1.00 0.00 H new ATOM 0 HE1 HIS B 82 30.923 1.029 -14.493 1.00 0.00 H new ATOM 0 HE2 HIS B 82 32.196 -1.174 -14.351 1.00 0.00 H new ATOM 2613 N HIS B 83 34.681 2.369 -8.343 1.00 0.00 N ATOM 2614 CA HIS B 83 34.848 3.217 -7.176 1.00 0.00 C ATOM 2615 C HIS B 83 34.354 2.456 -5.952 1.00 0.00 C ATOM 2616 O HIS B 83 33.196 2.669 -5.532 1.00 0.00 O ATOM 2617 CB HIS B 83 34.086 4.542 -7.343 1.00 0.00 C ATOM 2618 CG HIS B 83 34.305 5.520 -6.221 1.00 0.00 C ATOM 2619 ND1 HIS B 83 35.279 6.496 -6.248 1.00 0.00 N ATOM 2620 CD2 HIS B 83 33.662 5.671 -5.041 1.00 0.00 C ATOM 2621 CE1 HIS B 83 35.223 7.200 -5.132 1.00 0.00 C ATOM 2622 NE2 HIS B 83 34.250 6.721 -4.384 1.00 0.00 N ATOM 2623 OXT HIS B 83 35.114 1.609 -5.445 1.00 0.00 O ATOM 0 H HIS B 83 34.209 1.487 -8.145 1.00 0.00 H new ATOM 0 HA HIS B 83 35.902 3.467 -7.053 1.00 0.00 H new ATOM 0 HB2 HIS B 83 34.389 5.007 -8.281 1.00 0.00 H new ATOM 0 HB3 HIS B 83 33.020 4.329 -7.422 1.00 0.00 H new ATOM 0 HD2 HIS B 83 32.837 5.074 -4.682 1.00 0.00 H new ATOM 0 HE1 HIS B 83 35.866 8.029 -4.876 1.00 0.00 H new ATOM 0 HE2 HIS B 83 33.979 7.074 -3.466 1.00 0.00 H new TER 2632 HIS B 83