USER MOD reduce.3.24.130724 H: found=0, std=0, add=1132, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1135 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 54 SER OG : rot 85:sc= 0.19 USER MOD Set 1.2: B 548 GLN : amide:sc= 0.314 K(o=0.5,f=-0.69) USER MOD Set 2.1: A 93 ASN : amide:sc= 0.0874 K(o=-0.083,f=-9.1!) USER MOD Set 2.2: A 95 THR OG1 : rot 180:sc= -0.171 USER MOD Set 3.1: A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 88 MET CE :methyl 167:sc= 0 (180deg=-0.143) USER MOD Set 4.1: A 19 ASN :FLIP amide:sc= 0.253 F(o=-1.4,f=1.5) USER MOD Set 4.2: A 28 THR OG1 : rot 152:sc= 1.21 USER MOD Set 4.3: A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= -0.0565 USER MOD Single : A 3 HIS :FLIP no HD1:sc= -2.2 F(o=-3!,f=-2.2) USER MOD Single : A 4 SER OG : rot 44:sc= 1.23 USER MOD Single : A 11 LYS NZ :NH3+ -161:sc= -0.0683 (180deg=-0.446) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 143:sc= -0.352! USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 36 LYS NZ :NH3+ 168:sc= 0.0142 (180deg=-0.101) USER MOD Single : A 38 HIS :FLIP no HE2:sc= -0.286 F(o=-1.8,f=-0.29) USER MOD Single : A 43 SER OG : rot 170:sc= 0 USER MOD Single : A 44 THR OG1 : rot -52:sc= 1.02 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN :FLIP amide:sc= -0.0449 F(o=-1.3!,f=-0.045) USER MOD Single : A 51 THR OG1 : rot 35:sc= 0.805 USER MOD Single : A 55 SER OG : rot 23:sc= -0.858 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= -1.91! (180deg=-1.91!) USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -121:sc= 1.18 (180deg=0.264) USER MOD Single : A 69 SER OG : rot -91:sc= 1.19 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -168:sc= 0.564 (180deg=0.202) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.0105 K(o=-0.01,f=-1.2!) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0.115 X(o=0.12,f=0) USER MOD Single : A 87 HIS :FLIP no HE2:sc= 0.292 F(o=-1.1,f=0.29) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 MET CE :methyl -127:sc=-0.00939 (180deg=-2.05!) USER MOD Single : A 99 ASN : amide:sc= 0.56 K(o=0.56,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl -165:sc= -0.0574 (180deg=-0.365) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 SER OG : rot -29:sc= 0.0367 USER MOD Single : A 111 TYR OH : rot 130:sc= 0.291 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 520 SER OG : rot 180:sc= 0 USER MOD Single : B 523 TYR OH : rot 180:sc= 0 USER MOD Single : B 525 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 529 SER OG : rot 91:sc= 0.00115 USER MOD Single : B 535 SER OG : rot 180:sc= 0 USER MOD Single : B 536 SER OG : rot -78:sc= 0.374 USER MOD Single : B 540 MET CE :methyl -167:sc= -0.0115 (180deg=-0.242) USER MOD Single : B 543 SER OG : rot -91:sc=0.000617 USER MOD Single : B 547 SER OG : rot 55:sc= 0.381 USER MOD Single : B 550 SER OG : rot 180:sc= 0 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 19.296 0.359 -7.647 1.00 25.00 N ATOM 2 CA PRO A 1 18.458 -0.605 -6.882 1.00 25.00 C ATOM 3 C PRO A 1 19.022 -0.846 -5.482 1.00 25.00 C ATOM 4 O PRO A 1 20.225 -1.074 -5.317 1.00 25.00 O ATOM 5 CB PRO A 1 18.386 -1.915 -7.658 1.00 25.00 C ATOM 6 CG PRO A 1 18.568 -1.486 -9.073 1.00 25.00 C ATOM 7 CD PRO A 1 19.879 -0.405 -8.774 1.00 25.00 C ATOM 0 H2 PRO A 1 20.028 0.754 -7.057 1.00 25.00 H new ATOM 0 H3 PRO A 1 18.735 1.140 -7.988 1.00 25.00 H new ATOM 0 HA PRO A 1 17.458 -0.187 -6.761 1.00 25.00 H new ATOM 0 HB2 PRO A 1 19.165 -2.611 -7.345 1.00 25.00 H new ATOM 0 HB3 PRO A 1 17.430 -2.418 -7.510 1.00 25.00 H new ATOM 0 HG2 PRO A 1 18.827 -2.305 -9.744 1.00 25.00 H new ATOM 0 HG3 PRO A 1 17.690 -0.996 -9.493 1.00 25.00 H new ATOM 0 HD2 PRO A 1 20.798 -0.923 -8.501 1.00 25.00 H new ATOM 0 HD3 PRO A 1 20.111 0.224 -9.634 1.00 25.00 H new ATOM 17 N SER A 2 18.137 -0.787 -4.480 1.00 25.00 N ATOM 18 CA SER A 2 18.522 -1.002 -3.083 1.00 25.00 C ATOM 19 C SER A 2 17.725 -2.147 -2.454 1.00 25.00 C ATOM 20 O SER A 2 18.276 -2.941 -1.685 1.00 25.00 O ATOM 21 CB SER A 2 18.330 0.283 -2.265 1.00 25.00 C ATOM 22 OG SER A 2 16.991 0.742 -2.338 1.00 25.00 O ATOM 0 H SER A 2 17.145 -0.591 -4.613 1.00 25.00 H new ATOM 0 HA SER A 2 19.577 -1.275 -3.072 1.00 25.00 H new ATOM 0 HB2 SER A 2 18.598 0.098 -1.225 1.00 25.00 H new ATOM 0 HB3 SER A 2 19.003 1.057 -2.635 1.00 25.00 H new ATOM 0 HG SER A 2 16.896 1.560 -1.807 1.00 25.00 H new ATOM 28 N HIS A 3 16.414 -2.225 -2.796 1.00 25.00 N ATOM 29 CA HIS A 3 15.476 -3.275 -2.309 1.00 25.00 C ATOM 30 C HIS A 3 15.145 -3.140 -0.816 1.00 25.00 C ATOM 31 O HIS A 3 14.039 -3.489 -0.392 1.00 25.00 O ATOM 32 CB HIS A 3 15.992 -4.701 -2.602 1.00 25.00 C ATOM 33 CG HIS A 3 16.180 -5.005 -4.057 1.00 25.00 C ATOM 34 ND1 HIS A 3 15.300 -5.420 -4.998 1.00 25.00 N flip ATOM 35 CD2 HIS A 3 17.401 -4.906 -4.695 1.00 25.00 C flip ATOM 36 CE1 HIS A 3 15.999 -5.562 -6.173 1.00 25.00 C flip ATOM 37 NE2 HIS A 3 17.262 -5.245 -5.964 1.00 25.00 N flip ATOM 0 H HIS A 3 15.971 -1.555 -3.424 1.00 25.00 H new ATOM 0 HA HIS A 3 14.555 -3.114 -2.870 1.00 25.00 H new ATOM 0 HB2 HIS A 3 16.943 -4.843 -2.088 1.00 25.00 H new ATOM 0 HB3 HIS A 3 15.291 -5.422 -2.180 1.00 25.00 H new ATOM 0 HD2 HIS A 3 18.326 -4.599 -4.229 1.00 25.00 H new ATOM 0 HE1 HIS A 3 15.581 -5.882 -7.116 1.00 25.00 H new ATOM 0 HE2 HIS A 3 18.005 -5.259 -6.663 1.00 25.00 H new ATOM 46 N SER A 4 16.102 -2.631 -0.031 1.00 25.00 N ATOM 47 CA SER A 4 15.931 -2.480 1.411 1.00 25.00 C ATOM 48 C SER A 4 16.381 -1.101 1.881 1.00 25.00 C ATOM 49 O SER A 4 17.358 -0.544 1.369 1.00 25.00 O ATOM 50 CB SER A 4 16.697 -3.574 2.166 1.00 25.00 C ATOM 51 OG SER A 4 16.545 -3.444 3.571 1.00 25.00 O ATOM 0 H SER A 4 17.008 -2.316 -0.378 1.00 25.00 H new ATOM 0 HA SER A 4 14.868 -2.582 1.629 1.00 25.00 H new ATOM 0 HB2 SER A 4 16.339 -4.554 1.850 1.00 25.00 H new ATOM 0 HB3 SER A 4 17.755 -3.523 1.908 1.00 25.00 H new ATOM 0 HG SER A 4 15.606 -3.261 3.783 1.00 25.00 H new ATOM 57 N GLY A 5 15.651 -0.567 2.860 1.00 25.00 N ATOM 58 CA GLY A 5 15.963 0.735 3.417 1.00 25.00 C ATOM 59 C GLY A 5 15.482 0.871 4.846 1.00 25.00 C ATOM 60 O GLY A 5 15.971 0.173 5.738 1.00 25.00 O ATOM 0 H GLY A 5 14.840 -1.022 3.279 1.00 25.00 H new ATOM 0 HA2 GLY A 5 17.040 0.896 3.380 1.00 25.00 H new ATOM 0 HA3 GLY A 5 15.504 1.511 2.805 1.00 25.00 H new ATOM 64 N ALA A 6 14.528 1.785 5.061 1.00 25.00 N ATOM 65 CA ALA A 6 13.889 1.968 6.367 1.00 25.00 C ATOM 66 C ALA A 6 12.435 2.406 6.198 1.00 25.00 C ATOM 67 O ALA A 6 12.155 3.375 5.484 1.00 25.00 O ATOM 68 CB ALA A 6 14.645 2.986 7.208 1.00 25.00 C ATOM 0 H ALA A 6 14.180 2.415 4.338 1.00 25.00 H new ATOM 0 HA ALA A 6 13.911 1.009 6.885 1.00 25.00 H new ATOM 0 HB1 ALA A 6 14.149 3.102 8.172 1.00 25.00 H new ATOM 0 HB2 ALA A 6 15.667 2.641 7.365 1.00 25.00 H new ATOM 0 HB3 ALA A 6 14.661 3.945 6.690 1.00 25.00 H new ATOM 74 N ALA A 7 11.513 1.685 6.852 1.00 25.00 N ATOM 75 CA ALA A 7 10.078 1.978 6.742 1.00 25.00 C ATOM 76 C ALA A 7 9.343 1.752 8.068 1.00 25.00 C ATOM 77 O ALA A 7 9.763 0.938 8.892 1.00 25.00 O ATOM 78 CB ALA A 7 9.451 1.125 5.649 1.00 25.00 C ATOM 0 H ALA A 7 11.735 0.897 7.461 1.00 25.00 H new ATOM 0 HA ALA A 7 9.979 3.032 6.484 1.00 25.00 H new ATOM 0 HB1 ALA A 7 8.387 1.351 5.577 1.00 25.00 H new ATOM 0 HB2 ALA A 7 9.934 1.342 4.696 1.00 25.00 H new ATOM 0 HB3 ALA A 7 9.582 0.070 5.890 1.00 25.00 H new ATOM 84 N ILE A 8 8.237 2.487 8.252 1.00 25.00 N ATOM 85 CA ILE A 8 7.365 2.337 9.426 1.00 25.00 C ATOM 86 C ILE A 8 6.017 1.739 8.983 1.00 25.00 C ATOM 87 O ILE A 8 5.480 2.111 7.938 1.00 25.00 O ATOM 88 CB ILE A 8 7.143 3.705 10.162 1.00 25.00 C ATOM 89 CG1 ILE A 8 8.486 4.263 10.683 1.00 25.00 C ATOM 90 CG2 ILE A 8 6.135 3.570 11.319 1.00 25.00 C ATOM 91 CD1 ILE A 8 8.421 5.674 11.245 1.00 25.00 C ATOM 0 H ILE A 8 7.922 3.200 7.594 1.00 25.00 H new ATOM 0 HA ILE A 8 7.851 1.666 10.134 1.00 25.00 H new ATOM 0 HB ILE A 8 6.726 4.405 9.438 1.00 25.00 H new ATOM 0 HG12 ILE A 8 8.863 3.596 11.459 1.00 25.00 H new ATOM 0 HG13 ILE A 8 9.210 4.246 9.868 1.00 25.00 H new ATOM 0 HG21 ILE A 8 6.007 4.537 11.805 1.00 25.00 H new ATOM 0 HG22 ILE A 8 5.176 3.231 10.928 1.00 25.00 H new ATOM 0 HG23 ILE A 8 6.508 2.846 12.044 1.00 25.00 H new ATOM 0 HD11 ILE A 8 9.412 5.976 11.585 1.00 25.00 H new ATOM 0 HD12 ILE A 8 8.079 6.359 10.469 1.00 25.00 H new ATOM 0 HD13 ILE A 8 7.726 5.700 12.084 1.00 25.00 H new ATOM 103 N PHE A 9 5.490 0.813 9.792 1.00 25.00 N ATOM 104 CA PHE A 9 4.227 0.132 9.497 1.00 25.00 C ATOM 105 C PHE A 9 3.441 -0.073 10.786 1.00 25.00 C ATOM 106 O PHE A 9 3.877 -0.796 11.679 1.00 25.00 O ATOM 107 CB PHE A 9 4.497 -1.214 8.792 1.00 25.00 C ATOM 108 CG PHE A 9 3.270 -1.925 8.263 1.00 25.00 C ATOM 109 CD1 PHE A 9 2.701 -1.557 7.052 1.00 25.00 C ATOM 110 CD2 PHE A 9 2.699 -2.971 8.975 1.00 25.00 C ATOM 111 CE1 PHE A 9 1.588 -2.211 6.565 1.00 25.00 C ATOM 112 CE2 PHE A 9 1.585 -3.629 8.492 1.00 25.00 C ATOM 113 CZ PHE A 9 1.028 -3.249 7.285 1.00 25.00 C ATOM 0 H PHE A 9 5.926 0.517 10.665 1.00 25.00 H new ATOM 0 HA PHE A 9 3.633 0.750 8.824 1.00 25.00 H new ATOM 0 HB2 PHE A 9 5.182 -1.040 7.962 1.00 25.00 H new ATOM 0 HB3 PHE A 9 5.007 -1.876 9.492 1.00 25.00 H new ATOM 0 HD1 PHE A 9 3.135 -0.748 6.483 1.00 25.00 H new ATOM 0 HD2 PHE A 9 3.131 -3.274 9.917 1.00 25.00 H new ATOM 0 HE1 PHE A 9 1.155 -1.912 5.622 1.00 25.00 H new ATOM 0 HE2 PHE A 9 1.149 -4.440 9.057 1.00 25.00 H new ATOM 0 HZ PHE A 9 0.157 -3.762 6.906 1.00 25.00 H new ATOM 123 N GLU A 10 2.267 0.576 10.863 1.00 25.00 N ATOM 124 CA GLU A 10 1.383 0.543 12.056 1.00 25.00 C ATOM 125 C GLU A 10 2.081 1.119 13.297 1.00 25.00 C ATOM 126 O GLU A 10 2.039 0.549 14.396 1.00 25.00 O ATOM 127 CB GLU A 10 0.852 -0.879 12.326 1.00 25.00 C ATOM 128 CG GLU A 10 -0.003 -1.436 11.198 1.00 25.00 C ATOM 129 CD GLU A 10 -0.472 -2.854 11.462 1.00 25.00 C ATOM 130 OE1 GLU A 10 -0.215 -3.369 12.570 1.00 25.00 O ATOM 131 OE2 GLU A 10 -1.095 -3.450 10.558 1.00 25.00 O ATOM 0 H GLU A 10 1.897 1.143 10.100 1.00 25.00 H new ATOM 0 HA GLU A 10 0.526 1.181 11.838 1.00 25.00 H new ATOM 0 HB2 GLU A 10 1.697 -1.547 12.494 1.00 25.00 H new ATOM 0 HB3 GLU A 10 0.265 -0.870 13.245 1.00 25.00 H new ATOM 0 HG2 GLU A 10 -0.871 -0.792 11.054 1.00 25.00 H new ATOM 0 HG3 GLU A 10 0.568 -1.414 10.270 1.00 25.00 H new ATOM 138 N LYS A 11 2.726 2.280 13.084 1.00 25.00 N ATOM 139 CA LYS A 11 3.347 3.106 14.145 1.00 25.00 C ATOM 140 C LYS A 11 4.580 2.449 14.798 1.00 25.00 C ATOM 141 O LYS A 11 5.256 3.076 15.621 1.00 25.00 O ATOM 142 CB LYS A 11 2.314 3.516 15.222 1.00 25.00 C ATOM 143 CG LYS A 11 1.151 4.384 14.719 1.00 25.00 C ATOM 144 CD LYS A 11 0.142 4.755 15.807 1.00 25.00 C ATOM 145 CE LYS A 11 -0.689 3.550 16.222 1.00 25.00 C ATOM 146 NZ LYS A 11 -1.518 3.020 15.101 1.00 25.00 N ATOM 0 H LYS A 11 2.834 2.682 12.153 1.00 25.00 H new ATOM 0 HA LYS A 11 3.706 4.004 13.642 1.00 25.00 H new ATOM 0 HB2 LYS A 11 1.903 2.612 15.671 1.00 25.00 H new ATOM 0 HB3 LYS A 11 2.834 4.057 16.013 1.00 25.00 H new ATOM 0 HG2 LYS A 11 1.554 5.298 14.283 1.00 25.00 H new ATOM 0 HG3 LYS A 11 0.632 3.853 13.921 1.00 25.00 H new ATOM 0 HD2 LYS A 11 0.669 5.153 16.674 1.00 25.00 H new ATOM 0 HD3 LYS A 11 -0.515 5.545 15.443 1.00 25.00 H new ATOM 0 HE2 LYS A 11 -0.028 2.763 16.585 1.00 25.00 H new ATOM 0 HE3 LYS A 11 -1.339 3.828 17.052 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 -2.286 2.432 15.485 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 -1.924 3.813 14.565 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 -0.923 2.445 14.471 1.00 25.00 H new ATOM 160 N VAL A 12 4.870 1.196 14.422 1.00 25.00 N ATOM 161 CA VAL A 12 6.101 0.517 14.832 1.00 25.00 C ATOM 162 C VAL A 12 7.155 0.681 13.725 1.00 25.00 C ATOM 163 O VAL A 12 6.937 0.262 12.586 1.00 25.00 O ATOM 164 CB VAL A 12 5.844 -0.996 15.200 1.00 25.00 C ATOM 165 CG1 VAL A 12 7.095 -1.680 15.728 1.00 25.00 C ATOM 166 CG2 VAL A 12 4.692 -1.176 16.193 1.00 25.00 C ATOM 0 H VAL A 12 4.262 0.631 13.830 1.00 25.00 H new ATOM 0 HA VAL A 12 6.479 0.979 15.744 1.00 25.00 H new ATOM 0 HB VAL A 12 5.558 -1.476 14.264 1.00 25.00 H new ATOM 0 HG11 VAL A 12 6.868 -2.719 15.967 1.00 25.00 H new ATOM 0 HG12 VAL A 12 7.877 -1.645 14.969 1.00 25.00 H new ATOM 0 HG13 VAL A 12 7.438 -1.167 16.627 1.00 25.00 H new ATOM 0 HG21 VAL A 12 4.561 -2.236 16.410 1.00 25.00 H new ATOM 0 HG22 VAL A 12 4.920 -0.643 17.116 1.00 25.00 H new ATOM 0 HG23 VAL A 12 3.774 -0.777 15.761 1.00 25.00 H new ATOM 176 N SER A 13 8.282 1.310 14.076 1.00 25.00 N ATOM 177 CA SER A 13 9.334 1.608 13.103 1.00 25.00 C ATOM 178 C SER A 13 10.213 0.392 12.844 1.00 25.00 C ATOM 179 O SER A 13 10.596 -0.325 13.775 1.00 25.00 O ATOM 180 CB SER A 13 10.179 2.804 13.563 1.00 25.00 C ATOM 181 OG SER A 13 11.380 2.912 12.813 1.00 25.00 O ATOM 0 H SER A 13 8.487 1.621 15.025 1.00 25.00 H new ATOM 0 HA SER A 13 8.850 1.872 12.163 1.00 25.00 H new ATOM 0 HB2 SER A 13 9.600 3.722 13.459 1.00 25.00 H new ATOM 0 HB3 SER A 13 10.418 2.697 14.621 1.00 25.00 H new ATOM 0 HG SER A 13 11.895 3.684 13.129 1.00 25.00 H new ATOM 187 N GLY A 14 10.513 0.174 11.564 1.00 25.00 N ATOM 188 CA GLY A 14 11.282 -0.985 11.160 1.00 25.00 C ATOM 189 C GLY A 14 12.086 -0.754 9.901 1.00 25.00 C ATOM 190 O GLY A 14 12.363 0.388 9.524 1.00 25.00 O ATOM 0 H GLY A 14 10.233 0.786 10.798 1.00 25.00 H new ATOM 0 HA2 GLY A 14 11.957 -1.266 11.969 1.00 25.00 H new ATOM 0 HA3 GLY A 14 10.606 -1.825 11.003 1.00 25.00 H new ATOM 194 N ILE A 15 12.461 -1.858 9.260 1.00 25.00 N ATOM 195 CA ILE A 15 13.237 -1.836 8.025 1.00 25.00 C ATOM 196 C ILE A 15 12.502 -2.650 6.943 1.00 25.00 C ATOM 197 O ILE A 15 11.977 -3.732 7.223 1.00 25.00 O ATOM 198 CB ILE A 15 14.687 -2.391 8.278 1.00 25.00 C ATOM 199 CG1 ILE A 15 15.556 -1.404 9.115 1.00 25.00 C ATOM 200 CG2 ILE A 15 15.416 -2.786 6.984 1.00 25.00 C ATOM 201 CD1 ILE A 15 16.903 -1.926 9.614 1.00 25.00 C ATOM 0 H ILE A 15 12.233 -2.798 9.585 1.00 25.00 H new ATOM 0 HA ILE A 15 13.337 -0.809 7.675 1.00 25.00 H new ATOM 0 HB ILE A 15 14.549 -3.302 8.860 1.00 25.00 H new ATOM 0 HG12 ILE A 15 15.739 -0.515 8.511 1.00 25.00 H new ATOM 0 HG13 ILE A 15 14.973 -1.087 9.980 1.00 25.00 H new ATOM 0 HG21 ILE A 15 16.410 -3.161 7.227 1.00 25.00 H new ATOM 0 HG22 ILE A 15 14.850 -3.563 6.470 1.00 25.00 H new ATOM 0 HG23 ILE A 15 15.505 -1.914 6.336 1.00 25.00 H new ATOM 0 HD11 ILE A 15 17.408 -1.145 10.181 1.00 25.00 H new ATOM 0 HD12 ILE A 15 16.742 -2.793 10.254 1.00 25.00 H new ATOM 0 HD13 ILE A 15 17.520 -2.213 8.763 1.00 25.00 H new ATOM 213 N ILE A 16 12.480 -2.115 5.715 1.00 25.00 N ATOM 214 CA ILE A 16 11.789 -2.759 4.595 1.00 25.00 C ATOM 215 C ILE A 16 12.795 -3.500 3.693 1.00 25.00 C ATOM 216 O ILE A 16 13.880 -2.985 3.420 1.00 25.00 O ATOM 217 CB ILE A 16 10.919 -1.704 3.812 1.00 25.00 C ATOM 218 CG1 ILE A 16 9.856 -2.441 2.961 1.00 25.00 C ATOM 219 CG2 ILE A 16 11.749 -0.722 2.952 1.00 25.00 C ATOM 220 CD1 ILE A 16 8.432 -1.913 3.104 1.00 25.00 C ATOM 0 H ILE A 16 12.935 -1.235 5.474 1.00 25.00 H new ATOM 0 HA ILE A 16 11.101 -3.514 4.977 1.00 25.00 H new ATOM 0 HB ILE A 16 10.427 -1.079 4.557 1.00 25.00 H new ATOM 0 HG12 ILE A 16 10.146 -2.379 1.912 1.00 25.00 H new ATOM 0 HG13 ILE A 16 9.864 -3.497 3.232 1.00 25.00 H new ATOM 0 HG21 ILE A 16 11.080 -0.028 2.444 1.00 25.00 H new ATOM 0 HG22 ILE A 16 12.432 -0.165 3.593 1.00 25.00 H new ATOM 0 HG23 ILE A 16 12.321 -1.281 2.212 1.00 25.00 H new ATOM 0 HD11 ILE A 16 7.763 -2.494 2.469 1.00 25.00 H new ATOM 0 HD12 ILE A 16 8.114 -2.001 4.143 1.00 25.00 H new ATOM 0 HD13 ILE A 16 8.400 -0.866 2.802 1.00 25.00 H new ATOM 232 N ALA A 17 12.425 -4.711 3.264 1.00 25.00 N ATOM 233 CA ALA A 17 13.265 -5.518 2.370 1.00 25.00 C ATOM 234 C ALA A 17 12.431 -6.180 1.273 1.00 25.00 C ATOM 235 O ALA A 17 11.310 -6.622 1.525 1.00 25.00 O ATOM 236 CB ALA A 17 14.030 -6.571 3.164 1.00 25.00 C ATOM 0 H ALA A 17 11.545 -5.157 3.523 1.00 25.00 H new ATOM 0 HA ALA A 17 13.981 -4.850 1.891 1.00 25.00 H new ATOM 0 HB1 ALA A 17 14.648 -7.160 2.486 1.00 25.00 H new ATOM 0 HB2 ALA A 17 14.666 -6.080 3.901 1.00 25.00 H new ATOM 0 HB3 ALA A 17 13.324 -7.226 3.674 1.00 25.00 H new ATOM 242 N ILE A 18 12.989 -6.246 0.056 1.00 25.00 N ATOM 243 CA ILE A 18 12.315 -6.897 -1.077 1.00 25.00 C ATOM 244 C ILE A 18 12.895 -8.305 -1.307 1.00 25.00 C ATOM 245 O ILE A 18 14.115 -8.494 -1.347 1.00 25.00 O ATOM 246 CB ILE A 18 12.410 -6.042 -2.386 1.00 25.00 C ATOM 247 CG1 ILE A 18 11.628 -4.723 -2.216 1.00 25.00 C ATOM 248 CG2 ILE A 18 11.899 -6.822 -3.604 1.00 25.00 C ATOM 249 CD1 ILE A 18 11.803 -3.723 -3.344 1.00 25.00 C ATOM 0 H ILE A 18 13.905 -5.857 -0.169 1.00 25.00 H new ATOM 0 HA ILE A 18 11.258 -6.985 -0.824 1.00 25.00 H new ATOM 0 HB ILE A 18 13.460 -5.810 -2.563 1.00 25.00 H new ATOM 0 HG12 ILE A 18 10.568 -4.957 -2.119 1.00 25.00 H new ATOM 0 HG13 ILE A 18 11.937 -4.253 -1.283 1.00 25.00 H new ATOM 0 HG21 ILE A 18 11.979 -6.199 -4.495 1.00 25.00 H new ATOM 0 HG22 ILE A 18 12.498 -7.723 -3.736 1.00 25.00 H new ATOM 0 HG23 ILE A 18 10.856 -7.099 -3.448 1.00 25.00 H new ATOM 0 HD11 ILE A 18 11.215 -2.830 -3.133 1.00 25.00 H new ATOM 0 HD12 ILE A 18 12.855 -3.452 -3.430 1.00 25.00 H new ATOM 0 HD13 ILE A 18 11.465 -4.167 -4.280 1.00 25.00 H new ATOM 261 N ASN A 19 11.987 -9.270 -1.453 1.00 25.00 N ATOM 262 CA ASN A 19 12.327 -10.667 -1.711 1.00 25.00 C ATOM 263 C ASN A 19 12.135 -11.017 -3.197 1.00 25.00 C ATOM 264 O ASN A 19 11.004 -11.103 -3.684 1.00 25.00 O ATOM 265 CB ASN A 19 11.439 -11.572 -0.833 1.00 25.00 C ATOM 266 CG ASN A 19 11.641 -11.380 0.669 1.00 25.00 C ATOM 267 OD1 ASN A 19 10.682 -11.819 1.480 1.00 25.00 O flip ATOM 268 ND2 ASN A 19 12.672 -10.858 1.096 1.00 25.00 N flip ATOM 0 H ASN A 19 10.983 -9.100 -1.395 1.00 25.00 H new ATOM 0 HA ASN A 19 13.377 -10.827 -1.464 1.00 25.00 H new ATOM 0 HB2 ASN A 19 10.393 -11.381 -1.075 1.00 25.00 H new ATOM 0 HB3 ASN A 19 11.639 -12.613 -1.085 1.00 25.00 H new ATOM 0 HD21 ASN A 19 13.386 -10.533 0.445 1.00 25.00 H new ATOM 0 HD22 ASN A 19 12.811 -10.751 2.101 1.00 25.00 H new ATOM 275 N GLU A 20 13.256 -11.195 -3.907 1.00 25.00 N ATOM 276 CA GLU A 20 13.249 -11.657 -5.302 1.00 25.00 C ATOM 277 C GLU A 20 14.075 -12.945 -5.417 1.00 25.00 C ATOM 278 O GLU A 20 14.794 -13.302 -4.478 1.00 25.00 O ATOM 279 CB GLU A 20 13.791 -10.576 -6.261 1.00 25.00 C ATOM 280 CG GLU A 20 13.010 -9.265 -6.265 1.00 25.00 C ATOM 281 CD GLU A 20 13.435 -8.340 -7.388 1.00 25.00 C ATOM 282 OE1 GLU A 20 13.364 -8.759 -8.563 1.00 25.00 O ATOM 283 OE2 GLU A 20 13.835 -7.196 -7.097 1.00 25.00 O ATOM 0 H GLU A 20 14.190 -11.024 -3.534 1.00 25.00 H new ATOM 0 HA GLU A 20 12.218 -11.859 -5.594 1.00 25.00 H new ATOM 0 HB2 GLU A 20 14.827 -10.363 -5.996 1.00 25.00 H new ATOM 0 HB3 GLU A 20 13.798 -10.980 -7.273 1.00 25.00 H new ATOM 0 HG2 GLU A 20 11.946 -9.480 -6.359 1.00 25.00 H new ATOM 0 HG3 GLU A 20 13.150 -8.759 -5.310 1.00 25.00 H new ATOM 290 N ASP A 21 13.965 -13.647 -6.575 1.00 25.00 N ATOM 291 CA ASP A 21 14.573 -14.996 -6.787 1.00 25.00 C ATOM 292 C ASP A 21 13.861 -16.081 -5.960 1.00 25.00 C ATOM 293 O ASP A 21 14.256 -17.252 -5.948 1.00 25.00 O ATOM 294 CB ASP A 21 16.073 -15.007 -6.485 1.00 25.00 C ATOM 295 CG ASP A 21 16.860 -14.060 -7.371 1.00 25.00 C ATOM 296 OD1 ASP A 21 16.639 -14.074 -8.601 1.00 25.00 O ATOM 297 OD2 ASP A 21 17.699 -13.306 -6.835 1.00 25.00 O ATOM 0 H ASP A 21 13.455 -13.299 -7.387 1.00 25.00 H new ATOM 0 HA ASP A 21 14.439 -15.225 -7.844 1.00 25.00 H new ATOM 0 HB2 ASP A 21 16.230 -14.735 -5.441 1.00 25.00 H new ATOM 0 HB3 ASP A 21 16.457 -16.019 -6.612 1.00 25.00 H new ATOM 302 N VAL A 22 12.800 -15.650 -5.293 1.00 25.00 N ATOM 303 CA VAL A 22 11.923 -16.500 -4.484 1.00 25.00 C ATOM 304 C VAL A 22 10.629 -16.815 -5.255 1.00 25.00 C ATOM 305 O VAL A 22 10.517 -16.490 -6.443 1.00 25.00 O ATOM 306 CB VAL A 22 11.589 -15.838 -3.099 1.00 25.00 C ATOM 307 CG1 VAL A 22 12.838 -15.756 -2.232 1.00 25.00 C ATOM 308 CG2 VAL A 22 10.954 -14.440 -3.245 1.00 25.00 C ATOM 0 H VAL A 22 12.513 -14.671 -5.297 1.00 25.00 H new ATOM 0 HA VAL A 22 12.454 -17.431 -4.284 1.00 25.00 H new ATOM 0 HB VAL A 22 10.851 -16.478 -2.616 1.00 25.00 H new ATOM 0 HG11 VAL A 22 12.588 -15.295 -1.277 1.00 25.00 H new ATOM 0 HG12 VAL A 22 13.228 -16.759 -2.060 1.00 25.00 H new ATOM 0 HG13 VAL A 22 13.594 -15.155 -2.738 1.00 25.00 H new ATOM 0 HG21 VAL A 22 10.744 -14.031 -2.257 1.00 25.00 H new ATOM 0 HG22 VAL A 22 11.643 -13.781 -3.772 1.00 25.00 H new ATOM 0 HG23 VAL A 22 10.025 -14.520 -3.809 1.00 25.00 H new ATOM 318 N SER A 23 9.663 -17.453 -4.578 1.00 25.00 N ATOM 319 CA SER A 23 8.322 -17.646 -5.145 1.00 25.00 C ATOM 320 C SER A 23 7.650 -16.261 -5.084 1.00 25.00 C ATOM 321 O SER A 23 8.072 -15.455 -4.250 1.00 25.00 O ATOM 322 CB SER A 23 7.564 -18.687 -4.315 1.00 25.00 C ATOM 323 OG SER A 23 7.269 -18.212 -3.014 1.00 25.00 O ATOM 0 H SER A 23 9.785 -17.842 -3.643 1.00 25.00 H new ATOM 0 HA SER A 23 8.341 -18.018 -6.170 1.00 25.00 H new ATOM 0 HB2 SER A 23 6.637 -18.952 -4.824 1.00 25.00 H new ATOM 0 HB3 SER A 23 8.159 -19.597 -4.243 1.00 25.00 H new ATOM 0 HG SER A 23 6.784 -18.903 -2.516 1.00 25.00 H new ATOM 329 N PRO A 24 6.587 -15.930 -5.889 1.00 25.00 N ATOM 330 CA PRO A 24 6.497 -14.590 -6.520 1.00 25.00 C ATOM 331 C PRO A 24 6.930 -13.443 -5.607 1.00 25.00 C ATOM 332 O PRO A 24 6.491 -13.332 -4.457 1.00 25.00 O ATOM 333 CB PRO A 24 5.007 -14.472 -6.832 1.00 25.00 C ATOM 334 CG PRO A 24 4.564 -15.870 -7.078 1.00 25.00 C ATOM 335 CD PRO A 24 5.387 -16.747 -6.188 1.00 25.00 C ATOM 0 HA PRO A 24 7.162 -14.511 -7.380 1.00 25.00 H new ATOM 0 HB2 PRO A 24 4.462 -14.024 -6.001 1.00 25.00 H new ATOM 0 HB3 PRO A 24 4.833 -13.842 -7.704 1.00 25.00 H new ATOM 0 HG2 PRO A 24 3.502 -15.984 -6.858 1.00 25.00 H new ATOM 0 HG3 PRO A 24 4.704 -16.141 -8.124 1.00 25.00 H new ATOM 0 HD2 PRO A 24 4.847 -17.011 -5.279 1.00 25.00 H new ATOM 0 HD3 PRO A 24 5.653 -17.681 -6.683 1.00 25.00 H new ATOM 343 N ALA A 25 7.818 -12.598 -6.172 1.00 25.00 N ATOM 344 CA ALA A 25 8.565 -11.571 -5.433 1.00 25.00 C ATOM 345 C ALA A 25 7.698 -10.745 -4.515 1.00 25.00 C ATOM 346 O ALA A 25 6.584 -10.346 -4.863 1.00 25.00 O ATOM 347 CB ALA A 25 9.333 -10.676 -6.392 1.00 25.00 C ATOM 0 H ALA A 25 8.036 -12.614 -7.168 1.00 25.00 H new ATOM 0 HA ALA A 25 9.269 -12.104 -4.793 1.00 25.00 H new ATOM 0 HB1 ALA A 25 9.880 -9.922 -5.827 1.00 25.00 H new ATOM 0 HB2 ALA A 25 10.036 -11.278 -6.968 1.00 25.00 H new ATOM 0 HB3 ALA A 25 8.635 -10.186 -7.070 1.00 25.00 H new ATOM 353 N GLU A 26 8.248 -10.517 -3.333 1.00 25.00 N ATOM 354 CA GLU A 26 7.506 -9.970 -2.222 1.00 25.00 C ATOM 355 C GLU A 26 8.160 -8.686 -1.699 1.00 25.00 C ATOM 356 O GLU A 26 9.213 -8.270 -2.177 1.00 25.00 O ATOM 357 CB GLU A 26 7.380 -11.016 -1.091 1.00 25.00 C ATOM 358 CG GLU A 26 7.139 -12.463 -1.539 1.00 25.00 C ATOM 359 CD GLU A 26 7.248 -13.458 -0.398 1.00 25.00 C ATOM 360 OE1 GLU A 26 8.109 -13.259 0.485 1.00 25.00 O ATOM 361 OE2 GLU A 26 6.469 -14.436 -0.389 1.00 25.00 O ATOM 0 H GLU A 26 9.227 -10.709 -3.122 1.00 25.00 H new ATOM 0 HA GLU A 26 6.506 -9.716 -2.575 1.00 25.00 H new ATOM 0 HB2 GLU A 26 8.291 -10.988 -0.494 1.00 25.00 H new ATOM 0 HB3 GLU A 26 6.561 -10.718 -0.437 1.00 25.00 H new ATOM 0 HG2 GLU A 26 6.149 -12.539 -1.988 1.00 25.00 H new ATOM 0 HG3 GLU A 26 7.861 -12.724 -2.313 1.00 25.00 H new ATOM 368 N LEU A 27 7.457 -8.021 -0.783 1.00 25.00 N ATOM 369 CA LEU A 27 7.954 -6.847 -0.075 1.00 25.00 C ATOM 370 C LEU A 27 7.755 -7.081 1.422 1.00 25.00 C ATOM 371 O LEU A 27 6.631 -7.037 1.929 1.00 25.00 O ATOM 372 CB LEU A 27 7.224 -5.586 -0.618 1.00 25.00 C ATOM 373 CG LEU A 27 7.434 -4.202 0.059 1.00 25.00 C ATOM 374 CD1 LEU A 27 8.819 -3.620 -0.176 1.00 25.00 C ATOM 375 CD2 LEU A 27 6.363 -3.194 -0.336 1.00 25.00 C ATOM 0 H LEU A 27 6.512 -8.289 -0.509 1.00 25.00 H new ATOM 0 HA LEU A 27 9.019 -6.680 -0.239 1.00 25.00 H new ATOM 0 HB2 LEU A 27 7.504 -5.478 -1.666 1.00 25.00 H new ATOM 0 HB3 LEU A 27 6.155 -5.797 -0.594 1.00 25.00 H new ATOM 0 HG LEU A 27 7.343 -4.397 1.128 1.00 25.00 H new ATOM 0 HD11 LEU A 27 8.897 -2.654 0.324 1.00 25.00 H new ATOM 0 HD12 LEU A 27 9.572 -4.299 0.225 1.00 25.00 H new ATOM 0 HD13 LEU A 27 8.982 -3.489 -1.246 1.00 25.00 H new ATOM 0 HD21 LEU A 27 6.555 -2.244 0.163 1.00 25.00 H new ATOM 0 HD22 LEU A 27 6.383 -3.047 -1.416 1.00 25.00 H new ATOM 0 HD23 LEU A 27 5.383 -3.569 -0.039 1.00 25.00 H new ATOM 387 N THR A 28 8.861 -7.352 2.114 1.00 25.00 N ATOM 388 CA THR A 28 8.814 -7.777 3.510 1.00 25.00 C ATOM 389 C THR A 28 9.271 -6.659 4.445 1.00 25.00 C ATOM 390 O THR A 28 10.446 -6.274 4.450 1.00 25.00 O ATOM 391 CB THR A 28 9.682 -9.046 3.735 1.00 25.00 C ATOM 392 OG1 THR A 28 9.218 -10.110 2.892 1.00 25.00 O ATOM 393 CG2 THR A 28 9.630 -9.521 5.188 1.00 25.00 C ATOM 0 H THR A 28 9.803 -7.284 1.728 1.00 25.00 H new ATOM 0 HA THR A 28 7.777 -8.018 3.742 1.00 25.00 H new ATOM 0 HB THR A 28 10.711 -8.781 3.491 1.00 25.00 H new ATOM 0 HG1 THR A 28 9.962 -10.716 2.690 1.00 25.00 H new ATOM 0 HG21 THR A 28 10.250 -10.410 5.303 1.00 25.00 H new ATOM 0 HG22 THR A 28 10.002 -8.732 5.842 1.00 25.00 H new ATOM 0 HG23 THR A 28 8.601 -9.759 5.456 1.00 25.00 H new ATOM 401 N TRP A 29 8.321 -6.142 5.231 1.00 25.00 N ATOM 402 CA TRP A 29 8.628 -5.212 6.312 1.00 25.00 C ATOM 403 C TRP A 29 8.946 -5.995 7.584 1.00 25.00 C ATOM 404 O TRP A 29 8.212 -6.912 7.963 1.00 25.00 O ATOM 405 CB TRP A 29 7.457 -4.232 6.559 1.00 25.00 C ATOM 406 CG TRP A 29 7.702 -3.254 7.693 1.00 25.00 C ATOM 407 CD1 TRP A 29 8.262 -2.013 7.598 1.00 25.00 C ATOM 408 CD2 TRP A 29 7.412 -3.454 9.090 1.00 25.00 C ATOM 409 NE1 TRP A 29 8.347 -1.433 8.843 1.00 25.00 N ATOM 410 CE2 TRP A 29 7.828 -2.295 9.773 1.00 25.00 C ATOM 411 CE3 TRP A 29 6.841 -4.498 9.831 1.00 25.00 C ATOM 412 CZ2 TRP A 29 7.695 -2.155 11.153 1.00 25.00 C ATOM 413 CZ3 TRP A 29 6.711 -4.353 11.199 1.00 25.00 C ATOM 414 CH2 TRP A 29 7.136 -3.188 11.846 1.00 25.00 C ATOM 0 H TRP A 29 7.328 -6.356 5.134 1.00 25.00 H new ATOM 0 HA TRP A 29 9.497 -4.621 6.024 1.00 25.00 H new ATOM 0 HB2 TRP A 29 7.266 -3.671 5.644 1.00 25.00 H new ATOM 0 HB3 TRP A 29 6.556 -4.806 6.775 1.00 25.00 H new ATOM 0 HD1 TRP A 29 8.591 -1.552 6.678 1.00 25.00 H new ATOM 0 HE1 TRP A 29 8.734 -0.510 9.041 1.00 25.00 H new ATOM 0 HE3 TRP A 29 6.508 -5.401 9.341 1.00 25.00 H new ATOM 0 HZ2 TRP A 29 8.024 -1.258 11.657 1.00 25.00 H new ATOM 0 HZ3 TRP A 29 6.274 -5.153 11.778 1.00 25.00 H new ATOM 0 HH2 TRP A 29 7.019 -3.105 12.916 1.00 25.00 H new ATOM 425 N ARG A 30 10.048 -5.624 8.222 1.00 25.00 N ATOM 426 CA ARG A 30 10.424 -6.185 9.514 1.00 25.00 C ATOM 427 C ARG A 30 10.667 -5.062 10.507 1.00 25.00 C ATOM 428 O ARG A 30 10.956 -3.931 10.109 1.00 25.00 O ATOM 429 CB ARG A 30 11.671 -7.064 9.389 1.00 25.00 C ATOM 430 CG ARG A 30 11.480 -8.265 8.485 1.00 25.00 C ATOM 431 CD ARG A 30 12.770 -9.024 8.282 1.00 25.00 C ATOM 432 NE ARG A 30 13.718 -8.279 7.445 1.00 25.00 N ATOM 433 CZ ARG A 30 14.997 -8.629 7.238 1.00 25.00 C ATOM 434 NH1 ARG A 30 15.513 -9.726 7.791 1.00 25.00 N ATOM 435 NH2 ARG A 30 15.764 -7.870 6.465 1.00 25.00 N ATOM 0 H ARG A 30 10.703 -4.930 7.862 1.00 25.00 H new ATOM 0 HA ARG A 30 9.607 -6.812 9.872 1.00 25.00 H new ATOM 0 HB2 ARG A 30 12.494 -6.460 9.007 1.00 25.00 H new ATOM 0 HB3 ARG A 30 11.963 -7.409 10.381 1.00 25.00 H new ATOM 0 HG2 ARG A 30 10.731 -8.929 8.916 1.00 25.00 H new ATOM 0 HG3 ARG A 30 11.096 -7.936 7.519 1.00 25.00 H new ATOM 0 HD2 ARG A 30 13.226 -9.231 9.250 1.00 25.00 H new ATOM 0 HD3 ARG A 30 12.555 -9.987 7.818 1.00 25.00 H new ATOM 0 HE ARG A 30 13.380 -7.433 6.987 1.00 25.00 H new ATOM 0 HH11 ARG A 30 14.933 -10.319 8.385 1.00 25.00 H new ATOM 0 HH12 ARG A 30 16.488 -9.973 7.620 1.00 25.00 H new ATOM 0 HH21 ARG A 30 15.380 -7.029 6.034 1.00 25.00 H new ATOM 0 HH22 ARG A 30 16.737 -8.128 6.302 1.00 25.00 H new ATOM 449 N SER A 31 10.545 -5.374 11.803 1.00 25.00 N ATOM 450 CA SER A 31 10.786 -4.390 12.865 1.00 25.00 C ATOM 451 C SER A 31 12.273 -3.990 12.893 1.00 25.00 C ATOM 452 O SER A 31 13.088 -4.635 12.221 1.00 25.00 O ATOM 453 CB SER A 31 10.323 -4.959 14.222 1.00 25.00 C ATOM 454 OG SER A 31 11.091 -6.072 14.642 1.00 25.00 O ATOM 0 H SER A 31 10.281 -6.299 12.141 1.00 25.00 H new ATOM 0 HA SER A 31 10.207 -3.489 12.664 1.00 25.00 H new ATOM 0 HB2 SER A 31 10.383 -4.176 14.978 1.00 25.00 H new ATOM 0 HB3 SER A 31 9.276 -5.253 14.149 1.00 25.00 H new ATOM 0 HG SER A 31 11.210 -6.039 15.614 1.00 25.00 H new ATOM 460 N THR A 32 12.634 -2.945 13.650 1.00 25.00 N ATOM 461 CA THR A 32 14.042 -2.484 13.715 1.00 25.00 C ATOM 462 C THR A 32 15.012 -3.607 14.135 1.00 25.00 C ATOM 463 O THR A 32 16.177 -3.616 13.721 1.00 25.00 O ATOM 464 CB THR A 32 14.217 -1.263 14.643 1.00 25.00 C ATOM 465 OG1 THR A 32 13.296 -1.331 15.741 1.00 25.00 O ATOM 466 CG2 THR A 32 14.019 0.037 13.869 1.00 25.00 C ATOM 0 H THR A 32 11.986 -2.404 14.222 1.00 25.00 H new ATOM 0 HA THR A 32 14.296 -2.180 12.699 1.00 25.00 H new ATOM 0 HB THR A 32 15.233 -1.279 15.037 1.00 25.00 H new ATOM 0 HG1 THR A 32 13.420 -0.551 16.321 1.00 25.00 H new ATOM 0 HG21 THR A 32 14.147 0.884 14.542 1.00 25.00 H new ATOM 0 HG22 THR A 32 14.753 0.098 13.066 1.00 25.00 H new ATOM 0 HG23 THR A 32 13.015 0.059 13.445 1.00 25.00 H new ATOM 474 N ASP A 33 14.507 -4.555 14.936 1.00 25.00 N ATOM 475 CA ASP A 33 15.239 -5.784 15.257 1.00 25.00 C ATOM 476 C ASP A 33 14.727 -6.945 14.380 1.00 25.00 C ATOM 477 O ASP A 33 15.486 -7.859 14.041 1.00 25.00 O ATOM 478 CB ASP A 33 15.088 -6.115 16.752 1.00 25.00 C ATOM 479 CG ASP A 33 15.613 -5.017 17.667 1.00 25.00 C ATOM 480 OD1 ASP A 33 16.778 -4.603 17.489 1.00 25.00 O ATOM 481 OD2 ASP A 33 14.859 -4.577 18.559 1.00 25.00 O ATOM 0 H ASP A 33 13.589 -4.492 15.375 1.00 25.00 H new ATOM 0 HA ASP A 33 16.298 -5.636 15.047 1.00 25.00 H new ATOM 0 HB2 ASP A 33 14.035 -6.291 16.974 1.00 25.00 H new ATOM 0 HB3 ASP A 33 15.618 -7.043 16.967 1.00 25.00 H new ATOM 486 N GLY A 34 13.433 -6.882 14.028 1.00 25.00 N ATOM 487 CA GLY A 34 12.815 -7.860 13.136 1.00 25.00 C ATOM 488 C GLY A 34 11.917 -8.860 13.848 1.00 25.00 C ATOM 489 O GLY A 34 11.611 -9.919 13.292 1.00 25.00 O ATOM 0 H GLY A 34 12.795 -6.156 14.354 1.00 25.00 H new ATOM 0 HA2 GLY A 34 12.230 -7.332 12.383 1.00 25.00 H new ATOM 0 HA3 GLY A 34 13.599 -8.402 12.608 1.00 25.00 H new ATOM 493 N ASP A 35 11.495 -8.526 15.079 1.00 25.00 N ATOM 494 CA ASP A 35 10.569 -9.368 15.854 1.00 25.00 C ATOM 495 C ASP A 35 9.157 -9.345 15.234 1.00 25.00 C ATOM 496 O ASP A 35 8.418 -10.330 15.319 1.00 25.00 O ATOM 497 CB ASP A 35 10.529 -8.892 17.318 1.00 25.00 C ATOM 498 CG ASP A 35 9.953 -7.493 17.478 1.00 25.00 C ATOM 499 OD1 ASP A 35 10.589 -6.531 16.998 1.00 25.00 O ATOM 500 OD2 ASP A 35 8.867 -7.363 18.079 1.00 25.00 O ATOM 0 H ASP A 35 11.783 -7.674 15.561 1.00 25.00 H new ATOM 0 HA ASP A 35 10.928 -10.397 15.828 1.00 25.00 H new ATOM 0 HB2 ASP A 35 9.934 -9.592 17.905 1.00 25.00 H new ATOM 0 HB3 ASP A 35 11.539 -8.911 17.727 1.00 25.00 H new ATOM 505 N LYS A 36 8.807 -8.206 14.617 1.00 25.00 N ATOM 506 CA LYS A 36 7.554 -8.067 13.873 1.00 25.00 C ATOM 507 C LYS A 36 7.851 -8.106 12.373 1.00 25.00 C ATOM 508 O LYS A 36 8.823 -7.496 11.918 1.00 25.00 O ATOM 509 CB LYS A 36 6.866 -6.744 14.233 1.00 25.00 C ATOM 510 CG LYS A 36 6.447 -6.629 15.682 1.00 25.00 C ATOM 511 CD LYS A 36 5.748 -5.307 15.913 1.00 25.00 C ATOM 512 CE LYS A 36 5.438 -5.073 17.384 1.00 25.00 C ATOM 513 NZ LYS A 36 6.671 -4.955 18.219 1.00 25.00 N ATOM 0 H LYS A 36 9.382 -7.364 14.622 1.00 25.00 H new ATOM 0 HA LYS A 36 6.888 -8.889 14.136 1.00 25.00 H new ATOM 0 HB2 LYS A 36 7.541 -5.922 13.997 1.00 25.00 H new ATOM 0 HB3 LYS A 36 5.985 -6.624 13.603 1.00 25.00 H new ATOM 0 HG2 LYS A 36 5.782 -7.452 15.944 1.00 25.00 H new ATOM 0 HG3 LYS A 36 7.321 -6.706 16.329 1.00 25.00 H new ATOM 0 HD2 LYS A 36 6.375 -4.496 15.542 1.00 25.00 H new ATOM 0 HD3 LYS A 36 4.822 -5.282 15.339 1.00 25.00 H new ATOM 0 HE2 LYS A 36 4.846 -4.164 17.487 1.00 25.00 H new ATOM 0 HE3 LYS A 36 4.828 -5.895 17.758 1.00 25.00 H new ATOM 0 HZ1 LYS A 36 6.418 -4.598 19.163 1.00 25.00 H new ATOM 0 HZ2 LYS A 36 7.119 -5.889 18.311 1.00 25.00 H new ATOM 0 HZ3 LYS A 36 7.335 -4.296 17.766 1.00 25.00 H new ATOM 527 N VAL A 37 7.021 -8.825 11.609 1.00 25.00 N ATOM 528 CA VAL A 37 7.263 -8.991 10.171 1.00 25.00 C ATOM 529 C VAL A 37 5.943 -9.047 9.364 1.00 25.00 C ATOM 530 O VAL A 37 4.988 -9.726 9.758 1.00 25.00 O ATOM 531 CB VAL A 37 8.176 -10.242 9.896 1.00 25.00 C ATOM 532 CG1 VAL A 37 7.533 -11.559 10.344 1.00 25.00 C ATOM 533 CG2 VAL A 37 8.599 -10.312 8.431 1.00 25.00 C ATOM 0 H VAL A 37 6.186 -9.296 11.957 1.00 25.00 H new ATOM 0 HA VAL A 37 7.800 -8.109 9.823 1.00 25.00 H new ATOM 0 HB VAL A 37 9.070 -10.106 10.505 1.00 25.00 H new ATOM 0 HG11 VAL A 37 8.210 -12.386 10.129 1.00 25.00 H new ATOM 0 HG12 VAL A 37 7.335 -11.521 11.415 1.00 25.00 H new ATOM 0 HG13 VAL A 37 6.596 -11.708 9.807 1.00 25.00 H new ATOM 0 HG21 VAL A 37 9.229 -11.188 8.276 1.00 25.00 H new ATOM 0 HG22 VAL A 37 7.713 -10.385 7.800 1.00 25.00 H new ATOM 0 HG23 VAL A 37 9.157 -9.413 8.170 1.00 25.00 H new ATOM 543 N HIS A 38 5.922 -8.314 8.242 1.00 25.00 N ATOM 544 CA HIS A 38 4.790 -8.308 7.305 1.00 25.00 C ATOM 545 C HIS A 38 5.309 -8.536 5.876 1.00 25.00 C ATOM 546 O HIS A 38 6.412 -8.094 5.542 1.00 25.00 O ATOM 547 CB HIS A 38 4.028 -6.972 7.398 1.00 25.00 C ATOM 548 CG HIS A 38 3.302 -6.761 8.698 1.00 25.00 C ATOM 549 ND1 HIS A 38 3.542 -5.907 9.722 1.00 25.00 N flip ATOM 550 CD2 HIS A 38 2.188 -7.489 9.063 1.00 25.00 C flip ATOM 551 CE1 HIS A 38 2.578 -6.132 10.675 1.00 25.00 C flip ATOM 552 NE2 HIS A 38 1.773 -7.090 10.252 1.00 25.00 N flip ATOM 0 H HIS A 38 6.691 -7.707 7.958 1.00 25.00 H new ATOM 0 HA HIS A 38 4.101 -9.111 7.565 1.00 25.00 H new ATOM 0 HB2 HIS A 38 4.734 -6.154 7.253 1.00 25.00 H new ATOM 0 HB3 HIS A 38 3.308 -6.920 6.581 1.00 25.00 H new ATOM 0 HD1 HIS A 38 4.298 -5.224 9.776 1.00 25.00 H new ATOM 0 HD2 HIS A 38 1.727 -8.264 8.469 1.00 25.00 H new ATOM 0 HE1 HIS A 38 2.492 -5.610 11.617 1.00 25.00 H new ATOM 561 N THR A 39 4.517 -9.224 5.040 1.00 25.00 N ATOM 562 CA THR A 39 4.953 -9.582 3.683 1.00 25.00 C ATOM 563 C THR A 39 3.913 -9.176 2.622 1.00 25.00 C ATOM 564 O THR A 39 2.730 -9.511 2.736 1.00 25.00 O ATOM 565 CB THR A 39 5.257 -11.103 3.584 1.00 25.00 C ATOM 566 OG1 THR A 39 6.353 -11.435 4.447 1.00 25.00 O ATOM 567 CG2 THR A 39 5.614 -11.527 2.159 1.00 25.00 C ATOM 0 H THR A 39 3.577 -9.542 5.278 1.00 25.00 H new ATOM 0 HA THR A 39 5.869 -9.026 3.482 1.00 25.00 H new ATOM 0 HB THR A 39 4.353 -11.632 3.884 1.00 25.00 H new ATOM 0 HG1 THR A 39 6.541 -12.395 4.383 1.00 25.00 H new ATOM 0 HG21 THR A 39 5.818 -12.597 2.138 1.00 25.00 H new ATOM 0 HG22 THR A 39 4.780 -11.304 1.493 1.00 25.00 H new ATOM 0 HG23 THR A 39 6.498 -10.982 1.828 1.00 25.00 H new ATOM 575 N VAL A 40 4.386 -8.446 1.599 1.00 25.00 N ATOM 576 CA VAL A 40 3.567 -8.048 0.451 1.00 25.00 C ATOM 577 C VAL A 40 4.051 -8.772 -0.823 1.00 25.00 C ATOM 578 O VAL A 40 5.092 -8.427 -1.375 1.00 25.00 O ATOM 579 CB VAL A 40 3.653 -6.493 0.271 1.00 25.00 C ATOM 580 CG1 VAL A 40 2.780 -5.943 -0.863 1.00 25.00 C ATOM 581 CG2 VAL A 40 3.301 -5.780 1.563 1.00 25.00 C ATOM 0 H VAL A 40 5.350 -8.116 1.548 1.00 25.00 H new ATOM 0 HA VAL A 40 2.529 -8.329 0.627 1.00 25.00 H new ATOM 0 HB VAL A 40 4.689 -6.296 -0.003 1.00 25.00 H new ATOM 0 HG11 VAL A 40 2.897 -4.861 -0.920 1.00 25.00 H new ATOM 0 HG12 VAL A 40 3.086 -6.392 -1.808 1.00 25.00 H new ATOM 0 HG13 VAL A 40 1.735 -6.185 -0.668 1.00 25.00 H new ATOM 0 HG21 VAL A 40 3.368 -4.702 1.414 1.00 25.00 H new ATOM 0 HG22 VAL A 40 2.285 -6.043 1.859 1.00 25.00 H new ATOM 0 HG23 VAL A 40 3.997 -6.081 2.346 1.00 25.00 H new ATOM 591 N VAL A 41 3.272 -9.750 -1.301 1.00 25.00 N ATOM 592 CA VAL A 41 3.581 -10.443 -2.559 1.00 25.00 C ATOM 593 C VAL A 41 3.074 -9.581 -3.728 1.00 25.00 C ATOM 594 O VAL A 41 1.882 -9.278 -3.802 1.00 25.00 O ATOM 595 CB VAL A 41 2.937 -11.867 -2.608 1.00 25.00 C ATOM 596 CG1 VAL A 41 3.280 -12.601 -3.906 1.00 25.00 C ATOM 597 CG2 VAL A 41 3.400 -12.702 -1.418 1.00 25.00 C ATOM 0 H VAL A 41 2.425 -10.079 -0.838 1.00 25.00 H new ATOM 0 HA VAL A 41 4.660 -10.581 -2.633 1.00 25.00 H new ATOM 0 HB VAL A 41 1.856 -11.733 -2.565 1.00 25.00 H new ATOM 0 HG11 VAL A 41 2.814 -13.586 -3.901 1.00 25.00 H new ATOM 0 HG12 VAL A 41 2.910 -12.029 -4.756 1.00 25.00 H new ATOM 0 HG13 VAL A 41 4.361 -12.712 -3.987 1.00 25.00 H new ATOM 0 HG21 VAL A 41 2.943 -13.690 -1.467 1.00 25.00 H new ATOM 0 HG22 VAL A 41 4.485 -12.803 -1.444 1.00 25.00 H new ATOM 0 HG23 VAL A 41 3.103 -12.211 -0.491 1.00 25.00 H new ATOM 607 N LEU A 42 3.981 -9.187 -4.630 1.00 25.00 N ATOM 608 CA LEU A 42 3.644 -8.210 -5.679 1.00 25.00 C ATOM 609 C LEU A 42 2.795 -8.792 -6.814 1.00 25.00 C ATOM 610 O LEU A 42 2.133 -8.038 -7.534 1.00 25.00 O ATOM 611 CB LEU A 42 4.897 -7.543 -6.294 1.00 25.00 C ATOM 612 CG LEU A 42 5.677 -6.515 -5.435 1.00 25.00 C ATOM 613 CD1 LEU A 42 4.757 -5.453 -4.858 1.00 25.00 C ATOM 614 CD2 LEU A 42 6.460 -7.188 -4.322 1.00 25.00 C ATOM 0 H LEU A 42 4.944 -9.523 -4.658 1.00 25.00 H new ATOM 0 HA LEU A 42 3.050 -7.460 -5.157 1.00 25.00 H new ATOM 0 HB2 LEU A 42 5.591 -8.335 -6.577 1.00 25.00 H new ATOM 0 HB3 LEU A 42 4.591 -7.044 -7.214 1.00 25.00 H new ATOM 0 HG LEU A 42 6.387 -6.028 -6.104 1.00 25.00 H new ATOM 0 HD11 LEU A 42 5.340 -4.751 -4.262 1.00 25.00 H new ATOM 0 HD12 LEU A 42 4.264 -4.918 -5.670 1.00 25.00 H new ATOM 0 HD13 LEU A 42 4.005 -5.927 -4.227 1.00 25.00 H new ATOM 0 HD21 LEU A 42 6.992 -6.433 -3.744 1.00 25.00 H new ATOM 0 HD22 LEU A 42 5.774 -7.728 -3.669 1.00 25.00 H new ATOM 0 HD23 LEU A 42 7.177 -7.887 -4.753 1.00 25.00 H new ATOM 626 N SER A 43 2.808 -10.125 -6.976 1.00 25.00 N ATOM 627 CA SER A 43 1.950 -10.796 -7.971 1.00 25.00 C ATOM 628 C SER A 43 0.468 -10.710 -7.554 1.00 25.00 C ATOM 629 O SER A 43 -0.428 -11.147 -8.282 1.00 25.00 O ATOM 630 CB SER A 43 2.392 -12.258 -8.145 1.00 25.00 C ATOM 631 OG SER A 43 2.101 -13.035 -6.992 1.00 25.00 O ATOM 0 H SER A 43 3.398 -10.757 -6.436 1.00 25.00 H new ATOM 0 HA SER A 43 2.056 -10.288 -8.930 1.00 25.00 H new ATOM 0 HB2 SER A 43 1.890 -12.689 -9.011 1.00 25.00 H new ATOM 0 HB3 SER A 43 3.463 -12.293 -8.347 1.00 25.00 H new ATOM 0 HG SER A 43 2.244 -13.984 -7.192 1.00 25.00 H new ATOM 637 N THR A 44 0.249 -10.127 -6.366 1.00 25.00 N ATOM 638 CA THR A 44 -1.087 -9.902 -5.811 1.00 25.00 C ATOM 639 C THR A 44 -1.368 -8.390 -5.683 1.00 25.00 C ATOM 640 O THR A 44 -2.426 -7.981 -5.196 1.00 25.00 O ATOM 641 CB THR A 44 -1.244 -10.578 -4.417 1.00 25.00 C ATOM 642 OG1 THR A 44 -0.374 -9.971 -3.451 1.00 25.00 O ATOM 643 CG2 THR A 44 -0.934 -12.068 -4.480 1.00 25.00 C ATOM 0 H THR A 44 1.002 -9.797 -5.762 1.00 25.00 H new ATOM 0 HA THR A 44 -1.807 -10.350 -6.496 1.00 25.00 H new ATOM 0 HB THR A 44 -2.283 -10.440 -4.117 1.00 25.00 H new ATOM 0 HG1 THR A 44 0.541 -9.950 -3.802 1.00 25.00 H new ATOM 0 HG21 THR A 44 -1.054 -12.507 -3.489 1.00 25.00 H new ATOM 0 HG22 THR A 44 -1.618 -12.553 -5.177 1.00 25.00 H new ATOM 0 HG23 THR A 44 0.092 -12.212 -4.819 1.00 25.00 H new ATOM 651 N ILE A 45 -0.397 -7.580 -6.132 1.00 25.00 N ATOM 652 CA ILE A 45 -0.458 -6.112 -6.052 1.00 25.00 C ATOM 653 C ILE A 45 -0.649 -5.524 -7.459 1.00 25.00 C ATOM 654 O ILE A 45 -0.081 -6.027 -8.430 1.00 25.00 O ATOM 655 CB ILE A 45 0.851 -5.553 -5.389 1.00 25.00 C ATOM 656 CG1 ILE A 45 1.059 -6.141 -3.960 1.00 25.00 C ATOM 657 CG2 ILE A 45 0.892 -4.016 -5.359 1.00 25.00 C ATOM 658 CD1 ILE A 45 -0.041 -5.846 -2.935 1.00 25.00 C ATOM 0 H ILE A 45 0.459 -7.928 -6.564 1.00 25.00 H new ATOM 0 HA ILE A 45 -1.306 -5.819 -5.433 1.00 25.00 H new ATOM 0 HB ILE A 45 1.678 -5.880 -6.020 1.00 25.00 H new ATOM 0 HG12 ILE A 45 1.163 -7.222 -4.047 1.00 25.00 H new ATOM 0 HG13 ILE A 45 2.002 -5.760 -3.568 1.00 25.00 H new ATOM 0 HG21 ILE A 45 1.819 -3.686 -4.890 1.00 25.00 H new ATOM 0 HG22 ILE A 45 0.843 -3.631 -6.378 1.00 25.00 H new ATOM 0 HG23 ILE A 45 0.043 -3.640 -4.788 1.00 25.00 H new ATOM 0 HD11 ILE A 45 0.217 -6.307 -1.982 1.00 25.00 H new ATOM 0 HD12 ILE A 45 -0.136 -4.768 -2.803 1.00 25.00 H new ATOM 0 HD13 ILE A 45 -0.988 -6.253 -3.290 1.00 25.00 H new ATOM 670 N ASP A 46 -1.451 -4.452 -7.545 1.00 25.00 N ATOM 671 CA ASP A 46 -1.776 -3.823 -8.826 1.00 25.00 C ATOM 672 C ASP A 46 -1.116 -2.437 -8.964 1.00 25.00 C ATOM 673 O ASP A 46 -0.536 -2.135 -10.011 1.00 25.00 O ATOM 674 CB ASP A 46 -3.305 -3.731 -8.989 1.00 25.00 C ATOM 675 CG ASP A 46 -3.743 -3.154 -10.328 1.00 25.00 C ATOM 676 OD1 ASP A 46 -3.372 -3.729 -11.373 1.00 25.00 O ATOM 677 OD2 ASP A 46 -4.456 -2.128 -10.328 1.00 25.00 O ATOM 0 H ASP A 46 -1.886 -4.004 -6.738 1.00 25.00 H new ATOM 0 HA ASP A 46 -1.374 -4.445 -9.625 1.00 25.00 H new ATOM 0 HB2 ASP A 46 -3.734 -4.726 -8.874 1.00 25.00 H new ATOM 0 HB3 ASP A 46 -3.711 -3.114 -8.187 1.00 25.00 H new ATOM 682 N LYS A 47 -1.208 -1.600 -7.914 1.00 25.00 N ATOM 683 CA LYS A 47 -0.632 -0.241 -7.956 1.00 25.00 C ATOM 684 C LYS A 47 0.173 0.076 -6.694 1.00 25.00 C ATOM 685 O LYS A 47 0.203 -0.713 -5.745 1.00 25.00 O ATOM 686 CB LYS A 47 -1.713 0.841 -8.110 1.00 25.00 C ATOM 687 CG LYS A 47 -2.469 0.838 -9.440 1.00 25.00 C ATOM 688 CD LYS A 47 -3.553 1.918 -9.487 1.00 25.00 C ATOM 689 CE LYS A 47 -4.320 1.912 -10.807 1.00 25.00 C ATOM 690 NZ LYS A 47 -5.348 2.989 -10.870 1.00 25.00 N ATOM 0 H LYS A 47 -1.670 -1.836 -7.036 1.00 25.00 H new ATOM 0 HA LYS A 47 0.024 -0.230 -8.827 1.00 25.00 H new ATOM 0 HB2 LYS A 47 -2.435 0.725 -7.302 1.00 25.00 H new ATOM 0 HB3 LYS A 47 -1.245 1.817 -7.981 1.00 25.00 H new ATOM 0 HG2 LYS A 47 -1.765 0.995 -10.257 1.00 25.00 H new ATOM 0 HG3 LYS A 47 -2.925 -0.140 -9.596 1.00 25.00 H new ATOM 0 HD2 LYS A 47 -4.251 1.766 -8.663 1.00 25.00 H new ATOM 0 HD3 LYS A 47 -3.095 2.896 -9.340 1.00 25.00 H new ATOM 0 HE2 LYS A 47 -3.619 2.034 -11.632 1.00 25.00 H new ATOM 0 HE3 LYS A 47 -4.803 0.944 -10.939 1.00 25.00 H new ATOM 0 HZ1 LYS A 47 -5.842 2.944 -11.784 1.00 25.00 H new ATOM 0 HZ2 LYS A 47 -6.034 2.860 -10.099 1.00 25.00 H new ATOM 0 HZ3 LYS A 47 -4.886 3.916 -10.771 1.00 25.00 H new ATOM 704 N LEU A 48 0.831 1.254 -6.706 1.00 25.00 N ATOM 705 CA LEU A 48 1.625 1.744 -5.567 1.00 25.00 C ATOM 706 C LEU A 48 1.605 3.279 -5.572 1.00 25.00 C ATOM 707 O LEU A 48 1.872 3.895 -6.611 1.00 25.00 O ATOM 708 CB LEU A 48 3.099 1.260 -5.634 1.00 25.00 C ATOM 709 CG LEU A 48 3.575 0.731 -6.984 1.00 25.00 C ATOM 710 CD1 LEU A 48 3.756 1.858 -7.994 1.00 25.00 C ATOM 711 CD2 LEU A 48 4.859 -0.027 -6.819 1.00 25.00 C ATOM 0 H LEU A 48 0.825 1.888 -7.505 1.00 25.00 H new ATOM 0 HA LEU A 48 1.183 1.348 -4.653 1.00 25.00 H new ATOM 0 HB2 LEU A 48 3.745 2.089 -5.344 1.00 25.00 H new ATOM 0 HB3 LEU A 48 3.235 0.474 -4.891 1.00 25.00 H new ATOM 0 HG LEU A 48 2.808 0.059 -7.368 1.00 25.00 H new ATOM 0 HD11 LEU A 48 4.096 1.444 -8.944 1.00 25.00 H new ATOM 0 HD12 LEU A 48 2.806 2.371 -8.141 1.00 25.00 H new ATOM 0 HD13 LEU A 48 4.496 2.566 -7.621 1.00 25.00 H new ATOM 0 HD21 LEU A 48 5.189 -0.400 -7.789 1.00 25.00 H new ATOM 0 HD22 LEU A 48 5.621 0.634 -6.406 1.00 25.00 H new ATOM 0 HD23 LEU A 48 4.701 -0.867 -6.142 1.00 25.00 H new ATOM 723 N GLN A 49 1.285 3.897 -4.426 1.00 25.00 N ATOM 724 CA GLN A 49 1.197 5.367 -4.339 1.00 25.00 C ATOM 725 C GLN A 49 2.087 5.900 -3.208 1.00 25.00 C ATOM 726 O GLN A 49 1.864 5.589 -2.040 1.00 25.00 O ATOM 727 CB GLN A 49 -0.271 5.823 -4.133 1.00 25.00 C ATOM 728 CG GLN A 49 -1.209 5.480 -5.298 1.00 25.00 C ATOM 729 CD GLN A 49 -2.640 5.971 -5.103 1.00 25.00 C ATOM 730 OE1 GLN A 49 -2.871 6.678 -4.002 1.00 25.00 O flip ATOM 731 NE2 GLN A 49 -3.523 5.721 -5.925 1.00 25.00 N flip ATOM 0 H GLN A 49 1.084 3.410 -3.553 1.00 25.00 H new ATOM 0 HA GLN A 49 1.554 5.780 -5.282 1.00 25.00 H new ATOM 0 HB2 GLN A 49 -0.658 5.363 -3.223 1.00 25.00 H new ATOM 0 HB3 GLN A 49 -0.285 6.902 -3.976 1.00 25.00 H new ATOM 0 HG2 GLN A 49 -0.808 5.913 -6.214 1.00 25.00 H new ATOM 0 HG3 GLN A 49 -1.222 4.399 -5.436 1.00 25.00 H new ATOM 0 HE21 GLN A 49 -3.304 5.175 -6.758 1.00 25.00 H new ATOM 0 HE22 GLN A 49 -4.473 6.061 -5.773 1.00 25.00 H new ATOM 740 N ALA A 50 3.105 6.700 -3.569 1.00 25.00 N ATOM 741 CA ALA A 50 4.045 7.273 -2.591 1.00 25.00 C ATOM 742 C ALA A 50 3.878 8.793 -2.457 1.00 25.00 C ATOM 743 O ALA A 50 3.481 9.469 -3.411 1.00 25.00 O ATOM 744 CB ALA A 50 5.472 6.928 -2.990 1.00 25.00 C ATOM 0 H ALA A 50 3.298 6.965 -4.535 1.00 25.00 H new ATOM 0 HA ALA A 50 3.823 6.838 -1.616 1.00 25.00 H new ATOM 0 HB1 ALA A 50 6.166 7.353 -2.265 1.00 25.00 H new ATOM 0 HB2 ALA A 50 5.591 5.845 -3.014 1.00 25.00 H new ATOM 0 HB3 ALA A 50 5.683 7.338 -3.977 1.00 25.00 H new ATOM 750 N THR A 51 4.191 9.321 -1.251 1.00 25.00 N ATOM 751 CA THR A 51 4.071 10.763 -0.947 1.00 25.00 C ATOM 752 C THR A 51 5.133 11.587 -1.709 1.00 25.00 C ATOM 753 O THR A 51 6.331 11.332 -1.548 1.00 25.00 O ATOM 754 CB THR A 51 4.217 11.061 0.570 1.00 25.00 C ATOM 755 OG1 THR A 51 5.437 10.505 1.074 1.00 25.00 O ATOM 756 CG2 THR A 51 3.042 10.499 1.372 1.00 25.00 C ATOM 0 H THR A 51 4.531 8.763 -0.468 1.00 25.00 H new ATOM 0 HA THR A 51 3.071 11.053 -1.269 1.00 25.00 H new ATOM 0 HB THR A 51 4.229 12.145 0.685 1.00 25.00 H new ATOM 0 HG1 THR A 51 6.134 10.570 0.388 1.00 25.00 H new ATOM 0 HG21 THR A 51 3.180 10.728 2.429 1.00 25.00 H new ATOM 0 HG22 THR A 51 2.114 10.950 1.022 1.00 25.00 H new ATOM 0 HG23 THR A 51 2.994 9.418 1.238 1.00 25.00 H new ATOM 764 N PRO A 52 4.716 12.584 -2.564 1.00 25.00 N ATOM 765 CA PRO A 52 5.661 13.481 -3.276 1.00 25.00 C ATOM 766 C PRO A 52 6.625 14.219 -2.334 1.00 25.00 C ATOM 767 O PRO A 52 6.380 14.313 -1.127 1.00 25.00 O ATOM 768 CB PRO A 52 4.752 14.509 -3.962 1.00 25.00 C ATOM 769 CG PRO A 52 3.415 13.866 -4.080 1.00 25.00 C ATOM 770 CD PRO A 52 3.307 12.890 -2.919 1.00 25.00 C ATOM 0 HA PRO A 52 6.293 12.907 -3.954 1.00 25.00 H new ATOM 0 HB2 PRO A 52 4.692 15.427 -3.378 1.00 25.00 H new ATOM 0 HB3 PRO A 52 5.142 14.780 -4.943 1.00 25.00 H new ATOM 0 HG2 PRO A 52 2.620 14.611 -4.037 1.00 25.00 H new ATOM 0 HG3 PRO A 52 3.315 13.348 -5.034 1.00 25.00 H new ATOM 0 HD2 PRO A 52 2.772 13.330 -2.078 1.00 25.00 H new ATOM 0 HD3 PRO A 52 2.764 11.989 -3.206 1.00 25.00 H new ATOM 778 N ALA A 53 7.718 14.750 -2.911 1.00 25.00 N ATOM 779 CA ALA A 53 8.722 15.521 -2.159 1.00 25.00 C ATOM 780 C ALA A 53 8.194 16.904 -1.749 1.00 25.00 C ATOM 781 O ALA A 53 8.833 17.616 -0.967 1.00 25.00 O ATOM 782 CB ALA A 53 9.996 15.661 -2.984 1.00 25.00 C ATOM 0 H ALA A 53 7.929 14.657 -3.905 1.00 25.00 H new ATOM 0 HA ALA A 53 8.944 14.974 -1.243 1.00 25.00 H new ATOM 0 HB1 ALA A 53 10.733 16.233 -2.420 1.00 25.00 H new ATOM 0 HB2 ALA A 53 10.396 14.672 -3.206 1.00 25.00 H new ATOM 0 HB3 ALA A 53 9.771 16.179 -3.916 1.00 25.00 H new ATOM 788 N SER A 54 7.025 17.266 -2.294 1.00 25.00 N ATOM 789 CA SER A 54 6.322 18.497 -1.927 1.00 25.00 C ATOM 790 C SER A 54 5.260 18.230 -0.855 1.00 25.00 C ATOM 791 O SER A 54 4.801 19.156 -0.178 1.00 25.00 O ATOM 792 CB SER A 54 5.666 19.111 -3.159 1.00 25.00 C ATOM 793 OG SER A 54 4.612 18.296 -3.642 1.00 25.00 O ATOM 0 H SER A 54 6.542 16.712 -3.001 1.00 25.00 H new ATOM 0 HA SER A 54 7.054 19.194 -1.518 1.00 25.00 H new ATOM 0 HB2 SER A 54 5.280 20.100 -2.913 1.00 25.00 H new ATOM 0 HB3 SER A 54 6.412 19.246 -3.942 1.00 25.00 H new ATOM 0 HG SER A 54 3.788 18.505 -3.155 1.00 25.00 H new ATOM 799 N SER A 55 4.883 16.949 -0.710 1.00 25.00 N ATOM 800 CA SER A 55 3.888 16.514 0.273 1.00 25.00 C ATOM 801 C SER A 55 4.420 16.580 1.706 1.00 25.00 C ATOM 802 O SER A 55 5.575 16.236 1.972 1.00 25.00 O ATOM 803 CB SER A 55 3.423 15.099 -0.056 1.00 25.00 C ATOM 804 OG SER A 55 2.558 14.615 0.951 1.00 25.00 O ATOM 0 H SER A 55 5.262 16.188 -1.274 1.00 25.00 H new ATOM 0 HA SER A 55 3.044 17.201 0.215 1.00 25.00 H new ATOM 0 HB2 SER A 55 2.910 15.093 -1.018 1.00 25.00 H new ATOM 0 HB3 SER A 55 4.286 14.439 -0.151 1.00 25.00 H new ATOM 0 HG SER A 55 2.158 15.371 1.429 1.00 25.00 H new ATOM 810 N GLU A 56 3.546 17.038 2.617 1.00 25.00 N ATOM 811 CA GLU A 56 3.838 17.119 4.064 1.00 25.00 C ATOM 812 C GLU A 56 4.085 15.740 4.677 1.00 25.00 C ATOM 813 O GLU A 56 4.620 15.620 5.784 1.00 25.00 O ATOM 814 CB GLU A 56 2.657 17.759 4.791 1.00 25.00 C ATOM 815 CG GLU A 56 2.140 19.029 4.139 1.00 25.00 C ATOM 816 CD GLU A 56 1.416 18.767 2.832 1.00 25.00 C ATOM 817 OE1 GLU A 56 0.498 17.919 2.821 1.00 25.00 O ATOM 818 OE2 GLU A 56 1.766 19.409 1.820 1.00 25.00 O ATOM 0 H GLU A 56 2.611 17.365 2.373 1.00 25.00 H new ATOM 0 HA GLU A 56 4.741 17.719 4.178 1.00 25.00 H new ATOM 0 HB2 GLU A 56 1.844 17.035 4.847 1.00 25.00 H new ATOM 0 HB3 GLU A 56 2.954 17.985 5.815 1.00 25.00 H new ATOM 0 HG2 GLU A 56 1.464 19.536 4.828 1.00 25.00 H new ATOM 0 HG3 GLU A 56 2.976 19.704 3.957 1.00 25.00 H new ATOM 825 N LYS A 57 3.684 14.721 3.928 1.00 25.00 N ATOM 826 CA LYS A 57 3.672 13.351 4.385 1.00 25.00 C ATOM 827 C LYS A 57 4.889 12.559 3.933 1.00 25.00 C ATOM 828 O LYS A 57 5.510 12.866 2.911 1.00 25.00 O ATOM 829 CB LYS A 57 2.418 12.682 3.849 1.00 25.00 C ATOM 830 CG LYS A 57 1.113 13.266 4.351 1.00 25.00 C ATOM 831 CD LYS A 57 -0.085 12.396 4.033 1.00 25.00 C ATOM 832 CE LYS A 57 -1.360 13.129 4.390 1.00 25.00 C ATOM 833 NZ LYS A 57 -2.510 12.199 4.583 1.00 25.00 N ATOM 0 H LYS A 57 3.353 14.833 2.970 1.00 25.00 H new ATOM 0 HA LYS A 57 3.691 13.365 5.475 1.00 25.00 H new ATOM 0 HB2 LYS A 57 2.430 12.742 2.761 1.00 25.00 H new ATOM 0 HB3 LYS A 57 2.449 11.624 4.111 1.00 25.00 H new ATOM 0 HG2 LYS A 57 1.176 13.408 5.430 1.00 25.00 H new ATOM 0 HG3 LYS A 57 0.968 14.251 3.908 1.00 25.00 H new ATOM 0 HD2 LYS A 57 -0.088 12.138 2.974 1.00 25.00 H new ATOM 0 HD3 LYS A 57 -0.025 11.461 4.589 1.00 25.00 H new ATOM 0 HE2 LYS A 57 -1.203 13.704 5.303 1.00 25.00 H new ATOM 0 HE3 LYS A 57 -1.600 13.842 3.601 1.00 25.00 H new ATOM 0 HZ1 LYS A 57 -3.361 12.745 4.826 1.00 25.00 H new ATOM 0 HZ2 LYS A 57 -2.678 11.668 3.705 1.00 25.00 H new ATOM 0 HZ3 LYS A 57 -2.294 11.534 5.353 1.00 25.00 H new ATOM 847 N MET A 58 5.216 11.535 4.727 1.00 25.00 N ATOM 848 CA MET A 58 6.216 10.542 4.356 1.00 25.00 C ATOM 849 C MET A 58 5.603 9.151 4.465 1.00 25.00 C ATOM 850 O MET A 58 5.514 8.577 5.556 1.00 25.00 O ATOM 851 CB MET A 58 7.455 10.664 5.253 1.00 25.00 C ATOM 852 CG MET A 58 8.128 12.033 5.178 1.00 25.00 C ATOM 853 SD MET A 58 9.524 12.209 6.315 1.00 25.00 S ATOM 854 CE MET A 58 10.063 13.890 5.989 1.00 25.00 C ATOM 0 H MET A 58 4.794 11.376 5.642 1.00 25.00 H new ATOM 0 HA MET A 58 6.533 10.713 3.327 1.00 25.00 H new ATOM 0 HB2 MET A 58 7.167 10.465 6.285 1.00 25.00 H new ATOM 0 HB3 MET A 58 8.176 9.897 4.970 1.00 25.00 H new ATOM 0 HG2 MET A 58 8.475 12.204 4.159 1.00 25.00 H new ATOM 0 HG3 MET A 58 7.390 12.805 5.397 1.00 25.00 H new ATOM 0 HE1 MET A 58 10.917 14.128 6.623 1.00 25.00 H new ATOM 0 HE2 MET A 58 10.351 13.983 4.942 1.00 25.00 H new ATOM 0 HE3 MET A 58 9.248 14.581 6.204 1.00 25.00 H new ATOM 864 N MET A 59 5.172 8.618 3.312 1.00 25.00 N ATOM 865 CA MET A 59 4.448 7.344 3.245 1.00 25.00 C ATOM 866 C MET A 59 4.592 6.694 1.871 1.00 25.00 C ATOM 867 O MET A 59 4.865 7.368 0.873 1.00 25.00 O ATOM 868 CB MET A 59 2.954 7.551 3.548 1.00 25.00 C ATOM 869 CG MET A 59 2.647 8.051 4.960 1.00 25.00 C ATOM 870 SD MET A 59 0.928 8.574 5.278 1.00 25.00 S ATOM 871 CE MET A 59 0.934 9.170 6.967 1.00 25.00 C ATOM 0 H MET A 59 5.316 9.058 2.403 1.00 25.00 H new ATOM 0 HA MET A 59 4.885 6.685 3.995 1.00 25.00 H new ATOM 0 HB2 MET A 59 2.548 8.263 2.830 1.00 25.00 H new ATOM 0 HB3 MET A 59 2.432 6.607 3.391 1.00 25.00 H new ATOM 0 HG2 MET A 59 2.900 7.259 5.665 1.00 25.00 H new ATOM 0 HG3 MET A 59 3.306 8.892 5.176 1.00 25.00 H new ATOM 0 HE1 MET A 59 -0.067 9.505 7.238 1.00 25.00 H new ATOM 0 HE2 MET A 59 1.241 8.366 7.636 1.00 25.00 H new ATOM 0 HE3 MET A 59 1.632 10.003 7.057 1.00 25.00 H new ATOM 881 N LEU A 60 4.401 5.370 1.841 1.00 25.00 N ATOM 882 CA LEU A 60 4.420 4.591 0.609 1.00 25.00 C ATOM 883 C LEU A 60 3.262 3.592 0.634 1.00 25.00 C ATOM 884 O LEU A 60 3.207 2.718 1.504 1.00 25.00 O ATOM 885 CB LEU A 60 5.771 3.861 0.477 1.00 25.00 C ATOM 886 CG LEU A 60 5.870 2.780 -0.613 1.00 25.00 C ATOM 887 CD1 LEU A 60 6.047 3.411 -1.972 1.00 25.00 C ATOM 888 CD2 LEU A 60 7.015 1.819 -0.373 1.00 25.00 C ATOM 0 H LEU A 60 4.229 4.812 2.677 1.00 25.00 H new ATOM 0 HA LEU A 60 4.302 5.249 -0.252 1.00 25.00 H new ATOM 0 HB2 LEU A 60 6.543 4.607 0.288 1.00 25.00 H new ATOM 0 HB3 LEU A 60 6.003 3.399 1.436 1.00 25.00 H new ATOM 0 HG LEU A 60 4.936 2.219 -0.574 1.00 25.00 H new ATOM 0 HD11 LEU A 60 6.115 2.630 -2.730 1.00 25.00 H new ATOM 0 HD12 LEU A 60 5.194 4.054 -2.189 1.00 25.00 H new ATOM 0 HD13 LEU A 60 6.960 4.006 -1.981 1.00 25.00 H new ATOM 0 HD21 LEU A 60 7.040 1.077 -1.171 1.00 25.00 H new ATOM 0 HD22 LEU A 60 7.956 2.370 -0.360 1.00 25.00 H new ATOM 0 HD23 LEU A 60 6.875 1.318 0.585 1.00 25.00 H new ATOM 900 N ARG A 61 2.346 3.724 -0.328 1.00 25.00 N ATOM 901 CA ARG A 61 1.144 2.889 -0.374 1.00 25.00 C ATOM 902 C ARG A 61 1.275 1.762 -1.398 1.00 25.00 C ATOM 903 O ARG A 61 1.895 1.927 -2.452 1.00 25.00 O ATOM 904 CB ARG A 61 -0.103 3.726 -0.683 1.00 25.00 C ATOM 905 CG ARG A 61 -0.436 4.783 0.363 1.00 25.00 C ATOM 906 CD ARG A 61 -1.695 5.572 0.000 1.00 25.00 C ATOM 907 NE ARG A 61 -2.939 4.843 0.293 1.00 25.00 N ATOM 908 CZ ARG A 61 -3.518 4.777 1.502 1.00 25.00 C ATOM 909 NH1 ARG A 61 -3.005 5.421 2.549 1.00 25.00 N ATOM 910 NH2 ARG A 61 -4.626 4.065 1.660 1.00 25.00 N ATOM 0 H ARG A 61 2.414 4.402 -1.087 1.00 25.00 H new ATOM 0 HA ARG A 61 1.034 2.443 0.615 1.00 25.00 H new ATOM 0 HB2 ARG A 61 0.036 4.218 -1.646 1.00 25.00 H new ATOM 0 HB3 ARG A 61 -0.957 3.056 -0.788 1.00 25.00 H new ATOM 0 HG2 ARG A 61 -0.576 4.303 1.332 1.00 25.00 H new ATOM 0 HG3 ARG A 61 0.405 5.469 0.466 1.00 25.00 H new ATOM 0 HD2 ARG A 61 -1.696 6.515 0.547 1.00 25.00 H new ATOM 0 HD3 ARG A 61 -1.668 5.820 -1.061 1.00 25.00 H new ATOM 0 HE ARG A 61 -3.394 4.353 -0.477 1.00 25.00 H new ATOM 0 HH11 ARG A 61 -2.157 5.977 2.440 1.00 25.00 H new ATOM 0 HH12 ARG A 61 -3.460 5.358 3.460 1.00 25.00 H new ATOM 0 HH21 ARG A 61 -5.033 3.572 0.865 1.00 25.00 H new ATOM 0 HH22 ARG A 61 -5.071 4.011 2.576 1.00 25.00 H new ATOM 924 N LEU A 62 0.678 0.618 -1.057 1.00 25.00 N ATOM 925 CA LEU A 62 0.690 -0.580 -1.895 1.00 25.00 C ATOM 926 C LEU A 62 -0.743 -1.098 -2.096 1.00 25.00 C ATOM 927 O LEU A 62 -1.338 -1.679 -1.184 1.00 25.00 O ATOM 928 CB LEU A 62 1.560 -1.667 -1.225 1.00 25.00 C ATOM 929 CG LEU A 62 3.093 -1.665 -1.466 1.00 25.00 C ATOM 930 CD1 LEU A 62 3.398 -1.772 -2.944 1.00 25.00 C ATOM 931 CD2 LEU A 62 3.795 -0.448 -0.867 1.00 25.00 C ATOM 0 H LEU A 62 0.168 0.497 -0.182 1.00 25.00 H new ATOM 0 HA LEU A 62 1.110 -0.334 -2.870 1.00 25.00 H new ATOM 0 HB2 LEU A 62 1.397 -1.601 -0.149 1.00 25.00 H new ATOM 0 HB3 LEU A 62 1.179 -2.636 -1.546 1.00 25.00 H new ATOM 0 HG LEU A 62 3.487 -2.539 -0.948 1.00 25.00 H new ATOM 0 HD11 LEU A 62 4.478 -1.769 -3.094 1.00 25.00 H new ATOM 0 HD12 LEU A 62 2.980 -2.699 -3.336 1.00 25.00 H new ATOM 0 HD13 LEU A 62 2.957 -0.925 -3.469 1.00 25.00 H new ATOM 0 HD21 LEU A 62 4.864 -0.508 -1.071 1.00 25.00 H new ATOM 0 HD22 LEU A 62 3.391 0.461 -1.313 1.00 25.00 H new ATOM 0 HD23 LEU A 62 3.632 -0.427 0.210 1.00 25.00 H new ATOM 943 N ILE A 63 -1.282 -0.893 -3.300 1.00 25.00 N ATOM 944 CA ILE A 63 -2.679 -1.238 -3.616 1.00 25.00 C ATOM 945 C ILE A 63 -2.763 -2.711 -4.065 1.00 25.00 C ATOM 946 O ILE A 63 -1.923 -3.179 -4.834 1.00 25.00 O ATOM 947 CB ILE A 63 -3.264 -0.295 -4.736 1.00 25.00 C ATOM 948 CG1 ILE A 63 -3.257 1.213 -4.354 1.00 25.00 C ATOM 949 CG2 ILE A 63 -4.695 -0.684 -5.114 1.00 25.00 C ATOM 950 CD1 ILE A 63 -3.555 2.179 -5.480 1.00 25.00 C ATOM 0 H ILE A 63 -0.770 -0.486 -4.082 1.00 25.00 H new ATOM 0 HA ILE A 63 -3.277 -1.097 -2.716 1.00 25.00 H new ATOM 0 HB ILE A 63 -2.594 -0.435 -5.584 1.00 25.00 H new ATOM 0 HG12 ILE A 63 -3.989 1.371 -3.562 1.00 25.00 H new ATOM 0 HG13 ILE A 63 -2.280 1.459 -3.939 1.00 25.00 H new ATOM 0 HG21 ILE A 63 -5.063 -0.011 -5.888 1.00 25.00 H new ATOM 0 HG22 ILE A 63 -4.707 -1.708 -5.488 1.00 25.00 H new ATOM 0 HG23 ILE A 63 -5.336 -0.611 -4.235 1.00 25.00 H new ATOM 0 HD11 ILE A 63 -3.524 3.200 -5.101 1.00 25.00 H new ATOM 0 HD12 ILE A 63 -2.810 2.061 -6.267 1.00 25.00 H new ATOM 0 HD13 ILE A 63 -4.546 1.972 -5.884 1.00 25.00 H new ATOM 962 N GLY A 64 -3.796 -3.414 -3.584 1.00 25.00 N ATOM 963 CA GLY A 64 -3.959 -4.835 -3.873 1.00 25.00 C ATOM 964 C GLY A 64 -4.751 -5.109 -5.140 1.00 25.00 C ATOM 965 O GLY A 64 -5.416 -4.216 -5.673 1.00 25.00 O ATOM 0 H GLY A 64 -4.528 -3.018 -2.994 1.00 25.00 H new ATOM 0 HA2 GLY A 64 -2.975 -5.295 -3.963 1.00 25.00 H new ATOM 0 HA3 GLY A 64 -4.459 -5.314 -3.031 1.00 25.00 H new ATOM 969 N LYS A 65 -4.671 -6.358 -5.618 1.00 25.00 N ATOM 970 CA LYS A 65 -5.371 -6.788 -6.830 1.00 25.00 C ATOM 971 C LYS A 65 -6.805 -7.228 -6.552 1.00 25.00 C ATOM 972 O LYS A 65 -7.055 -8.224 -5.864 1.00 25.00 O ATOM 973 CB LYS A 65 -4.600 -7.907 -7.508 1.00 25.00 C ATOM 974 CG LYS A 65 -5.232 -8.337 -8.810 1.00 25.00 C ATOM 975 CD LYS A 65 -4.447 -9.446 -9.474 1.00 25.00 C ATOM 976 CE LYS A 65 -5.047 -9.811 -10.822 1.00 25.00 C ATOM 977 NZ LYS A 65 -4.311 -10.919 -11.485 1.00 25.00 N ATOM 0 H LYS A 65 -4.121 -7.094 -5.176 1.00 25.00 H new ATOM 0 HA LYS A 65 -5.425 -5.926 -7.494 1.00 25.00 H new ATOM 0 HB2 LYS A 65 -3.578 -7.578 -7.695 1.00 25.00 H new ATOM 0 HB3 LYS A 65 -4.542 -8.763 -6.836 1.00 25.00 H new ATOM 0 HG2 LYS A 65 -6.252 -8.674 -8.626 1.00 25.00 H new ATOM 0 HG3 LYS A 65 -5.295 -7.482 -9.484 1.00 25.00 H new ATOM 0 HD2 LYS A 65 -3.411 -9.133 -9.606 1.00 25.00 H new ATOM 0 HD3 LYS A 65 -4.435 -10.324 -8.828 1.00 25.00 H new ATOM 0 HE2 LYS A 65 -6.089 -10.100 -10.687 1.00 25.00 H new ATOM 0 HE3 LYS A 65 -5.040 -8.934 -11.470 1.00 25.00 H new ATOM 0 HZ1 LYS A 65 -3.954 -10.596 -12.407 1.00 25.00 H new ATOM 0 HZ2 LYS A 65 -3.512 -11.212 -10.887 1.00 25.00 H new ATOM 0 HZ3 LYS A 65 -4.952 -11.726 -11.626 1.00 25.00 H new ATOM 991 N VAL A 66 -7.731 -6.447 -7.096 1.00 25.00 N ATOM 992 CA VAL A 66 -9.166 -6.678 -6.935 1.00 25.00 C ATOM 993 C VAL A 66 -9.850 -6.840 -8.298 1.00 25.00 C ATOM 994 O VAL A 66 -9.396 -6.291 -9.308 1.00 25.00 O ATOM 995 CB VAL A 66 -9.793 -5.537 -6.051 1.00 25.00 C ATOM 996 CG1 VAL A 66 -11.264 -5.203 -6.330 1.00 25.00 C ATOM 997 CG2 VAL A 66 -9.638 -5.901 -4.583 1.00 25.00 C ATOM 0 H VAL A 66 -7.508 -5.630 -7.665 1.00 25.00 H new ATOM 0 HA VAL A 66 -9.331 -7.617 -6.407 1.00 25.00 H new ATOM 0 HB VAL A 66 -9.240 -4.637 -6.319 1.00 25.00 H new ATOM 0 HG11 VAL A 66 -11.589 -4.404 -5.663 1.00 25.00 H new ATOM 0 HG12 VAL A 66 -11.374 -4.879 -7.365 1.00 25.00 H new ATOM 0 HG13 VAL A 66 -11.877 -6.088 -6.160 1.00 25.00 H new ATOM 0 HG21 VAL A 66 -10.071 -5.114 -3.965 1.00 25.00 H new ATOM 0 HG22 VAL A 66 -10.152 -6.842 -4.385 1.00 25.00 H new ATOM 0 HG23 VAL A 66 -8.580 -6.009 -4.345 1.00 25.00 H new ATOM 1007 N ASP A 67 -10.945 -7.601 -8.296 1.00 25.00 N ATOM 1008 CA ASP A 67 -11.790 -7.772 -9.476 1.00 25.00 C ATOM 1009 C ASP A 67 -12.863 -6.685 -9.509 1.00 25.00 C ATOM 1010 O ASP A 67 -13.845 -6.739 -8.767 1.00 25.00 O ATOM 1011 CB ASP A 67 -12.435 -9.167 -9.485 1.00 25.00 C ATOM 1012 CG ASP A 67 -13.129 -9.484 -10.799 1.00 25.00 C ATOM 1013 OD1 ASP A 67 -13.217 -8.580 -11.655 1.00 25.00 O ATOM 1014 OD2 ASP A 67 -13.582 -10.635 -10.968 1.00 25.00 O ATOM 0 H ASP A 67 -11.270 -8.115 -7.477 1.00 25.00 H new ATOM 0 HA ASP A 67 -11.169 -7.682 -10.367 1.00 25.00 H new ATOM 0 HB2 ASP A 67 -11.669 -9.918 -9.293 1.00 25.00 H new ATOM 0 HB3 ASP A 67 -13.158 -9.234 -8.672 1.00 25.00 H new ATOM 1019 N GLU A 68 -12.639 -5.676 -10.354 1.00 25.00 N ATOM 1020 CA GLU A 68 -13.553 -4.534 -10.475 1.00 25.00 C ATOM 1021 C GLU A 68 -14.702 -4.808 -11.463 1.00 25.00 C ATOM 1022 O GLU A 68 -15.581 -3.959 -11.652 1.00 25.00 O ATOM 1023 CB GLU A 68 -12.772 -3.273 -10.874 1.00 25.00 C ATOM 1024 CG GLU A 68 -11.879 -2.724 -9.761 1.00 25.00 C ATOM 1025 CD GLU A 68 -11.285 -1.372 -10.104 1.00 25.00 C ATOM 1026 OE1 GLU A 68 -12.063 -0.419 -10.323 1.00 25.00 O ATOM 1027 OE2 GLU A 68 -10.041 -1.264 -10.149 1.00 25.00 O ATOM 0 H GLU A 68 -11.827 -5.626 -10.969 1.00 25.00 H new ATOM 0 HA GLU A 68 -14.012 -4.373 -9.499 1.00 25.00 H new ATOM 0 HB2 GLU A 68 -12.155 -3.499 -11.744 1.00 25.00 H new ATOM 0 HB3 GLU A 68 -13.478 -2.499 -11.176 1.00 25.00 H new ATOM 0 HG2 GLU A 68 -12.460 -2.639 -8.843 1.00 25.00 H new ATOM 0 HG3 GLU A 68 -11.073 -3.431 -9.564 1.00 25.00 H new ATOM 1034 N SER A 69 -14.691 -6.002 -12.082 1.00 25.00 N ATOM 1035 CA SER A 69 -15.734 -6.410 -13.039 1.00 25.00 C ATOM 1036 C SER A 69 -16.974 -6.990 -12.333 1.00 25.00 C ATOM 1037 O SER A 69 -18.043 -7.106 -12.941 1.00 25.00 O ATOM 1038 CB SER A 69 -15.165 -7.431 -14.034 1.00 25.00 C ATOM 1039 OG SER A 69 -14.956 -8.693 -13.422 1.00 25.00 O ATOM 0 H SER A 69 -13.966 -6.705 -11.935 1.00 25.00 H new ATOM 0 HA SER A 69 -16.054 -5.517 -13.576 1.00 25.00 H new ATOM 0 HB2 SER A 69 -15.850 -7.542 -14.874 1.00 25.00 H new ATOM 0 HB3 SER A 69 -14.223 -7.061 -14.438 1.00 25.00 H new ATOM 0 HG SER A 69 -14.045 -8.736 -13.063 1.00 25.00 H new ATOM 1045 N LYS A 70 -16.817 -7.346 -11.047 1.00 25.00 N ATOM 1046 CA LYS A 70 -17.906 -7.871 -10.212 1.00 25.00 C ATOM 1047 C LYS A 70 -18.744 -6.725 -9.598 1.00 25.00 C ATOM 1048 O LYS A 70 -19.245 -6.830 -8.470 1.00 25.00 O ATOM 1049 CB LYS A 70 -17.290 -8.746 -9.115 1.00 25.00 C ATOM 1050 CG LYS A 70 -16.743 -10.078 -9.630 1.00 25.00 C ATOM 1051 CD LYS A 70 -16.138 -10.951 -8.528 1.00 25.00 C ATOM 1052 CE LYS A 70 -15.640 -12.295 -9.057 1.00 25.00 C ATOM 1053 NZ LYS A 70 -15.084 -13.150 -7.972 1.00 25.00 N ATOM 0 H LYS A 70 -15.925 -7.277 -10.557 1.00 25.00 H new ATOM 0 HA LYS A 70 -18.584 -8.465 -10.825 1.00 25.00 H new ATOM 0 HB2 LYS A 70 -16.484 -8.194 -8.632 1.00 25.00 H new ATOM 0 HB3 LYS A 70 -18.044 -8.943 -8.353 1.00 25.00 H new ATOM 0 HG2 LYS A 70 -17.547 -10.628 -10.119 1.00 25.00 H new ATOM 0 HG3 LYS A 70 -15.984 -9.883 -10.387 1.00 25.00 H new ATOM 0 HD2 LYS A 70 -15.310 -10.419 -8.060 1.00 25.00 H new ATOM 0 HD3 LYS A 70 -16.885 -11.123 -7.753 1.00 25.00 H new ATOM 0 HE2 LYS A 70 -16.461 -12.819 -9.547 1.00 25.00 H new ATOM 0 HE3 LYS A 70 -14.874 -12.125 -9.814 1.00 25.00 H new ATOM 0 HZ1 LYS A 70 -14.758 -14.052 -8.374 1.00 25.00 H new ATOM 0 HZ2 LYS A 70 -14.284 -12.662 -7.521 1.00 25.00 H new ATOM 0 HZ3 LYS A 70 -15.822 -13.334 -7.262 1.00 25.00 H new ATOM 1067 N LYS A 71 -18.893 -5.649 -10.374 1.00 25.00 N ATOM 1068 CA LYS A 71 -19.573 -4.405 -9.945 1.00 25.00 C ATOM 1069 C LYS A 71 -20.903 -4.659 -9.224 1.00 25.00 C ATOM 1070 O LYS A 71 -21.790 -5.346 -9.745 1.00 25.00 O ATOM 1071 CB LYS A 71 -19.852 -3.501 -11.162 1.00 25.00 C ATOM 1072 CG LYS A 71 -18.625 -2.979 -11.899 1.00 25.00 C ATOM 1073 CD LYS A 71 -19.001 -2.222 -13.159 1.00 25.00 C ATOM 1074 CE LYS A 71 -17.765 -1.708 -13.863 1.00 25.00 C ATOM 1075 NZ LYS A 71 -16.829 -1.024 -12.930 1.00 25.00 N ATOM 0 H LYS A 71 -18.544 -5.607 -11.331 1.00 25.00 H new ATOM 0 HA LYS A 71 -18.894 -3.922 -9.243 1.00 25.00 H new ATOM 0 HB2 LYS A 71 -20.468 -4.057 -11.869 1.00 25.00 H new ATOM 0 HB3 LYS A 71 -20.442 -2.647 -10.828 1.00 25.00 H new ATOM 0 HG2 LYS A 71 -18.056 -2.325 -11.239 1.00 25.00 H new ATOM 0 HG3 LYS A 71 -17.974 -3.814 -12.158 1.00 25.00 H new ATOM 0 HD2 LYS A 71 -19.561 -2.875 -13.828 1.00 25.00 H new ATOM 0 HD3 LYS A 71 -19.655 -1.388 -12.906 1.00 25.00 H new ATOM 0 HE2 LYS A 71 -17.251 -2.540 -14.345 1.00 25.00 H new ATOM 0 HE3 LYS A 71 -18.060 -1.016 -14.651 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 -16.105 -0.515 -13.476 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 -17.357 -0.348 -12.342 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 -16.370 -1.730 -12.319 1.00 25.00 H new ATOM 1089 N ARG A 72 -21.009 -4.097 -8.014 1.00 25.00 N ATOM 1090 CA ARG A 72 -22.212 -4.206 -7.196 1.00 25.00 C ATOM 1091 C ARG A 72 -23.057 -2.935 -7.355 1.00 25.00 C ATOM 1092 O ARG A 72 -22.520 -1.858 -7.616 1.00 25.00 O ATOM 1093 CB ARG A 72 -21.799 -4.438 -5.728 1.00 25.00 C ATOM 1094 CG ARG A 72 -22.956 -4.624 -4.746 1.00 25.00 C ATOM 1095 CD ARG A 72 -22.461 -5.077 -3.381 1.00 25.00 C ATOM 1096 NE ARG A 72 -21.570 -4.090 -2.761 1.00 25.00 N ATOM 1097 CZ ARG A 72 -21.969 -3.097 -1.952 1.00 25.00 C ATOM 1098 NH1 ARG A 72 -23.254 -2.928 -1.647 1.00 25.00 N ATOM 1099 NH2 ARG A 72 -21.068 -2.263 -1.447 1.00 25.00 N ATOM 0 H ARG A 72 -20.262 -3.556 -7.579 1.00 25.00 H new ATOM 0 HA ARG A 72 -22.820 -5.051 -7.519 1.00 25.00 H new ATOM 0 HB2 ARG A 72 -21.160 -5.320 -5.682 1.00 25.00 H new ATOM 0 HB3 ARG A 72 -21.197 -3.591 -5.399 1.00 25.00 H new ATOM 0 HG2 ARG A 72 -23.502 -3.686 -4.643 1.00 25.00 H new ATOM 0 HG3 ARG A 72 -23.657 -5.359 -5.142 1.00 25.00 H new ATOM 0 HD2 ARG A 72 -23.315 -5.255 -2.727 1.00 25.00 H new ATOM 0 HD3 ARG A 72 -21.935 -6.026 -3.483 1.00 25.00 H new ATOM 0 HE ARG A 72 -20.572 -4.164 -2.960 1.00 25.00 H new ATOM 0 HH11 ARG A 72 -23.957 -3.560 -2.031 1.00 25.00 H new ATOM 0 HH12 ARG A 72 -23.536 -2.166 -1.030 1.00 25.00 H new ATOM 0 HH21 ARG A 72 -20.081 -2.380 -1.675 1.00 25.00 H new ATOM 0 HH22 ARG A 72 -21.363 -1.505 -0.831 1.00 25.00 H new ATOM 1113 N LYS A 73 -24.377 -3.081 -7.215 1.00 25.00 N ATOM 1114 CA LYS A 73 -25.303 -1.949 -7.300 1.00 25.00 C ATOM 1115 C LYS A 73 -26.192 -1.905 -6.062 1.00 25.00 C ATOM 1116 O LYS A 73 -26.596 -2.948 -5.537 1.00 25.00 O ATOM 1117 CB LYS A 73 -26.170 -2.032 -8.567 1.00 25.00 C ATOM 1118 CG LYS A 73 -25.366 -1.937 -9.853 1.00 25.00 C ATOM 1119 CD LYS A 73 -26.250 -1.978 -11.083 1.00 25.00 C ATOM 1120 CE LYS A 73 -25.412 -1.953 -12.348 1.00 25.00 C ATOM 1121 NZ LYS A 73 -26.255 -1.995 -13.576 1.00 25.00 N ATOM 0 H LYS A 73 -24.831 -3.978 -7.041 1.00 25.00 H new ATOM 0 HA LYS A 73 -24.713 -1.034 -7.353 1.00 25.00 H new ATOM 0 HB2 LYS A 73 -26.722 -2.972 -8.560 1.00 25.00 H new ATOM 0 HB3 LYS A 73 -26.907 -1.229 -8.548 1.00 25.00 H new ATOM 0 HG2 LYS A 73 -24.790 -1.012 -9.852 1.00 25.00 H new ATOM 0 HG3 LYS A 73 -24.650 -2.758 -9.894 1.00 25.00 H new ATOM 0 HD2 LYS A 73 -26.864 -2.878 -11.066 1.00 25.00 H new ATOM 0 HD3 LYS A 73 -26.931 -1.127 -11.076 1.00 25.00 H new ATOM 0 HE2 LYS A 73 -24.799 -1.052 -12.359 1.00 25.00 H new ATOM 0 HE3 LYS A 73 -24.729 -2.803 -12.348 1.00 25.00 H new ATOM 0 HZ1 LYS A 73 -25.644 -1.976 -14.417 1.00 25.00 H new ATOM 0 HZ2 LYS A 73 -26.821 -2.867 -13.579 1.00 25.00 H new ATOM 0 HZ3 LYS A 73 -26.889 -1.171 -13.590 1.00 25.00 H new ATOM 1135 N ASP A 74 -26.489 -0.686 -5.607 1.00 25.00 N ATOM 1136 CA ASP A 74 -27.275 -0.471 -4.386 1.00 25.00 C ATOM 1137 C ASP A 74 -28.796 -0.514 -4.668 1.00 25.00 C ATOM 1138 O ASP A 74 -29.206 -0.910 -5.762 1.00 25.00 O ATOM 1139 CB ASP A 74 -26.848 0.855 -3.711 1.00 25.00 C ATOM 1140 CG ASP A 74 -27.225 2.101 -4.501 1.00 25.00 C ATOM 1141 OD1 ASP A 74 -27.952 1.967 -5.506 1.00 25.00 O ATOM 1142 OD2 ASP A 74 -26.793 3.207 -4.111 1.00 25.00 O ATOM 0 H ASP A 74 -26.195 0.175 -6.069 1.00 25.00 H new ATOM 0 HA ASP A 74 -27.070 -1.288 -3.694 1.00 25.00 H new ATOM 0 HB2 ASP A 74 -27.305 0.912 -2.723 1.00 25.00 H new ATOM 0 HB3 ASP A 74 -25.768 0.844 -3.563 1.00 25.00 H new ATOM 1147 N ASN A 75 -29.619 -0.107 -3.683 1.00 25.00 N ATOM 1148 CA ASN A 75 -31.094 -0.195 -3.778 1.00 25.00 C ATOM 1149 C ASN A 75 -31.677 0.542 -4.997 1.00 25.00 C ATOM 1150 O ASN A 75 -32.688 0.110 -5.561 1.00 25.00 O ATOM 1151 CB ASN A 75 -31.738 0.361 -2.502 1.00 25.00 C ATOM 1152 CG ASN A 75 -31.578 -0.564 -1.308 1.00 25.00 C ATOM 1153 OD1 ASN A 75 -31.399 -1.772 -1.463 1.00 25.00 O ATOM 1154 ND2 ASN A 75 -31.640 0.002 -0.108 1.00 25.00 N ATOM 0 H ASN A 75 -29.286 0.290 -2.804 1.00 25.00 H new ATOM 0 HA ASN A 75 -31.326 -1.253 -3.900 1.00 25.00 H new ATOM 0 HB2 ASN A 75 -31.293 1.328 -2.268 1.00 25.00 H new ATOM 0 HB3 ASN A 75 -32.799 0.533 -2.682 1.00 25.00 H new ATOM 0 HD21 ASN A 75 -31.538 -0.569 0.731 1.00 25.00 H new ATOM 0 HD22 ASN A 75 -31.790 1.008 -0.026 1.00 25.00 H new ATOM 1161 N GLU A 76 -31.021 1.633 -5.410 1.00 25.00 N ATOM 1162 CA GLU A 76 -31.528 2.482 -6.497 1.00 25.00 C ATOM 1163 C GLU A 76 -30.977 2.059 -7.867 1.00 25.00 C ATOM 1164 O GLU A 76 -31.556 2.402 -8.903 1.00 25.00 O ATOM 1165 CB GLU A 76 -31.194 3.956 -6.225 1.00 25.00 C ATOM 1166 CG GLU A 76 -31.886 4.527 -4.991 1.00 25.00 C ATOM 1167 CD GLU A 76 -31.571 5.994 -4.769 1.00 25.00 C ATOM 1168 OE1 GLU A 76 -30.802 6.564 -5.572 1.00 25.00 O ATOM 1169 OE2 GLU A 76 -32.094 6.574 -3.794 1.00 25.00 O ATOM 0 H GLU A 76 -30.138 1.949 -5.009 1.00 25.00 H new ATOM 0 HA GLU A 76 -32.610 2.357 -6.526 1.00 25.00 H new ATOM 0 HB2 GLU A 76 -30.115 4.058 -6.105 1.00 25.00 H new ATOM 0 HB3 GLU A 76 -31.476 4.549 -7.095 1.00 25.00 H new ATOM 0 HG2 GLU A 76 -32.964 4.403 -5.094 1.00 25.00 H new ATOM 0 HG3 GLU A 76 -31.582 3.957 -4.113 1.00 25.00 H new ATOM 1176 N GLY A 77 -29.864 1.312 -7.862 1.00 25.00 N ATOM 1177 CA GLY A 77 -29.264 0.832 -9.103 1.00 25.00 C ATOM 1178 C GLY A 77 -28.015 1.600 -9.506 1.00 25.00 C ATOM 1179 O GLY A 77 -27.608 1.551 -10.670 1.00 25.00 O ATOM 0 H GLY A 77 -29.368 1.032 -7.016 1.00 25.00 H new ATOM 0 HA2 GLY A 77 -29.013 -0.223 -8.992 1.00 25.00 H new ATOM 0 HA3 GLY A 77 -29.999 0.902 -9.905 1.00 25.00 H new ATOM 1183 N ASN A 78 -27.409 2.308 -8.542 1.00 25.00 N ATOM 1184 CA ASN A 78 -26.154 3.032 -8.770 1.00 25.00 C ATOM 1185 C ASN A 78 -24.962 2.104 -8.546 1.00 25.00 C ATOM 1186 O ASN A 78 -25.008 1.222 -7.682 1.00 25.00 O ATOM 1187 CB ASN A 78 -26.054 4.253 -7.846 1.00 25.00 C ATOM 1188 CG ASN A 78 -27.140 5.282 -8.109 1.00 25.00 C ATOM 1189 OD1 ASN A 78 -27.240 5.830 -9.206 1.00 25.00 O ATOM 1190 ND2 ASN A 78 -27.958 5.551 -7.097 1.00 25.00 N ATOM 0 H ASN A 78 -27.772 2.394 -7.593 1.00 25.00 H new ATOM 0 HA ASN A 78 -26.143 3.381 -9.803 1.00 25.00 H new ATOM 0 HB2 ASN A 78 -26.116 3.924 -6.809 1.00 25.00 H new ATOM 0 HB3 ASN A 78 -25.078 4.721 -7.974 1.00 25.00 H new ATOM 0 HD21 ASN A 78 -28.705 6.236 -7.213 1.00 25.00 H new ATOM 0 HD22 ASN A 78 -27.839 5.073 -6.204 1.00 25.00 H new ATOM 1197 N GLU A 79 -23.894 2.314 -9.328 1.00 25.00 N ATOM 1198 CA GLU A 79 -22.726 1.429 -9.310 1.00 25.00 C ATOM 1199 C GLU A 79 -21.881 1.653 -8.052 1.00 25.00 C ATOM 1200 O GLU A 79 -21.293 2.724 -7.863 1.00 25.00 O ATOM 1201 CB GLU A 79 -21.881 1.655 -10.575 1.00 25.00 C ATOM 1202 CG GLU A 79 -20.705 0.719 -10.731 1.00 25.00 C ATOM 1203 CD GLU A 79 -19.947 0.967 -12.021 1.00 25.00 C ATOM 1204 OE1 GLU A 79 -20.603 1.129 -13.072 1.00 25.00 O ATOM 1205 OE2 GLU A 79 -18.699 1.014 -11.981 1.00 25.00 O ATOM 0 H GLU A 79 -23.817 3.093 -9.982 1.00 25.00 H new ATOM 0 HA GLU A 79 -23.076 0.397 -9.294 1.00 25.00 H new ATOM 0 HB2 GLU A 79 -22.526 1.553 -11.448 1.00 25.00 H new ATOM 0 HB3 GLU A 79 -21.512 2.681 -10.569 1.00 25.00 H new ATOM 0 HG2 GLU A 79 -20.029 0.842 -9.884 1.00 25.00 H new ATOM 0 HG3 GLU A 79 -21.058 -0.312 -10.710 1.00 25.00 H new ATOM 1212 N VAL A 80 -21.844 0.627 -7.201 1.00 25.00 N ATOM 1213 CA VAL A 80 -21.041 0.647 -5.981 1.00 25.00 C ATOM 1214 C VAL A 80 -19.990 -0.455 -6.054 1.00 25.00 C ATOM 1215 O VAL A 80 -20.282 -1.636 -5.831 1.00 25.00 O ATOM 1216 CB VAL A 80 -21.899 0.521 -4.680 1.00 25.00 C ATOM 1217 CG1 VAL A 80 -21.009 0.588 -3.446 1.00 25.00 C ATOM 1218 CG2 VAL A 80 -22.994 1.588 -4.588 1.00 25.00 C ATOM 0 H VAL A 80 -22.368 -0.237 -7.338 1.00 25.00 H new ATOM 0 HA VAL A 80 -20.554 1.620 -5.920 1.00 25.00 H new ATOM 0 HB VAL A 80 -22.393 -0.449 -4.725 1.00 25.00 H new ATOM 0 HG11 VAL A 80 -21.623 0.499 -2.550 1.00 25.00 H new ATOM 0 HG12 VAL A 80 -20.286 -0.228 -3.474 1.00 25.00 H new ATOM 0 HG13 VAL A 80 -20.480 1.541 -3.430 1.00 25.00 H new ATOM 0 HG21 VAL A 80 -23.558 1.452 -3.665 1.00 25.00 H new ATOM 0 HG22 VAL A 80 -22.538 2.578 -4.592 1.00 25.00 H new ATOM 0 HG23 VAL A 80 -23.666 1.494 -5.441 1.00 25.00 H new ATOM 1228 N VAL A 81 -18.767 -0.053 -6.382 1.00 25.00 N ATOM 1229 CA VAL A 81 -17.698 -1.000 -6.676 1.00 25.00 C ATOM 1230 C VAL A 81 -16.837 -1.303 -5.426 1.00 25.00 C ATOM 1231 O VAL A 81 -16.356 -0.375 -4.771 1.00 25.00 O ATOM 1232 CB VAL A 81 -16.832 -0.517 -7.890 1.00 25.00 C ATOM 1233 CG1 VAL A 81 -15.684 -1.477 -8.210 1.00 25.00 C ATOM 1234 CG2 VAL A 81 -17.675 -0.248 -9.142 1.00 25.00 C ATOM 0 H VAL A 81 -18.491 0.926 -6.451 1.00 25.00 H new ATOM 0 HA VAL A 81 -18.163 -1.942 -6.966 1.00 25.00 H new ATOM 0 HB VAL A 81 -16.393 0.430 -7.577 1.00 25.00 H new ATOM 0 HG11 VAL A 81 -15.116 -1.095 -9.058 1.00 25.00 H new ATOM 0 HG12 VAL A 81 -15.028 -1.562 -7.343 1.00 25.00 H new ATOM 0 HG13 VAL A 81 -16.089 -2.459 -8.456 1.00 25.00 H new ATOM 0 HG21 VAL A 81 -17.027 0.084 -9.953 1.00 25.00 H new ATOM 0 HG22 VAL A 81 -18.188 -1.163 -9.439 1.00 25.00 H new ATOM 0 HG23 VAL A 81 -18.411 0.527 -8.926 1.00 25.00 H new ATOM 1244 N PRO A 82 -16.639 -2.621 -5.077 1.00 25.00 N ATOM 1245 CA PRO A 82 -15.764 -3.034 -3.955 1.00 25.00 C ATOM 1246 C PRO A 82 -14.300 -2.653 -4.188 1.00 25.00 C ATOM 1247 O PRO A 82 -13.741 -2.913 -5.258 1.00 25.00 O ATOM 1248 CB PRO A 82 -15.932 -4.561 -3.911 1.00 25.00 C ATOM 1249 CG PRO A 82 -17.268 -4.800 -4.515 1.00 25.00 C ATOM 1250 CD PRO A 82 -17.268 -3.810 -5.708 1.00 25.00 C ATOM 0 HA PRO A 82 -16.036 -2.540 -3.022 1.00 25.00 H new ATOM 0 HB2 PRO A 82 -15.145 -5.064 -4.473 1.00 25.00 H new ATOM 0 HB3 PRO A 82 -15.884 -4.937 -2.889 1.00 25.00 H new ATOM 0 HG2 PRO A 82 -17.388 -5.833 -4.843 1.00 25.00 H new ATOM 0 HG3 PRO A 82 -18.076 -4.592 -3.813 1.00 25.00 H new ATOM 0 HD2 PRO A 82 -16.692 -4.182 -6.555 1.00 25.00 H new ATOM 0 HD3 PRO A 82 -18.274 -3.602 -6.073 1.00 25.00 H new ATOM 1258 N LYS A 83 -13.696 -2.039 -3.170 1.00 25.00 N ATOM 1259 CA LYS A 83 -12.364 -1.433 -3.302 1.00 25.00 C ATOM 1260 C LYS A 83 -11.233 -2.382 -2.859 1.00 25.00 C ATOM 1261 O LYS A 83 -11.451 -3.243 -2.000 1.00 25.00 O ATOM 1262 CB LYS A 83 -12.273 -0.127 -2.492 1.00 25.00 C ATOM 1263 CG LYS A 83 -13.167 1.018 -2.998 1.00 25.00 C ATOM 1264 CD LYS A 83 -13.095 2.276 -2.130 1.00 25.00 C ATOM 1265 CE LYS A 83 -13.957 3.420 -2.672 1.00 25.00 C ATOM 1266 NZ LYS A 83 -13.987 4.591 -1.749 1.00 25.00 N ATOM 0 H LYS A 83 -14.107 -1.946 -2.241 1.00 25.00 H new ATOM 0 HA LYS A 83 -12.230 -1.222 -4.363 1.00 25.00 H new ATOM 0 HB2 LYS A 83 -12.535 -0.341 -1.456 1.00 25.00 H new ATOM 0 HB3 LYS A 83 -11.237 0.213 -2.495 1.00 25.00 H new ATOM 0 HG2 LYS A 83 -12.877 1.272 -4.017 1.00 25.00 H new ATOM 0 HG3 LYS A 83 -14.200 0.672 -3.038 1.00 25.00 H new ATOM 0 HD2 LYS A 83 -13.417 2.032 -1.118 1.00 25.00 H new ATOM 0 HD3 LYS A 83 -12.059 2.608 -2.064 1.00 25.00 H new ATOM 0 HE2 LYS A 83 -13.572 3.734 -3.642 1.00 25.00 H new ATOM 0 HE3 LYS A 83 -14.973 3.061 -2.834 1.00 25.00 H new ATOM 0 HZ1 LYS A 83 -14.582 5.340 -2.157 1.00 25.00 H new ATOM 0 HZ2 LYS A 83 -14.379 4.299 -0.831 1.00 25.00 H new ATOM 0 HZ3 LYS A 83 -13.021 4.952 -1.614 1.00 25.00 H new ATOM 1280 N PRO A 84 -9.993 -2.239 -3.448 1.00 25.00 N ATOM 1281 CA PRO A 84 -8.818 -3.033 -3.048 1.00 25.00 C ATOM 1282 C PRO A 84 -8.188 -2.582 -1.727 1.00 25.00 C ATOM 1283 O PRO A 84 -8.429 -1.468 -1.255 1.00 25.00 O ATOM 1284 CB PRO A 84 -7.807 -2.835 -4.192 1.00 25.00 C ATOM 1285 CG PRO A 84 -8.045 -1.471 -4.758 1.00 25.00 C ATOM 1286 CD PRO A 84 -9.654 -1.324 -4.561 1.00 25.00 C ATOM 0 HA PRO A 84 -9.110 -4.070 -2.884 1.00 25.00 H new ATOM 0 HB2 PRO A 84 -6.785 -2.926 -3.823 1.00 25.00 H new ATOM 0 HB3 PRO A 84 -7.938 -3.599 -4.959 1.00 25.00 H new ATOM 0 HG2 PRO A 84 -7.492 -0.700 -4.221 1.00 25.00 H new ATOM 0 HG3 PRO A 84 -7.751 -1.403 -5.805 1.00 25.00 H new ATOM 0 HD2 PRO A 84 -9.930 -0.296 -4.324 1.00 25.00 H new ATOM 0 HD3 PRO A 84 -10.189 -1.596 -5.471 1.00 25.00 H new ATOM 1294 N GLN A 85 -7.370 -3.476 -1.153 1.00 25.00 N ATOM 1295 CA GLN A 85 -6.669 -3.217 0.110 1.00 25.00 C ATOM 1296 C GLN A 85 -5.298 -2.600 -0.149 1.00 25.00 C ATOM 1297 O GLN A 85 -4.529 -3.091 -0.980 1.00 25.00 O ATOM 1298 CB GLN A 85 -6.520 -4.508 0.927 1.00 25.00 C ATOM 1299 CG GLN A 85 -7.845 -5.102 1.391 1.00 25.00 C ATOM 1300 CD GLN A 85 -7.673 -6.398 2.160 1.00 25.00 C ATOM 1301 OE1 GLN A 85 -7.794 -7.486 1.598 1.00 25.00 O ATOM 1302 NE2 GLN A 85 -7.393 -6.288 3.454 1.00 25.00 N ATOM 0 H GLN A 85 -7.177 -4.395 -1.551 1.00 25.00 H new ATOM 0 HA GLN A 85 -7.267 -2.510 0.685 1.00 25.00 H new ATOM 0 HB2 GLN A 85 -5.992 -5.248 0.326 1.00 25.00 H new ATOM 0 HB3 GLN A 85 -5.899 -4.305 1.799 1.00 25.00 H new ATOM 0 HG2 GLN A 85 -8.362 -4.378 2.021 1.00 25.00 H new ATOM 0 HG3 GLN A 85 -8.481 -5.281 0.524 1.00 25.00 H new ATOM 0 HE21 GLN A 85 -7.301 -5.365 3.879 1.00 25.00 H new ATOM 0 HE22 GLN A 85 -7.270 -7.126 4.022 1.00 25.00 H new ATOM 1311 N ARG A 86 -5.008 -1.529 0.586 1.00 25.00 N ATOM 1312 CA ARG A 86 -3.802 -0.719 0.367 1.00 25.00 C ATOM 1313 C ARG A 86 -2.883 -0.777 1.591 1.00 25.00 C ATOM 1314 O ARG A 86 -3.336 -0.584 2.725 1.00 25.00 O ATOM 1315 CB ARG A 86 -4.202 0.734 0.070 1.00 25.00 C ATOM 1316 CG ARG A 86 -4.967 0.892 -1.242 1.00 25.00 C ATOM 1317 CD ARG A 86 -5.416 2.325 -1.485 1.00 25.00 C ATOM 1318 NE ARG A 86 -6.111 2.469 -2.772 1.00 25.00 N ATOM 1319 CZ ARG A 86 -7.427 2.280 -2.957 1.00 25.00 C ATOM 1320 NH1 ARG A 86 -8.219 1.900 -1.953 1.00 25.00 N ATOM 1321 NH2 ARG A 86 -7.953 2.473 -4.156 1.00 25.00 N ATOM 0 H ARG A 86 -5.597 -1.195 1.349 1.00 25.00 H new ATOM 0 HA ARG A 86 -3.258 -1.123 -0.487 1.00 25.00 H new ATOM 0 HB2 ARG A 86 -4.816 1.109 0.889 1.00 25.00 H new ATOM 0 HB3 ARG A 86 -3.304 1.351 0.036 1.00 25.00 H new ATOM 0 HG2 ARG A 86 -4.335 0.567 -2.069 1.00 25.00 H new ATOM 0 HG3 ARG A 86 -5.839 0.238 -1.232 1.00 25.00 H new ATOM 0 HD2 ARG A 86 -6.077 2.640 -0.678 1.00 25.00 H new ATOM 0 HD3 ARG A 86 -4.549 2.986 -1.464 1.00 25.00 H new ATOM 0 HE ARG A 86 -5.552 2.732 -3.584 1.00 25.00 H new ATOM 0 HH11 ARG A 86 -7.827 1.748 -1.024 1.00 25.00 H new ATOM 0 HH12 ARG A 86 -9.217 1.762 -2.115 1.00 25.00 H new ATOM 0 HH21 ARG A 86 -7.359 2.764 -4.933 1.00 25.00 H new ATOM 0 HH22 ARG A 86 -8.952 2.331 -4.303 1.00 25.00 H new ATOM 1335 N HIS A 87 -1.595 -1.050 1.351 1.00 25.00 N ATOM 1336 CA HIS A 87 -0.602 -1.167 2.426 1.00 25.00 C ATOM 1337 C HIS A 87 0.327 0.054 2.441 1.00 25.00 C ATOM 1338 O HIS A 87 1.123 0.253 1.519 1.00 25.00 O ATOM 1339 CB HIS A 87 0.216 -2.464 2.260 1.00 25.00 C ATOM 1340 CG HIS A 87 -0.592 -3.659 1.840 1.00 25.00 C ATOM 1341 ND1 HIS A 87 -1.052 -4.032 0.620 1.00 25.00 N flip ATOM 1342 CD2 HIS A 87 -0.997 -4.645 2.716 1.00 25.00 C flip ATOM 1343 CE1 HIS A 87 -1.715 -5.223 0.782 1.00 25.00 C flip ATOM 1344 NE2 HIS A 87 -1.666 -5.572 2.054 1.00 25.00 N flip ATOM 0 H HIS A 87 -1.214 -1.195 0.416 1.00 25.00 H new ATOM 0 HA HIS A 87 -1.130 -1.207 3.379 1.00 25.00 H new ATOM 0 HB2 HIS A 87 0.999 -2.293 1.522 1.00 25.00 H new ATOM 0 HB3 HIS A 87 0.712 -2.690 3.204 1.00 25.00 H new ATOM 0 HD1 HIS A 87 -0.928 -3.522 -0.255 1.00 25.00 H new ATOM 0 HD2 HIS A 87 -0.798 -4.657 3.777 1.00 25.00 H new ATOM 0 HE1 HIS A 87 -2.199 -5.784 -0.004 1.00 25.00 H new ATOM 1353 N MET A 88 0.222 0.861 3.505 1.00 25.00 N ATOM 1354 CA MET A 88 0.983 2.111 3.622 1.00 25.00 C ATOM 1355 C MET A 88 2.184 1.936 4.562 1.00 25.00 C ATOM 1356 O MET A 88 2.086 1.268 5.596 1.00 25.00 O ATOM 1357 CB MET A 88 0.061 3.231 4.134 1.00 25.00 C ATOM 1358 CG MET A 88 0.705 4.609 4.208 1.00 25.00 C ATOM 1359 SD MET A 88 -0.440 5.856 4.821 1.00 25.00 S ATOM 1360 CE MET A 88 -0.503 5.442 6.562 1.00 25.00 C ATOM 0 H MET A 88 -0.386 0.669 4.301 1.00 25.00 H new ATOM 0 HA MET A 88 1.365 2.381 2.637 1.00 25.00 H new ATOM 0 HB2 MET A 88 -0.812 3.289 3.484 1.00 25.00 H new ATOM 0 HB3 MET A 88 -0.298 2.960 5.127 1.00 25.00 H new ATOM 0 HG2 MET A 88 1.578 4.567 4.859 1.00 25.00 H new ATOM 0 HG3 MET A 88 1.059 4.897 3.218 1.00 25.00 H new ATOM 0 HE1 MET A 88 -0.981 6.253 7.112 1.00 25.00 H new ATOM 0 HE2 MET A 88 -1.076 4.525 6.697 1.00 25.00 H new ATOM 0 HE3 MET A 88 0.510 5.296 6.938 1.00 25.00 H new ATOM 1370 N PHE A 89 3.313 2.548 4.178 1.00 25.00 N ATOM 1371 CA PHE A 89 4.540 2.522 4.983 1.00 25.00 C ATOM 1372 C PHE A 89 5.105 3.937 5.112 1.00 25.00 C ATOM 1373 O PHE A 89 5.270 4.627 4.109 1.00 25.00 O ATOM 1374 CB PHE A 89 5.622 1.634 4.339 1.00 25.00 C ATOM 1375 CG PHE A 89 5.268 0.180 4.169 1.00 25.00 C ATOM 1376 CD1 PHE A 89 4.595 -0.250 3.036 1.00 25.00 C ATOM 1377 CD2 PHE A 89 5.614 -0.751 5.130 1.00 25.00 C ATOM 1378 CE1 PHE A 89 4.270 -1.578 2.864 1.00 25.00 C ATOM 1379 CE2 PHE A 89 5.292 -2.083 4.969 1.00 25.00 C ATOM 1380 CZ PHE A 89 4.618 -2.499 3.836 1.00 25.00 C ATOM 0 H PHE A 89 3.400 3.071 3.307 1.00 25.00 H new ATOM 0 HA PHE A 89 4.279 2.116 5.960 1.00 25.00 H new ATOM 0 HB2 PHE A 89 5.865 2.045 3.359 1.00 25.00 H new ATOM 0 HB3 PHE A 89 6.525 1.699 4.945 1.00 25.00 H new ATOM 0 HD1 PHE A 89 4.321 0.467 2.276 1.00 25.00 H new ATOM 0 HD2 PHE A 89 6.142 -0.433 6.017 1.00 25.00 H new ATOM 0 HE1 PHE A 89 3.746 -1.898 1.975 1.00 25.00 H new ATOM 0 HE2 PHE A 89 5.567 -2.801 5.728 1.00 25.00 H new ATOM 0 HZ PHE A 89 4.364 -3.541 3.710 1.00 25.00 H new ATOM 1390 N SER A 90 5.424 4.361 6.339 1.00 25.00 N ATOM 1391 CA SER A 90 6.005 5.693 6.567 1.00 25.00 C ATOM 1392 C SER A 90 7.521 5.681 6.360 1.00 25.00 C ATOM 1393 O SER A 90 8.201 4.708 6.691 1.00 25.00 O ATOM 1394 CB SER A 90 5.660 6.197 7.963 1.00 25.00 C ATOM 1395 OG SER A 90 4.290 6.544 8.059 1.00 25.00 O ATOM 0 H SER A 90 5.292 3.808 7.186 1.00 25.00 H new ATOM 0 HA SER A 90 5.573 6.375 5.835 1.00 25.00 H new ATOM 0 HB2 SER A 90 5.895 5.428 8.699 1.00 25.00 H new ATOM 0 HB3 SER A 90 6.275 7.065 8.201 1.00 25.00 H new ATOM 0 HG SER A 90 4.096 6.862 8.965 1.00 25.00 H new ATOM 1401 N PHE A 91 8.028 6.783 5.807 1.00 25.00 N ATOM 1402 CA PHE A 91 9.436 6.900 5.408 1.00 25.00 C ATOM 1403 C PHE A 91 10.088 8.148 6.007 1.00 25.00 C ATOM 1404 O PHE A 91 9.426 8.943 6.681 1.00 25.00 O ATOM 1405 CB PHE A 91 9.524 6.937 3.874 1.00 25.00 C ATOM 1406 CG PHE A 91 9.459 5.580 3.224 1.00 25.00 C ATOM 1407 CD1 PHE A 91 8.276 4.860 3.193 1.00 25.00 C ATOM 1408 CD2 PHE A 91 10.587 5.033 2.627 1.00 25.00 C ATOM 1409 CE1 PHE A 91 8.221 3.623 2.580 1.00 25.00 C ATOM 1410 CE2 PHE A 91 10.535 3.795 2.016 1.00 25.00 C ATOM 1411 CZ PHE A 91 9.350 3.092 1.992 1.00 25.00 C ATOM 0 H PHE A 91 7.477 7.621 5.622 1.00 25.00 H new ATOM 0 HA PHE A 91 9.978 6.034 5.789 1.00 25.00 H new ATOM 0 HB2 PHE A 91 8.711 7.553 3.488 1.00 25.00 H new ATOM 0 HB3 PHE A 91 10.456 7.423 3.585 1.00 25.00 H new ATOM 0 HD1 PHE A 91 7.388 5.269 3.652 1.00 25.00 H new ATOM 0 HD2 PHE A 91 11.517 5.582 2.640 1.00 25.00 H new ATOM 0 HE1 PHE A 91 7.293 3.071 2.561 1.00 25.00 H new ATOM 0 HE2 PHE A 91 11.421 3.379 1.558 1.00 25.00 H new ATOM 0 HZ PHE A 91 9.305 2.125 1.513 1.00 25.00 H new ATOM 1421 N ASN A 92 11.400 8.294 5.775 1.00 25.00 N ATOM 1422 CA ASN A 92 12.157 9.446 6.267 1.00 25.00 C ATOM 1423 C ASN A 92 12.865 10.180 5.113 1.00 25.00 C ATOM 1424 O ASN A 92 13.266 11.337 5.270 1.00 25.00 O ATOM 1425 CB ASN A 92 13.178 8.985 7.327 1.00 25.00 C ATOM 1426 CG ASN A 92 12.550 8.288 8.533 1.00 25.00 C ATOM 1427 OD1 ASN A 92 11.950 8.920 9.403 1.00 25.00 O ATOM 1428 ND2 ASN A 92 12.687 6.967 8.583 1.00 25.00 N ATOM 0 H ASN A 92 11.958 7.623 5.247 1.00 25.00 H new ATOM 0 HA ASN A 92 11.461 10.148 6.726 1.00 25.00 H new ATOM 0 HB2 ASN A 92 13.891 8.306 6.859 1.00 25.00 H new ATOM 0 HB3 ASN A 92 13.742 9.851 7.674 1.00 25.00 H new ATOM 0 HD21 ASN A 92 12.288 6.442 9.361 1.00 25.00 H new ATOM 0 HD22 ASN A 92 13.191 6.478 7.843 1.00 25.00 H new ATOM 1435 N ASN A 93 13.009 9.508 3.955 1.00 25.00 N ATOM 1436 CA ASN A 93 13.692 10.087 2.791 1.00 25.00 C ATOM 1437 C ASN A 93 13.043 9.617 1.491 1.00 25.00 C ATOM 1438 O ASN A 93 12.849 8.415 1.282 1.00 25.00 O ATOM 1439 CB ASN A 93 15.187 9.713 2.782 1.00 25.00 C ATOM 1440 CG ASN A 93 16.030 10.633 1.914 1.00 25.00 C ATOM 1441 OD1 ASN A 93 15.589 11.084 0.857 1.00 25.00 O ATOM 1442 ND2 ASN A 93 17.251 10.910 2.358 1.00 25.00 N ATOM 0 H ASN A 93 12.659 8.562 3.804 1.00 25.00 H new ATOM 0 HA ASN A 93 13.600 11.171 2.865 1.00 25.00 H new ATOM 0 HB2 ASN A 93 15.567 9.739 3.803 1.00 25.00 H new ATOM 0 HB3 ASN A 93 15.296 8.688 2.427 1.00 25.00 H new ATOM 0 HD21 ASN A 93 17.865 11.519 1.817 1.00 25.00 H new ATOM 0 HD22 ASN A 93 17.575 10.514 3.240 1.00 25.00 H new ATOM 1449 N ARG A 94 12.707 10.587 0.623 1.00 25.00 N ATOM 1450 CA ARG A 94 12.121 10.320 -0.705 1.00 25.00 C ATOM 1451 C ARG A 94 13.043 9.499 -1.621 1.00 25.00 C ATOM 1452 O ARG A 94 12.581 8.914 -2.605 1.00 25.00 O ATOM 1453 CB ARG A 94 11.751 11.629 -1.412 1.00 25.00 C ATOM 1454 CG ARG A 94 12.951 12.471 -1.844 1.00 25.00 C ATOM 1455 CD ARG A 94 12.587 13.496 -2.911 1.00 25.00 C ATOM 1456 NE ARG A 94 12.261 12.867 -4.199 1.00 25.00 N ATOM 1457 CZ ARG A 94 13.157 12.542 -5.142 1.00 25.00 C ATOM 1458 NH1 ARG A 94 14.457 12.782 -4.973 1.00 25.00 N ATOM 1459 NH2 ARG A 94 12.745 11.974 -6.266 1.00 25.00 N ATOM 0 H ARG A 94 12.834 11.579 0.821 1.00 25.00 H new ATOM 0 HA ARG A 94 11.226 9.727 -0.519 1.00 25.00 H new ATOM 0 HB2 ARG A 94 11.150 11.396 -2.291 1.00 25.00 H new ATOM 0 HB3 ARG A 94 11.125 12.224 -0.746 1.00 25.00 H new ATOM 0 HG2 ARG A 94 13.362 12.985 -0.975 1.00 25.00 H new ATOM 0 HG3 ARG A 94 13.733 11.815 -2.226 1.00 25.00 H new ATOM 0 HD2 ARG A 94 11.735 14.085 -2.571 1.00 25.00 H new ATOM 0 HD3 ARG A 94 13.419 14.187 -3.047 1.00 25.00 H new ATOM 0 HE ARG A 94 11.280 12.663 -4.390 1.00 25.00 H new ATOM 0 HH11 ARG A 94 14.787 13.221 -4.113 1.00 25.00 H new ATOM 0 HH12 ARG A 94 15.122 12.527 -5.703 1.00 25.00 H new ATOM 0 HH21 ARG A 94 11.753 11.787 -6.409 1.00 25.00 H new ATOM 0 HH22 ARG A 94 13.420 11.724 -6.988 1.00 25.00 H new ATOM 1473 N THR A 95 14.341 9.459 -1.288 1.00 25.00 N ATOM 1474 CA THR A 95 15.341 8.732 -2.083 1.00 25.00 C ATOM 1475 C THR A 95 15.229 7.207 -1.873 1.00 25.00 C ATOM 1476 O THR A 95 15.589 6.433 -2.763 1.00 25.00 O ATOM 1477 CB THR A 95 16.778 9.210 -1.739 1.00 25.00 C ATOM 1478 OG1 THR A 95 17.047 8.985 -0.349 1.00 25.00 O ATOM 1479 CG2 THR A 95 16.975 10.697 -2.038 1.00 25.00 C ATOM 0 H THR A 95 14.725 9.926 -0.466 1.00 25.00 H new ATOM 0 HA THR A 95 15.140 8.949 -3.132 1.00 25.00 H new ATOM 0 HB THR A 95 17.465 8.638 -2.362 1.00 25.00 H new ATOM 0 HG1 THR A 95 17.955 9.287 -0.138 1.00 25.00 H new ATOM 0 HG21 THR A 95 17.994 10.988 -1.782 1.00 25.00 H new ATOM 0 HG22 THR A 95 16.800 10.881 -3.098 1.00 25.00 H new ATOM 0 HG23 THR A 95 16.271 11.283 -1.447 1.00 25.00 H new ATOM 1487 N VAL A 96 14.727 6.793 -0.698 1.00 25.00 N ATOM 1488 CA VAL A 96 14.495 5.367 -0.405 1.00 25.00 C ATOM 1489 C VAL A 96 13.153 4.935 -1.012 1.00 25.00 C ATOM 1490 O VAL A 96 13.128 4.127 -1.932 1.00 25.00 O ATOM 1491 CB VAL A 96 14.504 5.061 1.132 1.00 25.00 C ATOM 1492 CG1 VAL A 96 14.244 3.579 1.410 1.00 25.00 C ATOM 1493 CG2 VAL A 96 15.817 5.485 1.784 1.00 25.00 C ATOM 0 H VAL A 96 14.474 7.423 0.063 1.00 25.00 H new ATOM 0 HA VAL A 96 15.314 4.802 -0.850 1.00 25.00 H new ATOM 0 HB VAL A 96 13.696 5.646 1.571 1.00 25.00 H new ATOM 0 HG11 VAL A 96 14.257 3.403 2.486 1.00 25.00 H new ATOM 0 HG12 VAL A 96 13.270 3.299 1.008 1.00 25.00 H new ATOM 0 HG13 VAL A 96 15.019 2.978 0.934 1.00 25.00 H new ATOM 0 HG21 VAL A 96 15.785 5.257 2.849 1.00 25.00 H new ATOM 0 HG22 VAL A 96 16.644 4.945 1.322 1.00 25.00 H new ATOM 0 HG23 VAL A 96 15.962 6.557 1.647 1.00 25.00 H new ATOM 1503 N MET A 97 12.054 5.542 -0.526 1.00 25.00 N ATOM 1504 CA MET A 97 10.676 5.268 -0.989 1.00 25.00 C ATOM 1505 C MET A 97 10.534 5.252 -2.523 1.00 25.00 C ATOM 1506 O MET A 97 9.677 4.546 -3.052 1.00 25.00 O ATOM 1507 CB MET A 97 9.707 6.304 -0.384 1.00 25.00 C ATOM 1508 CG MET A 97 9.909 7.717 -0.860 1.00 25.00 C ATOM 1509 SD MET A 97 8.500 8.794 -0.513 1.00 25.00 S ATOM 1510 CE MET A 97 8.789 9.228 1.197 1.00 25.00 C ATOM 0 H MET A 97 12.097 6.247 0.210 1.00 25.00 H new ATOM 0 HA MET A 97 10.426 4.264 -0.645 1.00 25.00 H new ATOM 0 HB2 MET A 97 8.685 6.002 -0.614 1.00 25.00 H new ATOM 0 HB3 MET A 97 9.809 6.284 0.701 1.00 25.00 H new ATOM 0 HG2 MET A 97 10.799 8.130 -0.385 1.00 25.00 H new ATOM 0 HG3 MET A 97 10.096 7.709 -1.934 1.00 25.00 H new ATOM 0 HE1 MET A 97 7.896 9.011 1.783 1.00 25.00 H new ATOM 0 HE2 MET A 97 9.627 8.648 1.583 1.00 25.00 H new ATOM 0 HE3 MET A 97 9.020 10.291 1.269 1.00 25.00 H new ATOM 1520 N ASP A 98 11.377 6.028 -3.221 1.00 25.00 N ATOM 1521 CA ASP A 98 11.413 6.012 -4.691 1.00 25.00 C ATOM 1522 C ASP A 98 12.191 4.798 -5.211 1.00 25.00 C ATOM 1523 O ASP A 98 11.826 4.235 -6.235 1.00 25.00 O ATOM 1524 CB ASP A 98 12.041 7.313 -5.219 1.00 25.00 C ATOM 1525 CG ASP A 98 11.134 8.521 -5.051 1.00 25.00 C ATOM 1526 OD1 ASP A 98 9.959 8.334 -4.673 1.00 25.00 O ATOM 1527 OD2 ASP A 98 11.603 9.654 -5.295 1.00 25.00 O ATOM 0 H ASP A 98 12.041 6.673 -2.792 1.00 25.00 H new ATOM 0 HA ASP A 98 10.388 5.938 -5.055 1.00 25.00 H new ATOM 0 HB2 ASP A 98 12.980 7.495 -4.696 1.00 25.00 H new ATOM 0 HB3 ASP A 98 12.283 7.191 -6.275 1.00 25.00 H new ATOM 1532 N ASN A 99 13.244 4.404 -4.485 1.00 25.00 N ATOM 1533 CA ASN A 99 14.076 3.246 -4.845 1.00 25.00 C ATOM 1534 C ASN A 99 13.389 1.910 -4.512 1.00 25.00 C ATOM 1535 O ASN A 99 13.601 0.918 -5.215 1.00 25.00 O ATOM 1536 CB ASN A 99 15.430 3.337 -4.124 1.00 25.00 C ATOM 1537 CG ASN A 99 16.573 3.741 -5.044 1.00 25.00 C ATOM 1538 OD1 ASN A 99 16.945 3.010 -5.964 1.00 25.00 O ATOM 1539 ND2 ASN A 99 17.136 4.919 -4.797 1.00 25.00 N ATOM 0 H ASN A 99 13.544 4.877 -3.633 1.00 25.00 H new ATOM 0 HA ASN A 99 14.228 3.271 -5.924 1.00 25.00 H new ATOM 0 HB2 ASN A 99 15.354 4.059 -3.311 1.00 25.00 H new ATOM 0 HB3 ASN A 99 15.659 2.372 -3.672 1.00 25.00 H new ATOM 0 HD21 ASN A 99 17.906 5.248 -5.379 1.00 25.00 H new ATOM 0 HD22 ASN A 99 16.798 5.494 -4.025 1.00 25.00 H new ATOM 1546 N ILE A 100 12.571 1.888 -3.438 1.00 25.00 N ATOM 1547 CA ILE A 100 11.736 0.715 -3.115 1.00 25.00 C ATOM 1548 C ILE A 100 10.603 0.610 -4.160 1.00 25.00 C ATOM 1549 O ILE A 100 10.451 -0.423 -4.809 1.00 25.00 O ATOM 1550 CB ILE A 100 11.137 0.776 -1.654 1.00 25.00 C ATOM 1551 CG1 ILE A 100 12.219 1.063 -0.569 1.00 25.00 C ATOM 1552 CG2 ILE A 100 10.368 -0.503 -1.288 1.00 25.00 C ATOM 1553 CD1 ILE A 100 13.395 0.090 -0.493 1.00 25.00 C ATOM 0 H ILE A 100 12.472 2.665 -2.785 1.00 25.00 H new ATOM 0 HA ILE A 100 12.369 -0.172 -3.149 1.00 25.00 H new ATOM 0 HB ILE A 100 10.439 1.613 -1.666 1.00 25.00 H new ATOM 0 HG12 ILE A 100 12.616 2.063 -0.742 1.00 25.00 H new ATOM 0 HG13 ILE A 100 11.728 1.079 0.404 1.00 25.00 H new ATOM 0 HG21 ILE A 100 9.975 -0.414 -0.275 1.00 25.00 H new ATOM 0 HG22 ILE A 100 9.543 -0.644 -1.986 1.00 25.00 H new ATOM 0 HG23 ILE A 100 11.040 -1.360 -1.343 1.00 25.00 H new ATOM 0 HD11 ILE A 100 14.074 0.401 0.301 1.00 25.00 H new ATOM 0 HD12 ILE A 100 13.024 -0.913 -0.281 1.00 25.00 H new ATOM 0 HD13 ILE A 100 13.926 0.087 -1.445 1.00 25.00 H new ATOM 1565 N LYS A 101 9.845 1.716 -4.324 1.00 25.00 N ATOM 1566 CA LYS A 101 8.792 1.847 -5.349 1.00 25.00 C ATOM 1567 C LYS A 101 9.303 1.485 -6.749 1.00 25.00 C ATOM 1568 O LYS A 101 8.624 0.783 -7.488 1.00 25.00 O ATOM 1569 CB LYS A 101 8.256 3.282 -5.334 1.00 25.00 C ATOM 1570 CG LYS A 101 7.133 3.537 -6.335 1.00 25.00 C ATOM 1571 CD LYS A 101 6.574 4.955 -6.239 1.00 25.00 C ATOM 1572 CE LYS A 101 5.470 5.227 -7.260 1.00 25.00 C ATOM 1573 NZ LYS A 101 4.937 6.611 -7.145 1.00 25.00 N ATOM 0 H LYS A 101 9.949 2.548 -3.743 1.00 25.00 H new ATOM 0 HA LYS A 101 7.993 1.145 -5.110 1.00 25.00 H new ATOM 0 HB2 LYS A 101 7.895 3.513 -4.332 1.00 25.00 H new ATOM 0 HB3 LYS A 101 9.077 3.968 -5.543 1.00 25.00 H new ATOM 0 HG2 LYS A 101 7.505 3.364 -7.345 1.00 25.00 H new ATOM 0 HG3 LYS A 101 6.329 2.821 -6.164 1.00 25.00 H new ATOM 0 HD2 LYS A 101 6.182 5.119 -5.235 1.00 25.00 H new ATOM 0 HD3 LYS A 101 7.383 5.670 -6.386 1.00 25.00 H new ATOM 0 HE2 LYS A 101 5.859 5.070 -8.266 1.00 25.00 H new ATOM 0 HE3 LYS A 101 4.659 4.513 -7.117 1.00 25.00 H new ATOM 0 HZ1 LYS A 101 4.190 6.756 -7.855 1.00 25.00 H new ATOM 0 HZ2 LYS A 101 4.542 6.753 -6.193 1.00 25.00 H new ATOM 0 HZ3 LYS A 101 5.705 7.293 -7.307 1.00 25.00 H new ATOM 1587 N MET A 102 10.511 1.957 -7.084 1.00 25.00 N ATOM 1588 CA MET A 102 11.158 1.672 -8.377 1.00 25.00 C ATOM 1589 C MET A 102 11.269 0.158 -8.632 1.00 25.00 C ATOM 1590 O MET A 102 10.864 -0.315 -9.693 1.00 25.00 O ATOM 1591 CB MET A 102 12.543 2.335 -8.397 1.00 25.00 C ATOM 1592 CG MET A 102 13.304 2.219 -9.714 1.00 25.00 C ATOM 1593 SD MET A 102 14.951 2.961 -9.660 1.00 25.00 S ATOM 1594 CE MET A 102 14.565 4.685 -9.357 1.00 25.00 C ATOM 0 H MET A 102 11.070 2.548 -6.468 1.00 25.00 H new ATOM 0 HA MET A 102 10.544 2.083 -9.179 1.00 25.00 H new ATOM 0 HB2 MET A 102 12.425 3.392 -8.157 1.00 25.00 H new ATOM 0 HB3 MET A 102 13.150 1.894 -7.606 1.00 25.00 H new ATOM 0 HG2 MET A 102 13.397 1.166 -9.980 1.00 25.00 H new ATOM 0 HG3 MET A 102 12.724 2.697 -10.503 1.00 25.00 H new ATOM 0 HE1 MET A 102 15.444 5.296 -9.562 1.00 25.00 H new ATOM 0 HE2 MET A 102 13.748 4.995 -10.008 1.00 25.00 H new ATOM 0 HE3 MET A 102 14.269 4.814 -8.316 1.00 25.00 H new ATOM 1604 N THR A 103 11.806 -0.587 -7.649 1.00 25.00 N ATOM 1605 CA THR A 103 11.894 -2.052 -7.740 1.00 25.00 C ATOM 1606 C THR A 103 10.485 -2.662 -7.831 1.00 25.00 C ATOM 1607 O THR A 103 10.172 -3.317 -8.819 1.00 25.00 O ATOM 1608 CB THR A 103 12.675 -2.655 -6.539 1.00 25.00 C ATOM 1609 OG1 THR A 103 14.016 -2.148 -6.529 1.00 25.00 O ATOM 1610 CG2 THR A 103 12.724 -4.186 -6.599 1.00 25.00 C ATOM 0 H THR A 103 12.184 -0.198 -6.785 1.00 25.00 H new ATOM 0 HA THR A 103 12.447 -2.299 -8.646 1.00 25.00 H new ATOM 0 HB THR A 103 12.150 -2.364 -5.629 1.00 25.00 H new ATOM 0 HG1 THR A 103 14.504 -2.529 -5.770 1.00 25.00 H new ATOM 0 HG21 THR A 103 13.279 -4.566 -5.741 1.00 25.00 H new ATOM 0 HG22 THR A 103 11.709 -4.584 -6.580 1.00 25.00 H new ATOM 0 HG23 THR A 103 13.219 -4.498 -7.519 1.00 25.00 H new ATOM 1618 N LEU A 104 9.633 -2.376 -6.819 1.00 25.00 N ATOM 1619 CA LEU A 104 8.221 -2.811 -6.781 1.00 25.00 C ATOM 1620 C LEU A 104 7.553 -2.612 -8.147 1.00 25.00 C ATOM 1621 O LEU A 104 7.135 -3.569 -8.785 1.00 25.00 O ATOM 1622 CB LEU A 104 7.452 -1.981 -5.723 1.00 25.00 C ATOM 1623 CG LEU A 104 7.841 -2.184 -4.251 1.00 25.00 C ATOM 1624 CD1 LEU A 104 7.245 -1.083 -3.384 1.00 25.00 C ATOM 1625 CD2 LEU A 104 7.369 -3.524 -3.719 1.00 25.00 C ATOM 0 H LEU A 104 9.910 -1.833 -6.001 1.00 25.00 H new ATOM 0 HA LEU A 104 8.195 -3.870 -6.523 1.00 25.00 H new ATOM 0 HB2 LEU A 104 7.580 -0.926 -5.964 1.00 25.00 H new ATOM 0 HB3 LEU A 104 6.390 -2.204 -5.825 1.00 25.00 H new ATOM 0 HG LEU A 104 8.930 -2.152 -4.207 1.00 25.00 H new ATOM 0 HD11 LEU A 104 7.531 -1.243 -2.345 1.00 25.00 H new ATOM 0 HD12 LEU A 104 7.618 -0.115 -3.718 1.00 25.00 H new ATOM 0 HD13 LEU A 104 6.158 -1.102 -3.468 1.00 25.00 H new ATOM 0 HD21 LEU A 104 7.665 -3.626 -2.675 1.00 25.00 H new ATOM 0 HD22 LEU A 104 6.283 -3.584 -3.796 1.00 25.00 H new ATOM 0 HD23 LEU A 104 7.819 -4.326 -4.304 1.00 25.00 H new ATOM 1637 N GLN A 105 7.544 -1.352 -8.600 1.00 25.00 N ATOM 1638 CA GLN A 105 6.985 -0.941 -9.909 1.00 25.00 C ATOM 1639 C GLN A 105 7.494 -1.789 -11.087 1.00 25.00 C ATOM 1640 O GLN A 105 6.778 -1.986 -12.073 1.00 25.00 O ATOM 1641 CB GLN A 105 7.327 0.535 -10.168 1.00 25.00 C ATOM 1642 CG GLN A 105 6.711 1.096 -11.445 1.00 25.00 C ATOM 1643 CD GLN A 105 7.024 2.570 -11.673 1.00 25.00 C ATOM 1644 OE1 GLN A 105 7.800 3.184 -10.935 1.00 25.00 O ATOM 1645 NE2 GLN A 105 6.417 3.145 -12.705 1.00 25.00 N ATOM 0 H GLN A 105 7.929 -0.573 -8.065 1.00 25.00 H new ATOM 0 HA GLN A 105 5.907 -1.093 -9.850 1.00 25.00 H new ATOM 0 HB2 GLN A 105 6.988 1.131 -9.320 1.00 25.00 H new ATOM 0 HB3 GLN A 105 8.410 0.643 -10.221 1.00 25.00 H new ATOM 0 HG2 GLN A 105 7.072 0.520 -12.297 1.00 25.00 H new ATOM 0 HG3 GLN A 105 5.630 0.964 -11.406 1.00 25.00 H new ATOM 0 HE21 GLN A 105 5.783 2.602 -13.291 1.00 25.00 H new ATOM 0 HE22 GLN A 105 6.585 4.130 -12.912 1.00 25.00 H new ATOM 1654 N GLN A 106 8.729 -2.285 -10.965 1.00 25.00 N ATOM 1655 CA GLN A 106 9.357 -3.120 -11.995 1.00 25.00 C ATOM 1656 C GLN A 106 8.983 -4.600 -11.815 1.00 25.00 C ATOM 1657 O GLN A 106 9.082 -5.389 -12.757 1.00 25.00 O ATOM 1658 CB GLN A 106 10.883 -2.928 -11.957 1.00 25.00 C ATOM 1659 CG GLN A 106 11.357 -1.611 -12.573 1.00 25.00 C ATOM 1660 CD GLN A 106 12.873 -1.475 -12.646 1.00 25.00 C ATOM 1661 OE1 GLN A 106 13.485 -1.668 -13.701 1.00 25.00 O ATOM 1662 NE2 GLN A 106 13.489 -1.139 -11.518 1.00 25.00 N ATOM 0 H GLN A 106 9.321 -2.120 -10.151 1.00 25.00 H new ATOM 0 HA GLN A 106 8.986 -2.809 -12.972 1.00 25.00 H new ATOM 0 HB2 GLN A 106 11.220 -2.975 -10.921 1.00 25.00 H new ATOM 0 HB3 GLN A 106 11.357 -3.756 -12.484 1.00 25.00 H new ATOM 0 HG2 GLN A 106 10.945 -1.522 -13.578 1.00 25.00 H new ATOM 0 HG3 GLN A 106 10.955 -0.783 -11.989 1.00 25.00 H new ATOM 0 HE21 GLN A 106 12.948 -0.988 -10.667 1.00 25.00 H new ATOM 0 HE22 GLN A 106 14.503 -1.032 -11.503 1.00 25.00 H new ATOM 1671 N ILE A 107 8.554 -4.955 -10.593 1.00 25.00 N ATOM 1672 CA ILE A 107 8.096 -6.313 -10.261 1.00 25.00 C ATOM 1673 C ILE A 107 6.622 -6.536 -10.676 1.00 25.00 C ATOM 1674 O ILE A 107 6.292 -7.601 -11.205 1.00 25.00 O ATOM 1675 CB ILE A 107 8.293 -6.609 -8.731 1.00 25.00 C ATOM 1676 CG1 ILE A 107 9.808 -6.642 -8.382 1.00 25.00 C ATOM 1677 CG2 ILE A 107 7.601 -7.917 -8.323 1.00 25.00 C ATOM 1678 CD1 ILE A 107 10.157 -6.630 -6.895 1.00 25.00 C ATOM 0 H ILE A 107 8.515 -4.307 -9.806 1.00 25.00 H new ATOM 0 HA ILE A 107 8.707 -7.013 -10.830 1.00 25.00 H new ATOM 0 HB ILE A 107 7.826 -5.805 -8.163 1.00 25.00 H new ATOM 0 HG12 ILE A 107 10.243 -7.536 -8.829 1.00 25.00 H new ATOM 0 HG13 ILE A 107 10.287 -5.784 -8.853 1.00 25.00 H new ATOM 0 HG21 ILE A 107 7.756 -8.094 -7.259 1.00 25.00 H new ATOM 0 HG22 ILE A 107 6.533 -7.843 -8.527 1.00 25.00 H new ATOM 0 HG23 ILE A 107 8.022 -8.745 -8.893 1.00 25.00 H new ATOM 0 HD11 ILE A 107 11.240 -6.655 -6.775 1.00 25.00 H new ATOM 0 HD12 ILE A 107 9.762 -5.724 -6.436 1.00 25.00 H new ATOM 0 HD13 ILE A 107 9.718 -7.502 -6.411 1.00 25.00 H new ATOM 1690 N ILE A 108 5.744 -5.544 -10.433 1.00 25.00 N ATOM 1691 CA ILE A 108 4.304 -5.674 -10.767 1.00 25.00 C ATOM 1692 C ILE A 108 4.097 -5.684 -12.286 1.00 25.00 C ATOM 1693 O ILE A 108 3.223 -6.388 -12.791 1.00 25.00 O ATOM 1694 CB ILE A 108 3.428 -4.546 -10.132 1.00 25.00 C ATOM 1695 CG1 ILE A 108 3.600 -4.542 -8.610 1.00 25.00 C ATOM 1696 CG2 ILE A 108 1.946 -4.751 -10.483 1.00 25.00 C ATOM 1697 CD1 ILE A 108 3.274 -3.226 -7.936 1.00 25.00 C ATOM 0 H ILE A 108 5.998 -4.651 -10.011 1.00 25.00 H new ATOM 0 HA ILE A 108 3.979 -6.624 -10.342 1.00 25.00 H new ATOM 0 HB ILE A 108 3.756 -3.588 -10.535 1.00 25.00 H new ATOM 0 HG12 ILE A 108 2.964 -5.319 -8.185 1.00 25.00 H new ATOM 0 HG13 ILE A 108 4.630 -4.809 -8.374 1.00 25.00 H new ATOM 0 HG21 ILE A 108 1.352 -3.956 -10.032 1.00 25.00 H new ATOM 0 HG22 ILE A 108 1.822 -4.727 -11.566 1.00 25.00 H new ATOM 0 HG23 ILE A 108 1.612 -5.715 -10.101 1.00 25.00 H new ATOM 0 HD11 ILE A 108 3.425 -3.321 -6.861 1.00 25.00 H new ATOM 0 HD12 ILE A 108 3.927 -2.445 -8.327 1.00 25.00 H new ATOM 0 HD13 ILE A 108 2.235 -2.963 -8.134 1.00 25.00 H new ATOM 1709 N SER A 109 4.915 -4.897 -12.990 1.00 25.00 N ATOM 1710 CA SER A 109 4.902 -4.846 -14.464 1.00 25.00 C ATOM 1711 C SER A 109 5.309 -6.200 -15.081 1.00 25.00 C ATOM 1712 O SER A 109 5.059 -6.449 -16.265 1.00 25.00 O ATOM 1713 CB SER A 109 5.830 -3.729 -14.951 1.00 25.00 C ATOM 1714 OG SER A 109 7.192 -4.030 -14.686 1.00 25.00 O ATOM 0 H SER A 109 5.604 -4.278 -12.562 1.00 25.00 H new ATOM 0 HA SER A 109 3.884 -4.634 -14.790 1.00 25.00 H new ATOM 0 HB2 SER A 109 5.691 -3.580 -16.022 1.00 25.00 H new ATOM 0 HB3 SER A 109 5.562 -2.793 -14.462 1.00 25.00 H new ATOM 0 HG SER A 109 7.253 -4.593 -13.886 1.00 25.00 H new ATOM 1720 N ARG A 110 5.932 -7.065 -14.260 1.00 25.00 N ATOM 1721 CA ARG A 110 6.246 -8.451 -14.653 1.00 25.00 C ATOM 1722 C ARG A 110 4.996 -9.339 -14.552 1.00 25.00 C ATOM 1723 O ARG A 110 4.758 -10.185 -15.418 1.00 25.00 O ATOM 1724 CB ARG A 110 7.362 -9.039 -13.773 1.00 25.00 C ATOM 1725 CG ARG A 110 8.741 -8.436 -14.013 1.00 25.00 C ATOM 1726 CD ARG A 110 9.782 -9.030 -13.079 1.00 25.00 C ATOM 1727 NE ARG A 110 11.094 -8.390 -13.241 1.00 25.00 N ATOM 1728 CZ ARG A 110 12.160 -8.616 -12.458 1.00 25.00 C ATOM 1729 NH1 ARG A 110 12.102 -9.473 -11.440 1.00 25.00 N ATOM 1730 NH2 ARG A 110 13.297 -7.978 -12.701 1.00 25.00 N ATOM 0 H ARG A 110 6.230 -6.826 -13.314 1.00 25.00 H new ATOM 0 HA ARG A 110 6.590 -8.428 -15.687 1.00 25.00 H new ATOM 0 HB2 ARG A 110 7.095 -8.897 -12.726 1.00 25.00 H new ATOM 0 HB3 ARG A 110 7.415 -10.114 -13.945 1.00 25.00 H new ATOM 0 HG2 ARG A 110 9.039 -8.608 -15.047 1.00 25.00 H new ATOM 0 HG3 ARG A 110 8.697 -7.356 -13.870 1.00 25.00 H new ATOM 0 HD2 ARG A 110 9.449 -8.919 -12.047 1.00 25.00 H new ATOM 0 HD3 ARG A 110 9.874 -10.099 -13.271 1.00 25.00 H new ATOM 0 HE ARG A 110 11.203 -7.724 -14.006 1.00 25.00 H new ATOM 0 HH11 ARG A 110 11.235 -9.973 -11.243 1.00 25.00 H new ATOM 0 HH12 ARG A 110 12.925 -9.630 -10.858 1.00 25.00 H new ATOM 0 HH21 ARG A 110 13.357 -7.321 -13.479 1.00 25.00 H new ATOM 0 HH22 ARG A 110 14.112 -8.145 -12.110 1.00 25.00 H new ATOM 1744 N TYR A 111 4.206 -9.130 -13.482 1.00 25.00 N ATOM 1745 CA TYR A 111 2.931 -9.842 -13.280 1.00 25.00 C ATOM 1746 C TYR A 111 1.773 -9.123 -13.984 1.00 25.00 C ATOM 1747 O TYR A 111 0.635 -9.606 -13.990 1.00 25.00 O ATOM 1748 CB TYR A 111 2.635 -9.986 -11.784 1.00 25.00 C ATOM 1749 CG TYR A 111 3.777 -10.612 -11.010 1.00 25.00 C ATOM 1750 CD1 TYR A 111 4.242 -11.887 -11.326 1.00 25.00 C ATOM 1751 CD2 TYR A 111 4.396 -9.927 -9.972 1.00 25.00 C ATOM 1752 CE1 TYR A 111 5.290 -12.453 -10.636 1.00 25.00 C ATOM 1753 CE2 TYR A 111 5.442 -10.493 -9.275 1.00 25.00 C ATOM 1754 CZ TYR A 111 5.885 -11.754 -9.612 1.00 25.00 C ATOM 1755 OH TYR A 111 6.934 -12.314 -8.924 1.00 25.00 O ATOM 0 H TYR A 111 4.431 -8.468 -12.739 1.00 25.00 H new ATOM 0 HA TYR A 111 3.027 -10.834 -13.721 1.00 25.00 H new ATOM 0 HB2 TYR A 111 2.417 -9.003 -11.367 1.00 25.00 H new ATOM 0 HB3 TYR A 111 1.739 -10.594 -11.654 1.00 25.00 H new ATOM 0 HD1 TYR A 111 3.772 -12.440 -12.126 1.00 25.00 H new ATOM 0 HD2 TYR A 111 4.053 -8.938 -9.708 1.00 25.00 H new ATOM 0 HE1 TYR A 111 5.643 -13.440 -10.897 1.00 25.00 H new ATOM 0 HE2 TYR A 111 5.912 -9.951 -8.468 1.00 25.00 H new ATOM 0 HH TYR A 111 7.676 -11.675 -8.882 1.00 25.00 H new ATOM 1765 N LYS A 112 2.092 -7.971 -14.585 1.00 25.00 N ATOM 1766 CA LYS A 112 1.134 -7.171 -15.344 1.00 25.00 C ATOM 1767 C LYS A 112 1.083 -7.657 -16.799 1.00 25.00 C ATOM 1768 O LYS A 112 0.057 -7.535 -17.474 1.00 25.00 O ATOM 1769 CB LYS A 112 1.560 -5.701 -15.283 1.00 25.00 C ATOM 1770 CG LYS A 112 0.587 -4.733 -15.951 1.00 25.00 C ATOM 1771 CD LYS A 112 -0.728 -4.560 -15.167 1.00 25.00 C ATOM 1772 CE LYS A 112 -1.687 -3.530 -15.785 1.00 25.00 C ATOM 1773 NZ LYS A 112 -2.889 -3.284 -14.937 1.00 25.00 N ATOM 0 H LYS A 112 3.029 -7.568 -14.556 1.00 25.00 H new ATOM 0 HA LYS A 112 0.138 -7.277 -14.914 1.00 25.00 H new ATOM 0 HB2 LYS A 112 1.680 -5.413 -14.238 1.00 25.00 H new ATOM 0 HB3 LYS A 112 2.537 -5.599 -15.756 1.00 25.00 H new ATOM 0 HG2 LYS A 112 1.068 -3.761 -16.060 1.00 25.00 H new ATOM 0 HG3 LYS A 112 0.360 -5.091 -16.955 1.00 25.00 H new ATOM 0 HD2 LYS A 112 -1.234 -5.524 -15.107 1.00 25.00 H new ATOM 0 HD3 LYS A 112 -0.495 -4.258 -14.146 1.00 25.00 H new ATOM 0 HE2 LYS A 112 -1.156 -2.590 -15.937 1.00 25.00 H new ATOM 0 HE3 LYS A 112 -2.005 -3.879 -16.767 1.00 25.00 H new ATOM 0 HZ1 LYS A 112 -3.502 -2.582 -15.399 1.00 25.00 H new ATOM 0 HZ2 LYS A 112 -3.414 -4.173 -14.812 1.00 25.00 H new ATOM 0 HZ3 LYS A 112 -2.591 -2.925 -14.008 1.00 25.00 H new ATOM 1787 N ASP A 113 2.217 -8.208 -17.256 1.00 25.00 N ATOM 1788 CA ASP A 113 2.341 -8.813 -18.575 1.00 25.00 C ATOM 1789 C ASP A 113 2.099 -10.327 -18.521 1.00 25.00 C ATOM 1790 O ASP A 113 1.796 -10.950 -19.543 1.00 25.00 O ATOM 1791 CB ASP A 113 3.735 -8.523 -19.129 1.00 25.00 C ATOM 1792 CG ASP A 113 3.925 -7.068 -19.517 1.00 25.00 C ATOM 1793 OD1 ASP A 113 2.927 -6.319 -19.523 1.00 25.00 O ATOM 1794 OD2 ASP A 113 5.075 -6.678 -19.813 1.00 25.00 O ATOM 0 H ASP A 113 3.077 -8.243 -16.709 1.00 25.00 H new ATOM 0 HA ASP A 113 1.584 -8.381 -19.229 1.00 25.00 H new ATOM 0 HB2 ASP A 113 4.481 -8.795 -18.382 1.00 25.00 H new ATOM 0 HB3 ASP A 113 3.912 -9.153 -20.001 1.00 25.00 H new ATOM 1799 N ALA A 114 2.232 -10.907 -17.315 1.00 25.00 N ATOM 1800 CA ALA A 114 2.034 -12.346 -17.104 1.00 25.00 C ATOM 1801 C ALA A 114 0.559 -12.704 -16.871 1.00 25.00 C ATOM 1802 O ALA A 114 0.199 -13.884 -16.820 1.00 25.00 O ATOM 1803 CB ALA A 114 2.887 -12.832 -15.940 1.00 25.00 C ATOM 0 H ALA A 114 2.478 -10.394 -16.468 1.00 25.00 H new ATOM 0 HA ALA A 114 2.348 -12.852 -18.017 1.00 25.00 H new ATOM 0 HB1 ALA A 114 2.730 -13.901 -15.795 1.00 25.00 H new ATOM 0 HB2 ALA A 114 3.939 -12.646 -16.157 1.00 25.00 H new ATOM 0 HB3 ALA A 114 2.604 -12.298 -15.033 1.00 25.00 H new ATOM 1809 N ASP A 115 -0.281 -11.672 -16.745 1.00 25.00 N ATOM 1810 CA ASP A 115 -1.715 -11.848 -16.509 1.00 25.00 C ATOM 1811 C ASP A 115 -2.517 -11.441 -17.755 1.00 25.00 C ATOM 1812 O ASP A 115 -2.956 -12.349 -18.493 1.00 25.00 O ATOM 1813 CB ASP A 115 -2.147 -11.040 -15.272 1.00 25.00 C ATOM 1814 CG ASP A 115 -3.618 -11.212 -14.922 1.00 25.00 C ATOM 1815 OD1 ASP A 115 -4.254 -12.142 -15.464 1.00 25.00 O ATOM 1816 OD2 ASP A 115 -4.132 -10.416 -14.108 1.00 25.00 O ATOM 1817 OXT ASP A 115 -2.684 -10.223 -17.992 1.00 25.00 O ATOM 0 H ASP A 115 0.013 -10.697 -16.803 1.00 25.00 H new ATOM 0 HA ASP A 115 -1.920 -12.901 -16.314 1.00 25.00 H new ATOM 0 HB2 ASP A 115 -1.540 -11.343 -14.419 1.00 25.00 H new ATOM 0 HB3 ASP A 115 -1.944 -9.984 -15.448 1.00 25.00 H new TER 1822 ASP A 115 ATOM 1823 N GLY B 519 -22.361 -1.694 8.120 1.00 25.00 N ATOM 1824 CA GLY B 519 -21.845 -2.543 7.012 1.00 25.00 C ATOM 1825 C GLY B 519 -22.747 -3.727 6.721 1.00 25.00 C ATOM 1826 O GLY B 519 -23.955 -3.561 6.534 1.00 25.00 O ATOM 0 HA2 GLY B 519 -21.743 -1.938 6.111 1.00 25.00 H new ATOM 0 HA3 GLY B 519 -20.849 -2.903 7.268 1.00 25.00 H new ATOM 1832 N SER B 520 -22.151 -4.924 6.685 1.00 25.00 N ATOM 1833 CA SER B 520 -22.890 -6.160 6.416 1.00 25.00 C ATOM 1834 C SER B 520 -23.124 -6.956 7.714 1.00 25.00 C ATOM 1835 O SER B 520 -22.174 -7.180 8.470 1.00 25.00 O ATOM 1836 CB SER B 520 -22.132 -7.023 5.401 1.00 25.00 C ATOM 1837 OG SER B 520 -22.699 -8.320 5.308 1.00 25.00 O ATOM 0 H SER B 520 -21.152 -5.062 6.840 1.00 25.00 H new ATOM 0 HA SER B 520 -23.860 -5.890 5.999 1.00 25.00 H new ATOM 0 HB2 SER B 520 -22.153 -6.543 4.423 1.00 25.00 H new ATOM 0 HB3 SER B 520 -21.085 -7.101 5.695 1.00 25.00 H new ATOM 0 HG SER B 520 -22.198 -8.850 4.653 1.00 25.00 H new ATOM 1843 N PRO B 521 -24.394 -7.398 8.004 1.00 25.00 N ATOM 1844 CA PRO B 521 -24.702 -8.163 9.233 1.00 25.00 C ATOM 1845 C PRO B 521 -24.183 -9.610 9.196 1.00 25.00 C ATOM 1846 O PRO B 521 -24.333 -10.306 8.185 1.00 25.00 O ATOM 1847 CB PRO B 521 -26.236 -8.129 9.285 1.00 25.00 C ATOM 1848 CG PRO B 521 -26.661 -7.944 7.878 1.00 25.00 C ATOM 1849 CD PRO B 521 -25.624 -7.173 7.188 1.00 25.00 C ATOM 0 HA PRO B 521 -24.217 -7.733 10.110 1.00 25.00 H new ATOM 0 HB2 PRO B 521 -26.638 -9.053 9.701 1.00 25.00 H new ATOM 0 HB3 PRO B 521 -26.592 -7.314 9.916 1.00 25.00 H new ATOM 0 HG2 PRO B 521 -26.803 -8.910 7.393 1.00 25.00 H new ATOM 0 HG3 PRO B 521 -27.617 -7.421 7.834 1.00 25.00 H new ATOM 0 HD2 PRO B 521 -25.489 -7.516 6.162 1.00 25.00 H new ATOM 0 HD3 PRO B 521 -25.881 -6.115 7.139 1.00 25.00 H new ATOM 1857 N GLY B 522 -23.574 -10.040 10.306 1.00 25.00 N ATOM 1858 CA GLY B 522 -23.047 -11.394 10.406 1.00 25.00 C ATOM 1859 C GLY B 522 -21.717 -11.452 11.133 1.00 25.00 C ATOM 1860 O GLY B 522 -20.693 -11.781 10.530 1.00 25.00 O ATOM 0 H GLY B 522 -23.437 -9.470 11.140 1.00 25.00 H new ATOM 0 HA2 GLY B 522 -23.769 -12.023 10.927 1.00 25.00 H new ATOM 0 HA3 GLY B 522 -22.928 -11.808 9.405 1.00 25.00 H new ATOM 1864 N TYR B 523 -21.742 -11.129 12.444 1.00 25.00 N ATOM 1865 CA TYR B 523 -20.547 -11.142 13.323 1.00 25.00 C ATOM 1866 C TYR B 523 -19.416 -10.226 12.787 1.00 25.00 C ATOM 1867 O TYR B 523 -18.618 -10.660 11.946 1.00 25.00 O ATOM 1868 CB TYR B 523 -20.023 -12.581 13.543 1.00 25.00 C ATOM 1869 CG TYR B 523 -21.074 -13.558 14.036 1.00 25.00 C ATOM 1870 CD1 TYR B 523 -21.832 -14.307 13.141 1.00 25.00 C ATOM 1871 CD2 TYR B 523 -21.304 -13.734 15.396 1.00 25.00 C ATOM 1872 CE1 TYR B 523 -22.788 -15.200 13.588 1.00 25.00 C ATOM 1873 CE2 TYR B 523 -22.258 -14.625 15.850 1.00 25.00 C ATOM 1874 CZ TYR B 523 -22.998 -15.355 14.942 1.00 25.00 C ATOM 1875 OH TYR B 523 -23.949 -16.243 15.391 1.00 25.00 O ATOM 0 H TYR B 523 -22.596 -10.850 12.927 1.00 25.00 H new ATOM 0 HA TYR B 523 -20.864 -10.742 14.286 1.00 25.00 H new ATOM 0 HB2 TYR B 523 -19.610 -12.952 12.605 1.00 25.00 H new ATOM 0 HB3 TYR B 523 -19.205 -12.551 14.263 1.00 25.00 H new ATOM 0 HD1 TYR B 523 -21.671 -14.189 12.080 1.00 25.00 H new ATOM 0 HD2 TYR B 523 -20.727 -13.165 16.110 1.00 25.00 H new ATOM 0 HE1 TYR B 523 -23.368 -15.774 12.880 1.00 25.00 H new ATOM 0 HE2 TYR B 523 -22.424 -14.749 16.910 1.00 25.00 H new ATOM 0 HH TYR B 523 -23.970 -16.232 16.371 1.00 25.00 H new ATOM 1885 N PRO B 524 -19.335 -8.932 13.248 1.00 25.00 N ATOM 1886 CA PRO B 524 -18.256 -8.000 12.834 1.00 25.00 C ATOM 1887 C PRO B 524 -16.872 -8.423 13.341 1.00 25.00 C ATOM 1888 O PRO B 524 -16.740 -8.943 14.454 1.00 25.00 O ATOM 1889 CB PRO B 524 -18.660 -6.658 13.469 1.00 25.00 C ATOM 1890 CG PRO B 524 -20.133 -6.771 13.708 1.00 25.00 C ATOM 1891 CD PRO B 524 -20.286 -8.254 14.165 1.00 25.00 C ATOM 0 HA PRO B 524 -18.164 -7.967 11.748 1.00 25.00 H new ATOM 0 HB2 PRO B 524 -18.121 -6.484 14.400 1.00 25.00 H new ATOM 0 HB3 PRO B 524 -18.430 -5.823 12.807 1.00 25.00 H new ATOM 0 HG2 PRO B 524 -20.475 -6.073 14.472 1.00 25.00 H new ATOM 0 HG3 PRO B 524 -20.708 -6.563 12.806 1.00 25.00 H new ATOM 0 HD2 PRO B 524 -20.019 -8.392 15.213 1.00 25.00 H new ATOM 0 HD3 PRO B 524 -21.306 -8.619 14.045 1.00 25.00 H new ATOM 1899 N ASN B 525 -15.850 -8.192 12.510 1.00 25.00 N ATOM 1900 CA ASN B 525 -14.468 -8.545 12.847 1.00 25.00 C ATOM 1901 C ASN B 525 -13.582 -7.299 12.937 1.00 25.00 C ATOM 1902 O ASN B 525 -13.703 -6.380 12.119 1.00 25.00 O ATOM 1903 CB ASN B 525 -13.895 -9.554 11.826 1.00 25.00 C ATOM 1904 CG ASN B 525 -14.596 -10.909 11.841 1.00 25.00 C ATOM 1905 OD1 ASN B 525 -14.542 -11.638 12.832 1.00 25.00 O ATOM 1906 ND2 ASN B 525 -15.253 -11.248 10.739 1.00 25.00 N ATOM 0 H ASN B 525 -15.956 -7.759 11.593 1.00 25.00 H new ATOM 0 HA ASN B 525 -14.475 -9.019 13.829 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -13.970 -9.127 10.826 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -12.835 -9.701 12.031 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -15.739 -12.143 10.690 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -15.272 -10.613 9.941 1.00 25.00 H new ATOM 1913 N GLY B 526 -12.696 -7.284 13.939 1.00 25.00 N ATOM 1914 CA GLY B 526 -11.794 -6.158 14.139 1.00 25.00 C ATOM 1915 C GLY B 526 -10.432 -6.582 14.653 1.00 25.00 C ATOM 1916 O GLY B 526 -9.968 -6.078 15.680 1.00 25.00 O ATOM 0 H GLY B 526 -12.589 -8.038 14.618 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -11.672 -5.624 13.197 1.00 25.00 H new ATOM 0 HA3 GLY B 526 -12.243 -5.459 14.845 1.00 25.00 H new ATOM 1920 N LEU B 527 -9.795 -7.511 13.932 1.00 25.00 N ATOM 1921 CA LEU B 527 -8.460 -8.002 14.285 1.00 25.00 C ATOM 1922 C LEU B 527 -7.479 -7.730 13.153 1.00 25.00 C ATOM 1923 O LEU B 527 -6.353 -7.274 13.373 1.00 25.00 O ATOM 1924 CB LEU B 527 -8.523 -9.510 14.623 1.00 25.00 C ATOM 1925 CG LEU B 527 -9.359 -9.913 15.857 1.00 25.00 C ATOM 1926 CD1 LEU B 527 -9.500 -11.425 15.924 1.00 25.00 C ATOM 1927 CD2 LEU B 527 -8.727 -9.401 17.149 1.00 25.00 C ATOM 0 H LEU B 527 -10.187 -7.940 13.094 1.00 25.00 H new ATOM 0 HA LEU B 527 -8.106 -7.470 15.168 1.00 25.00 H new ATOM 0 HB2 LEU B 527 -8.922 -10.036 13.756 1.00 25.00 H new ATOM 0 HB3 LEU B 527 -7.504 -9.868 14.772 1.00 25.00 H new ATOM 0 HG LEU B 527 -10.344 -9.458 15.753 1.00 25.00 H new ATOM 0 HD11 LEU B 527 -10.091 -11.697 16.798 1.00 25.00 H new ATOM 0 HD12 LEU B 527 -9.998 -11.784 15.023 1.00 25.00 H new ATOM 0 HD13 LEU B 527 -8.512 -11.880 15.999 1.00 25.00 H new ATOM 0 HD21 LEU B 527 -9.340 -9.702 17.998 1.00 25.00 H new ATOM 0 HD22 LEU B 527 -7.727 -9.821 17.256 1.00 25.00 H new ATOM 0 HD23 LEU B 527 -8.662 -8.313 17.116 1.00 25.00 H new ATOM 1939 N LEU B 528 -7.939 -8.022 11.953 1.00 25.00 N ATOM 1940 CA LEU B 528 -7.165 -7.819 10.726 1.00 25.00 C ATOM 1941 C LEU B 528 -7.663 -6.568 9.994 1.00 25.00 C ATOM 1942 O LEU B 528 -6.967 -6.008 9.142 1.00 25.00 O ATOM 1943 CB LEU B 528 -7.264 -9.079 9.837 1.00 25.00 C ATOM 1944 CG LEU B 528 -6.766 -10.405 10.446 1.00 25.00 C ATOM 1945 CD1 LEU B 528 -7.147 -11.566 9.543 1.00 25.00 C ATOM 1946 CD2 LEU B 528 -5.252 -10.393 10.643 1.00 25.00 C ATOM 0 H LEU B 528 -8.868 -8.411 11.791 1.00 25.00 H new ATOM 0 HA LEU B 528 -6.115 -7.661 10.972 1.00 25.00 H new ATOM 0 HB2 LEU B 528 -8.307 -9.209 9.548 1.00 25.00 H new ATOM 0 HB3 LEU B 528 -6.701 -8.894 8.922 1.00 25.00 H new ATOM 0 HG LEU B 528 -7.239 -10.523 11.421 1.00 25.00 H new ATOM 0 HD11 LEU B 528 -6.792 -12.499 9.980 1.00 25.00 H new ATOM 0 HD12 LEU B 528 -8.231 -11.604 9.438 1.00 25.00 H new ATOM 0 HD13 LEU B 528 -6.692 -11.429 8.562 1.00 25.00 H new ATOM 0 HD21 LEU B 528 -4.934 -11.342 11.074 1.00 25.00 H new ATOM 0 HD22 LEU B 528 -4.761 -10.248 9.681 1.00 25.00 H new ATOM 0 HD23 LEU B 528 -4.979 -9.580 11.315 1.00 25.00 H new ATOM 1958 N SER B 529 -8.867 -6.136 10.367 1.00 25.00 N ATOM 1959 CA SER B 529 -9.499 -4.948 9.787 1.00 25.00 C ATOM 1960 C SER B 529 -9.706 -3.860 10.857 1.00 25.00 C ATOM 1961 O SER B 529 -10.714 -3.140 10.854 1.00 25.00 O ATOM 1962 CB SER B 529 -10.833 -5.333 9.131 1.00 25.00 C ATOM 1963 OG SER B 529 -11.672 -6.024 10.040 1.00 25.00 O ATOM 0 H SER B 529 -9.433 -6.598 11.079 1.00 25.00 H new ATOM 0 HA SER B 529 -8.839 -4.539 9.022 1.00 25.00 H new ATOM 0 HB2 SER B 529 -11.339 -4.435 8.776 1.00 25.00 H new ATOM 0 HB3 SER B 529 -10.645 -5.959 8.259 1.00 25.00 H new ATOM 0 HG SER B 529 -12.242 -5.382 10.512 1.00 25.00 H new ATOM 1969 N GLY B 530 -8.726 -3.743 11.764 1.00 25.00 N ATOM 1970 CA GLY B 530 -8.801 -2.772 12.851 1.00 25.00 C ATOM 1971 C GLY B 530 -7.939 -1.537 12.618 1.00 25.00 C ATOM 1972 O GLY B 530 -8.154 -0.504 13.257 1.00 25.00 O ATOM 0 H GLY B 530 -7.877 -4.309 11.762 1.00 25.00 H new ATOM 0 HA2 GLY B 530 -9.838 -2.463 12.982 1.00 25.00 H new ATOM 0 HA3 GLY B 530 -8.492 -3.252 13.779 1.00 25.00 H new ATOM 1976 N ASP B 531 -6.965 -1.649 11.705 1.00 25.00 N ATOM 1977 CA ASP B 531 -6.063 -0.538 11.379 1.00 25.00 C ATOM 1978 C ASP B 531 -6.143 -0.204 9.880 1.00 25.00 C ATOM 1979 O ASP B 531 -5.517 0.750 9.408 1.00 25.00 O ATOM 1980 CB ASP B 531 -4.621 -0.897 11.786 1.00 25.00 C ATOM 1981 CG ASP B 531 -4.446 -1.088 13.285 1.00 25.00 C ATOM 1982 OD1 ASP B 531 -4.658 -0.112 14.037 1.00 25.00 O ATOM 1983 OD2 ASP B 531 -4.098 -2.212 13.704 1.00 25.00 O ATOM 0 H ASP B 531 -6.782 -2.502 11.177 1.00 25.00 H new ATOM 0 HA ASP B 531 -6.371 0.346 11.938 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -4.324 -1.812 11.274 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -3.949 -0.109 11.447 1.00 25.00 H new ATOM 1988 N GLU B 532 -6.936 -0.997 9.154 1.00 25.00 N ATOM 1989 CA GLU B 532 -7.121 -0.837 7.715 1.00 25.00 C ATOM 1990 C GLU B 532 -8.416 -0.091 7.378 1.00 25.00 C ATOM 1991 O GLU B 532 -8.804 0.025 6.209 1.00 25.00 O ATOM 1992 CB GLU B 532 -7.127 -2.213 7.065 1.00 25.00 C ATOM 1993 CG GLU B 532 -5.803 -2.948 7.152 1.00 25.00 C ATOM 1994 CD GLU B 532 -5.854 -4.327 6.522 1.00 25.00 C ATOM 1995 OE1 GLU B 532 -6.905 -4.678 5.948 1.00 25.00 O ATOM 1996 OE2 GLU B 532 -4.841 -5.054 6.600 1.00 25.00 O ATOM 0 H GLU B 532 -7.468 -1.770 9.553 1.00 25.00 H new ATOM 0 HA GLU B 532 -6.297 -0.236 7.329 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -7.899 -2.821 7.536 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -7.402 -2.106 6.016 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -5.031 -2.357 6.659 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -5.513 -3.042 8.198 1.00 25.00 H new ATOM 2003 N ASP B 533 -9.059 0.422 8.418 1.00 25.00 N ATOM 2004 CA ASP B 533 -10.320 1.163 8.295 1.00 25.00 C ATOM 2005 C ASP B 533 -10.066 2.677 8.179 1.00 25.00 C ATOM 2006 O ASP B 533 -10.927 3.418 7.695 1.00 25.00 O ATOM 2007 CB ASP B 533 -11.219 0.859 9.506 1.00 25.00 C ATOM 2008 CG ASP B 533 -11.823 -0.538 9.471 1.00 25.00 C ATOM 2009 OD1 ASP B 533 -11.761 -1.184 8.403 1.00 25.00 O ATOM 2010 OD2 ASP B 533 -12.356 -0.981 10.508 1.00 25.00 O ATOM 0 H ASP B 533 -8.724 0.339 9.378 1.00 25.00 H new ATOM 0 HA ASP B 533 -10.824 0.841 7.384 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -10.636 0.973 10.420 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -12.023 1.594 9.547 1.00 25.00 H new ATOM 2015 N PHE B 534 -8.880 3.121 8.622 1.00 25.00 N ATOM 2016 CA PHE B 534 -8.507 4.542 8.580 1.00 25.00 C ATOM 2017 C PHE B 534 -7.707 4.883 7.317 1.00 25.00 C ATOM 2018 O PHE B 534 -7.420 6.056 7.055 1.00 25.00 O ATOM 2019 CB PHE B 534 -7.700 4.924 9.832 1.00 25.00 C ATOM 2020 CG PHE B 534 -8.441 4.733 11.133 1.00 25.00 C ATOM 2021 CD1 PHE B 534 -8.223 3.608 11.916 1.00 25.00 C ATOM 2022 CD2 PHE B 534 -9.352 5.683 11.575 1.00 25.00 C ATOM 2023 CE1 PHE B 534 -8.898 3.435 13.110 1.00 25.00 C ATOM 2024 CE2 PHE B 534 -10.029 5.514 12.768 1.00 25.00 C ATOM 2025 CZ PHE B 534 -9.802 4.388 13.536 1.00 25.00 C ATOM 0 H PHE B 534 -8.161 2.513 9.015 1.00 25.00 H new ATOM 0 HA PHE B 534 -9.431 5.120 8.558 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -6.787 4.329 9.857 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -7.397 5.968 9.750 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -7.518 2.859 11.589 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -9.534 6.565 10.979 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -8.718 2.555 13.709 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -10.735 6.261 13.100 1.00 25.00 H new ATOM 0 HZ PHE B 534 -10.331 4.253 14.468 1.00 25.00 H new ATOM 2035 N SER B 535 -7.363 3.852 6.535 1.00 25.00 N ATOM 2036 CA SER B 535 -6.639 4.030 5.277 1.00 25.00 C ATOM 2037 C SER B 535 -7.601 4.275 4.101 1.00 25.00 C ATOM 2038 O SER B 535 -7.165 4.603 2.993 1.00 25.00 O ATOM 2039 CB SER B 535 -5.749 2.812 4.998 1.00 25.00 C ATOM 2040 OG SER B 535 -6.521 1.656 4.716 1.00 25.00 O ATOM 0 H SER B 535 -7.578 2.880 6.757 1.00 25.00 H new ATOM 0 HA SER B 535 -6.008 4.913 5.377 1.00 25.00 H new ATOM 0 HB2 SER B 535 -5.092 3.026 4.155 1.00 25.00 H new ATOM 0 HB3 SER B 535 -5.110 2.622 5.860 1.00 25.00 H new ATOM 0 HG SER B 535 -5.924 0.899 4.541 1.00 25.00 H new ATOM 2046 N SER B 536 -8.911 4.119 4.362 1.00 25.00 N ATOM 2047 CA SER B 536 -9.957 4.385 3.363 1.00 25.00 C ATOM 2048 C SER B 536 -10.254 5.885 3.265 1.00 25.00 C ATOM 2049 O SER B 536 -10.555 6.397 2.183 1.00 25.00 O ATOM 2050 CB SER B 536 -11.234 3.607 3.708 1.00 25.00 C ATOM 2051 OG SER B 536 -11.802 4.055 4.929 1.00 25.00 O ATOM 0 H SER B 536 -9.271 3.808 5.264 1.00 25.00 H new ATOM 0 HA SER B 536 -9.593 4.049 2.392 1.00 25.00 H new ATOM 0 HB2 SER B 536 -11.960 3.723 2.904 1.00 25.00 H new ATOM 0 HB3 SER B 536 -11.005 2.544 3.780 1.00 25.00 H new ATOM 0 HG SER B 536 -11.300 3.678 5.681 1.00 25.00 H new ATOM 2057 N ILE B 537 -10.164 6.572 4.411 1.00 25.00 N ATOM 2058 CA ILE B 537 -10.274 8.034 4.467 1.00 25.00 C ATOM 2059 C ILE B 537 -8.915 8.684 4.173 1.00 25.00 C ATOM 2060 O ILE B 537 -8.840 9.881 3.874 1.00 25.00 O ATOM 2061 CB ILE B 537 -10.863 8.498 5.850 1.00 25.00 C ATOM 2062 CG1 ILE B 537 -9.926 8.081 7.014 1.00 25.00 C ATOM 2063 CG2 ILE B 537 -12.294 7.988 6.111 1.00 25.00 C ATOM 2064 CD1 ILE B 537 -10.279 8.679 8.376 1.00 25.00 C ATOM 0 H ILE B 537 -10.014 6.133 5.319 1.00 25.00 H new ATOM 0 HA ILE B 537 -10.970 8.364 3.696 1.00 25.00 H new ATOM 0 HB ILE B 537 -10.924 9.585 5.801 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -9.937 6.994 7.098 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.906 8.371 6.761 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -12.636 8.346 7.082 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -12.960 8.359 5.332 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -12.299 6.898 6.104 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -9.567 8.328 9.123 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -10.238 9.767 8.318 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -11.285 8.369 8.660 1.00 25.00 H new ATOM 2076 N ALA B 538 -7.855 7.877 4.235 1.00 25.00 N ATOM 2077 CA ALA B 538 -6.519 8.339 3.892 1.00 25.00 C ATOM 2078 C ALA B 538 -6.245 8.200 2.386 1.00 25.00 C ATOM 2079 O ALA B 538 -5.117 8.394 1.919 1.00 25.00 O ATOM 2080 CB ALA B 538 -5.484 7.599 4.720 1.00 25.00 C ATOM 0 H ALA B 538 -7.901 6.899 4.521 1.00 25.00 H new ATOM 0 HA ALA B 538 -6.450 9.401 4.127 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -4.487 7.952 4.456 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -5.666 7.783 5.779 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -5.555 6.530 4.520 1.00 25.00 H new ATOM 2086 N ASP B 539 -7.311 7.873 1.643 1.00 25.00 N ATOM 2087 CA ASP B 539 -7.280 7.819 0.178 1.00 25.00 C ATOM 2088 C ASP B 539 -7.680 9.186 -0.396 1.00 25.00 C ATOM 2089 O ASP B 539 -7.191 9.591 -1.453 1.00 25.00 O ATOM 2090 CB ASP B 539 -8.223 6.717 -0.336 1.00 25.00 C ATOM 2091 CG ASP B 539 -7.598 5.329 -0.312 1.00 25.00 C ATOM 2092 OD1 ASP B 539 -6.442 5.189 -0.764 1.00 25.00 O ATOM 2093 OD2 ASP B 539 -8.265 4.385 0.160 1.00 25.00 O ATOM 0 H ASP B 539 -8.220 7.638 2.043 1.00 25.00 H new ATOM 0 HA ASP B 539 -6.269 7.581 -0.151 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -9.128 6.711 0.271 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -8.525 6.954 -1.356 1.00 25.00 H new ATOM 2098 N MET B 540 -8.579 9.884 0.324 1.00 25.00 N ATOM 2099 CA MET B 540 -8.950 11.268 0.003 1.00 25.00 C ATOM 2100 C MET B 540 -7.810 12.236 0.326 1.00 25.00 C ATOM 2101 O MET B 540 -7.739 13.338 -0.226 1.00 25.00 O ATOM 2102 CB MET B 540 -10.207 11.681 0.764 1.00 25.00 C ATOM 2103 CG MET B 540 -11.452 10.911 0.335 1.00 25.00 C ATOM 2104 SD MET B 540 -11.846 11.107 -1.414 1.00 25.00 S ATOM 2105 CE MET B 540 -12.291 12.838 -1.472 1.00 25.00 C ATOM 0 H MET B 540 -9.063 9.505 1.138 1.00 25.00 H new ATOM 0 HA MET B 540 -9.151 11.313 -1.067 1.00 25.00 H new ATOM 0 HB2 MET B 540 -10.044 11.529 1.831 1.00 25.00 H new ATOM 0 HB3 MET B 540 -10.379 12.747 0.617 1.00 25.00 H new ATOM 0 HG2 MET B 540 -11.308 9.852 0.551 1.00 25.00 H new ATOM 0 HG3 MET B 540 -12.301 11.246 0.931 1.00 25.00 H new ATOM 0 HE1 MET B 540 -12.776 13.057 -2.423 1.00 25.00 H new ATOM 0 HE2 MET B 540 -12.975 13.065 -0.655 1.00 25.00 H new ATOM 0 HE3 MET B 540 -11.393 13.448 -1.374 1.00 25.00 H new ATOM 2115 N ASP B 541 -6.923 11.797 1.227 1.00 25.00 N ATOM 2116 CA ASP B 541 -5.750 12.553 1.624 1.00 25.00 C ATOM 2117 C ASP B 541 -4.587 12.370 0.641 1.00 25.00 C ATOM 2118 O ASP B 541 -3.807 13.299 0.416 1.00 25.00 O ATOM 2119 CB ASP B 541 -5.323 12.101 3.018 1.00 25.00 C ATOM 2120 CG ASP B 541 -6.269 12.575 4.106 1.00 25.00 C ATOM 2121 OD1 ASP B 541 -7.123 13.438 3.814 1.00 25.00 O ATOM 2122 OD2 ASP B 541 -6.156 12.082 5.247 1.00 25.00 O ATOM 0 H ASP B 541 -7.009 10.897 1.700 1.00 25.00 H new ATOM 0 HA ASP B 541 -6.009 13.612 1.625 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -5.267 11.013 3.041 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -4.321 12.476 3.225 1.00 25.00 H new ATOM 2127 N PHE B 542 -4.484 11.163 0.060 1.00 25.00 N ATOM 2128 CA PHE B 542 -3.365 10.804 -0.819 1.00 25.00 C ATOM 2129 C PHE B 542 -3.595 11.250 -2.272 1.00 25.00 C ATOM 2130 O PHE B 542 -2.632 11.519 -2.997 1.00 25.00 O ATOM 2131 CB PHE B 542 -3.119 9.286 -0.767 1.00 25.00 C ATOM 2132 CG PHE B 542 -1.848 8.887 -0.066 1.00 25.00 C ATOM 2133 CD1 PHE B 542 -1.820 8.683 1.307 1.00 25.00 C ATOM 2134 CD2 PHE B 542 -0.677 8.727 -0.785 1.00 25.00 C ATOM 2135 CE1 PHE B 542 -0.651 8.324 1.938 1.00 25.00 C ATOM 2136 CE2 PHE B 542 0.494 8.372 -0.153 1.00 25.00 C ATOM 2137 CZ PHE B 542 0.505 8.169 1.206 1.00 25.00 C ATOM 0 H PHE B 542 -5.168 10.417 0.186 1.00 25.00 H new ATOM 0 HA PHE B 542 -2.485 11.333 -0.453 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -3.961 8.810 -0.265 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -3.095 8.899 -1.786 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -2.724 8.807 1.885 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -0.681 8.882 -1.854 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -0.640 8.164 3.006 1.00 25.00 H new ATOM 0 HE2 PHE B 542 1.403 8.253 -0.725 1.00 25.00 H new ATOM 0 HZ PHE B 542 1.422 7.887 1.701 1.00 25.00 H new ATOM 2147 N SER B 543 -4.868 11.335 -2.683 1.00 25.00 N ATOM 2148 CA SER B 543 -5.229 11.685 -4.067 1.00 25.00 C ATOM 2149 C SER B 543 -5.065 13.188 -4.346 1.00 25.00 C ATOM 2150 O SER B 543 -5.003 13.603 -5.508 1.00 25.00 O ATOM 2151 CB SER B 543 -6.667 11.243 -4.357 1.00 25.00 C ATOM 2152 OG SER B 543 -7.604 11.979 -3.586 1.00 25.00 O ATOM 0 H SER B 543 -5.669 11.166 -2.075 1.00 25.00 H new ATOM 0 HA SER B 543 -4.544 11.158 -4.731 1.00 25.00 H new ATOM 0 HB2 SER B 543 -6.883 11.376 -5.417 1.00 25.00 H new ATOM 0 HB3 SER B 543 -6.772 10.180 -4.141 1.00 25.00 H new ATOM 0 HG SER B 543 -7.769 11.513 -2.740 1.00 25.00 H new ATOM 2158 N ALA B 544 -4.992 13.990 -3.276 1.00 25.00 N ATOM 2159 CA ALA B 544 -4.793 15.438 -3.392 1.00 25.00 C ATOM 2160 C ALA B 544 -3.304 15.813 -3.363 1.00 25.00 C ATOM 2161 O ALA B 544 -2.936 16.942 -3.703 1.00 25.00 O ATOM 2162 CB ALA B 544 -5.544 16.158 -2.279 1.00 25.00 C ATOM 0 H ALA B 544 -5.068 13.657 -2.315 1.00 25.00 H new ATOM 0 HA ALA B 544 -5.190 15.753 -4.357 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -5.391 17.233 -2.373 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -6.608 15.935 -2.355 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -5.171 15.821 -1.312 1.00 25.00 H new ATOM 2168 N LEU B 545 -2.455 14.853 -2.961 1.00 25.00 N ATOM 2169 CA LEU B 545 -1.014 15.066 -2.845 1.00 25.00 C ATOM 2170 C LEU B 545 -0.279 14.819 -4.168 1.00 25.00 C ATOM 2171 O LEU B 545 0.669 15.540 -4.492 1.00 25.00 O ATOM 2172 CB LEU B 545 -0.445 14.157 -1.750 1.00 25.00 C ATOM 2173 CG LEU B 545 -0.930 14.432 -0.313 1.00 25.00 C ATOM 2174 CD1 LEU B 545 -0.434 13.357 0.640 1.00 25.00 C ATOM 2175 CD2 LEU B 545 -0.459 15.800 0.183 1.00 25.00 C ATOM 0 H LEU B 545 -2.754 13.911 -2.709 1.00 25.00 H new ATOM 0 HA LEU B 545 -0.856 16.112 -2.580 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -0.689 13.125 -2.002 1.00 25.00 H new ATOM 0 HB3 LEU B 545 0.642 14.241 -1.766 1.00 25.00 H new ATOM 0 HG LEU B 545 -2.020 14.422 -0.335 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -0.789 13.572 1.648 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -0.813 12.386 0.322 1.00 25.00 H new ATOM 0 HD13 LEU B 545 0.656 13.341 0.635 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -0.818 15.962 1.199 1.00 25.00 H new ATOM 0 HD22 LEU B 545 0.630 15.835 0.173 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -0.853 16.579 -0.470 1.00 25.00 H new ATOM 2187 N LEU B 546 -0.719 13.801 -4.930 1.00 25.00 N ATOM 2188 CA LEU B 546 -0.123 13.487 -6.242 1.00 25.00 C ATOM 2189 C LEU B 546 -0.522 14.541 -7.275 1.00 25.00 C ATOM 2190 O LEU B 546 0.265 14.901 -8.156 1.00 25.00 O ATOM 2191 CB LEU B 546 -0.556 12.089 -6.723 1.00 25.00 C ATOM 2192 CG LEU B 546 0.005 10.902 -5.934 1.00 25.00 C ATOM 2193 CD1 LEU B 546 -0.744 9.629 -6.294 1.00 25.00 C ATOM 2194 CD2 LEU B 546 1.493 10.721 -6.202 1.00 25.00 C ATOM 0 H LEU B 546 -1.484 13.183 -4.660 1.00 25.00 H new ATOM 0 HA LEU B 546 0.961 13.493 -6.129 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -1.644 12.038 -6.693 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -0.260 11.978 -7.766 1.00 25.00 H new ATOM 0 HG LEU B 546 -0.130 11.109 -4.872 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -0.335 8.793 -5.726 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -1.801 9.748 -6.054 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -0.634 9.431 -7.360 1.00 25.00 H new ATOM 0 HD21 LEU B 546 1.865 9.872 -5.629 1.00 25.00 H new ATOM 0 HD22 LEU B 546 1.652 10.539 -7.265 1.00 25.00 H new ATOM 0 HD23 LEU B 546 2.029 11.622 -5.904 1.00 25.00 H new ATOM 2206 N SER B 547 -1.758 15.018 -7.140 1.00 25.00 N ATOM 2207 CA SER B 547 -2.260 16.152 -7.914 1.00 25.00 C ATOM 2208 C SER B 547 -2.466 17.351 -6.975 1.00 25.00 C ATOM 2209 O SER B 547 -3.598 17.759 -6.684 1.00 25.00 O ATOM 2210 CB SER B 547 -3.562 15.769 -8.640 1.00 25.00 C ATOM 2211 OG SER B 547 -4.565 15.357 -7.723 1.00 25.00 O ATOM 0 H SER B 547 -2.441 14.629 -6.490 1.00 25.00 H new ATOM 0 HA SER B 547 -1.534 16.431 -8.677 1.00 25.00 H new ATOM 0 HB2 SER B 547 -3.922 16.620 -9.217 1.00 25.00 H new ATOM 0 HB3 SER B 547 -3.362 14.965 -9.348 1.00 25.00 H new ATOM 0 HG SER B 547 -4.703 16.058 -7.052 1.00 25.00 H new ATOM 2217 N GLN B 548 -1.340 17.903 -6.501 1.00 25.00 N ATOM 2218 CA GLN B 548 -1.344 18.970 -5.498 1.00 25.00 C ATOM 2219 C GLN B 548 -1.276 20.349 -6.177 1.00 25.00 C ATOM 2220 O GLN B 548 -0.265 21.060 -6.098 1.00 25.00 O ATOM 2221 CB GLN B 548 -0.163 18.762 -4.525 1.00 25.00 C ATOM 2222 CG GLN B 548 -0.220 19.606 -3.247 1.00 25.00 C ATOM 2223 CD GLN B 548 0.860 19.260 -2.231 1.00 25.00 C ATOM 2224 OE1 GLN B 548 1.730 18.429 -2.491 1.00 25.00 O ATOM 2225 NE2 GLN B 548 0.806 19.900 -1.068 1.00 25.00 N ATOM 0 H GLN B 548 -0.407 17.622 -6.802 1.00 25.00 H new ATOM 0 HA GLN B 548 -2.273 18.932 -4.930 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -0.123 17.709 -4.246 1.00 25.00 H new ATOM 0 HB3 GLN B 548 0.765 18.988 -5.050 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -0.130 20.659 -3.514 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -1.197 19.478 -2.782 1.00 25.00 H new ATOM 0 HE21 GLN B 548 0.067 20.581 -0.895 1.00 25.00 H new ATOM 0 HE22 GLN B 548 1.503 19.710 -0.348 1.00 25.00 H new ATOM 2234 N ILE B 549 -2.372 20.708 -6.854 1.00 25.00 N ATOM 2235 CA ILE B 549 -2.476 21.991 -7.557 1.00 25.00 C ATOM 2236 C ILE B 549 -3.400 22.939 -6.778 1.00 25.00 C ATOM 2237 O ILE B 549 -4.586 22.648 -6.587 1.00 25.00 O ATOM 2238 CB ILE B 549 -3.000 21.811 -9.027 1.00 25.00 C ATOM 2239 CG1 ILE B 549 -2.080 20.875 -9.871 1.00 25.00 C ATOM 2240 CG2 ILE B 549 -3.180 23.165 -9.734 1.00 25.00 C ATOM 2241 CD1 ILE B 549 -2.629 20.426 -11.228 1.00 25.00 C ATOM 0 H ILE B 549 -3.205 20.124 -6.930 1.00 25.00 H new ATOM 0 HA ILE B 549 -1.476 22.422 -7.616 1.00 25.00 H new ATOM 0 HB ILE B 549 -3.976 21.333 -8.948 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -1.132 21.387 -10.038 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -1.862 19.986 -9.279 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -3.544 23.000 -10.748 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -3.901 23.770 -9.184 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -2.223 23.686 -9.772 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -1.901 19.781 -11.720 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -3.559 19.877 -11.081 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -2.818 21.300 -11.851 1.00 25.00 H new ATOM 2253 N SER B 550 -2.833 24.065 -6.331 1.00 25.00 N ATOM 2254 CA SER B 550 -3.580 25.073 -5.574 1.00 25.00 C ATOM 2255 C SER B 550 -3.593 26.412 -6.311 1.00 25.00 C ATOM 2256 O SER B 550 -2.572 26.837 -6.861 1.00 25.00 O ATOM 2257 CB SER B 550 -2.972 25.251 -4.177 1.00 25.00 C ATOM 2258 OG SER B 550 -3.111 24.071 -3.403 1.00 25.00 O ATOM 0 H SER B 550 -1.852 24.301 -6.482 1.00 25.00 H new ATOM 0 HA SER B 550 -4.608 24.725 -5.473 1.00 25.00 H new ATOM 0 HB2 SER B 550 -1.917 25.508 -4.267 1.00 25.00 H new ATOM 0 HB3 SER B 550 -3.460 26.082 -3.668 1.00 25.00 H new ATOM 0 HG SER B 550 -2.714 24.211 -2.518 1.00 25.00 H new ATOM 2264 N SER B 551 -4.760 27.067 -6.313 1.00 25.00 N ATOM 2265 CA SER B 551 -4.930 28.363 -6.972 1.00 25.00 C ATOM 2266 C SER B 551 -5.151 29.472 -5.936 1.00 25.00 C ATOM 2267 O SER B 551 -4.187 30.215 -5.655 1.00 25.00 O ATOM 2268 CB SER B 551 -6.096 28.304 -7.973 1.00 25.00 C ATOM 2269 OG SER B 551 -6.326 29.567 -8.579 1.00 25.00 O ATOM 2270 OXT SER B 551 -6.280 29.581 -5.403 1.00 25.00 O ATOM 0 H SER B 551 -5.605 26.716 -5.862 1.00 25.00 H new ATOM 0 HA SER B 551 -4.018 28.596 -7.523 1.00 25.00 H new ATOM 0 HB2 SER B 551 -5.879 27.564 -8.743 1.00 25.00 H new ATOM 0 HB3 SER B 551 -7.000 27.975 -7.461 1.00 25.00 H new ATOM 0 HG SER B 551 -7.072 29.496 -9.211 1.00 25.00 H new TER 2276 SER B 551