USER MOD reduce.3.24.130724 H: found=0, std=0, add=1254, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1254 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 87 HIS : no HE2:sc= -3.57! C(o=-3.2!,f=-8.6!) USER MOD Set 1.2: B 92 GLN : amide:sc= 0.347 K(o=-3.2,f=-5.8!) USER MOD Set 2.1: B 87 HIS :FLIP no HD1:sc= -1.96 X(o=-2.8,f=-2.6) USER MOD Set 2.2: B 90 ASN :FLIP amide:sc= -0.688 F(o=-3.2,f=-2.6) USER MOD Set 3.1: B 58 LYS NZ :NH3+ 172:sc= 0.00125 (180deg=0) USER MOD Set 3.2: B 59 THR OG1 : rot 82:sc= 1.26 USER MOD Set 4.1: A 77 LYS NZ :NH3+ -176:sc= 2.25 (180deg=1.06) USER MOD Set 4.2: B 34 HIS : no HE2:sc= 0.266! C(o=2.5!,f=-14!) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 171:sc= -0.0172 (180deg=-0.113) USER MOD Single : A 29 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0119) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HE2:sc= 0.65 K(o=0.65,f=-5.4!) USER MOD Single : A 36 LYS NZ :NH3+ -157:sc= -0.199 (180deg=-0.699!) USER MOD Single : A 37 SER OG : rot 180:sc= 0.113 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 168:sc=-0.00116 (180deg=-0.145) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 53 SER OG : rot 82:sc= 1.01 USER MOD Single : A 55 SER OG : rot -79:sc= 1.12 USER MOD Single : A 56 GLN : amide:sc= 0.221 K(o=0.22,f=-2.4) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 94:sc= 1.23 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00117) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HE2:sc= -0.0919 K(o=-0.092,f=-1.2) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl 143:sc= -0.233 (180deg=-3.54!) USER MOD Single : A 84 THR OG1 : rot 84:sc= -0.342 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.0954 X(o=-0.095,f=-0.38) USER MOD Single : A 92 GLN : amide:sc= -1.56! C(o=-1.6!,f=-6!) USER MOD Single : A 95 GLN : amide:sc= 0.688 K(o=0.69,f=-0.42) USER MOD Single : B 26 MET CE :methyl 161:sc= -0.144 (180deg=-0.643) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 168:sc= -0.0142 (180deg=-0.201) USER MOD Single : B 30 THR OG1 : rot 180:sc= 0.0628 USER MOD Single : B 32 SER OG : rot 150:sc= 0 USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 SER OG : rot -175:sc= 0.964 USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 42 MET CE :methyl -162:sc= -0.113 (180deg=-0.626) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 ASN : amide:sc= 0.982 K(o=0.98,f=-0.11) USER MOD Single : B 53 SER OG : rot 92:sc= 1.3 USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= 0.00149 X(o=0.0015,f=0) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 174:sc= 1.32 (180deg=1.19) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 70 SER OG : rot 180:sc= 0 USER MOD Single : B 72 HIS : no HE2:sc= -1.3 K(o=-1.3,f=-2.3) USER MOD Single : B 73 SER OG : rot 77:sc= 1.31 USER MOD Single : B 74 LYS NZ :NH3+ 129:sc= 1.22 (180deg=0.806) USER MOD Single : B 77 LYS NZ :NH3+ 177:sc= 1.18 (180deg=1.04) USER MOD Single : B 83 MET CE :methyl 143:sc= -0.184 (180deg=-0.895) USER MOD Single : B 84 THR OG1 : rot 89:sc= 0.0316 USER MOD Single : B 86 LYS NZ :NH3+ -157:sc= -0.0909 (180deg=-0.454) USER MOD Single : B 95 GLN : amide:sc= -0.318 X(o=-0.32,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 26 0.300 1.300 22.525 1.00 0.00 N ATOM 2 CA MET A 26 -1.145 1.481 22.719 1.00 0.00 C ATOM 3 C MET A 26 -1.663 2.536 21.762 1.00 0.00 C ATOM 4 O MET A 26 -2.680 2.347 21.114 1.00 0.00 O ATOM 5 CB MET A 26 -1.477 1.884 24.166 1.00 0.00 C ATOM 6 CG MET A 26 -1.010 0.894 25.220 1.00 0.00 C ATOM 7 SD MET A 26 -1.702 -0.755 24.983 1.00 0.00 S ATOM 8 CE MET A 26 -0.889 -1.651 26.311 1.00 0.00 C ATOM 0 HA MET A 26 -1.632 0.527 22.517 1.00 0.00 H new ATOM 0 HB2 MET A 26 -1.025 2.854 24.372 1.00 0.00 H new ATOM 0 HB3 MET A 26 -2.556 2.009 24.256 1.00 0.00 H new ATOM 0 HG2 MET A 26 0.078 0.833 25.199 1.00 0.00 H new ATOM 0 HG3 MET A 26 -1.289 1.262 26.207 1.00 0.00 H new ATOM 0 HE1 MET A 26 -1.213 -2.692 26.299 1.00 0.00 H new ATOM 0 HE2 MET A 26 0.191 -1.606 26.172 1.00 0.00 H new ATOM 0 HE3 MET A 26 -1.151 -1.200 27.268 1.00 0.00 H new ATOM 20 N LYS A 27 -0.968 3.651 21.685 1.00 0.00 N ATOM 21 CA LYS A 27 -1.324 4.719 20.784 1.00 0.00 C ATOM 22 C LYS A 27 -0.202 4.865 19.768 1.00 0.00 C ATOM 23 O LYS A 27 0.867 5.379 20.093 1.00 0.00 O ATOM 24 CB LYS A 27 -1.501 6.033 21.562 1.00 0.00 C ATOM 25 CG LYS A 27 -2.517 5.968 22.699 1.00 0.00 C ATOM 26 CD LYS A 27 -3.933 5.733 22.199 1.00 0.00 C ATOM 27 CE LYS A 27 -4.904 5.545 23.359 1.00 0.00 C ATOM 28 NZ LYS A 27 -4.922 6.698 24.284 1.00 0.00 N ATOM 0 H LYS A 27 -0.139 3.840 22.248 1.00 0.00 H new ATOM 0 HA LYS A 27 -2.265 4.492 20.283 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.536 6.330 21.972 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.805 6.814 20.865 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.240 5.168 23.385 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -2.484 6.899 23.265 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -4.251 6.578 21.589 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.953 4.852 21.558 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -5.908 5.386 22.965 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -4.633 4.646 23.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -5.702 6.586 24.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -4.019 6.745 24.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.057 7.575 23.742 1.00 0.00 H new ATOM 42 N PRO A 28 -0.381 4.344 18.560 1.00 0.00 N ATOM 43 CA PRO A 28 0.633 4.422 17.533 1.00 0.00 C ATOM 44 C PRO A 28 0.595 5.755 16.788 1.00 0.00 C ATOM 45 O PRO A 28 -0.454 6.404 16.692 1.00 0.00 O ATOM 46 CB PRO A 28 0.291 3.259 16.602 1.00 0.00 C ATOM 47 CG PRO A 28 -1.186 3.065 16.746 1.00 0.00 C ATOM 48 CD PRO A 28 -1.584 3.631 18.094 1.00 0.00 C ATOM 0 HA PRO A 28 1.641 4.361 17.943 1.00 0.00 H new ATOM 0 HB2 PRO A 28 0.560 3.488 15.571 1.00 0.00 H new ATOM 0 HB3 PRO A 28 0.836 2.357 16.881 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.721 3.572 15.943 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -1.443 2.008 16.682 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.437 4.305 18.006 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.872 2.841 18.788 1.00 0.00 H new ATOM 56 N LYS A 29 1.735 6.170 16.283 1.00 0.00 N ATOM 57 CA LYS A 29 1.836 7.419 15.549 1.00 0.00 C ATOM 58 C LYS A 29 1.867 7.141 14.045 1.00 0.00 C ATOM 59 O LYS A 29 1.847 8.052 13.220 1.00 0.00 O ATOM 60 CB LYS A 29 3.083 8.203 16.023 1.00 0.00 C ATOM 61 CG LYS A 29 3.286 9.596 15.399 1.00 0.00 C ATOM 62 CD LYS A 29 2.059 10.507 15.562 1.00 0.00 C ATOM 63 CE LYS A 29 1.657 10.710 17.019 1.00 0.00 C ATOM 64 NZ LYS A 29 2.728 11.325 17.828 1.00 0.00 N ATOM 0 H LYS A 29 2.614 5.659 16.366 1.00 0.00 H new ATOM 0 HA LYS A 29 0.961 8.038 15.747 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.025 8.317 17.105 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.967 7.601 15.813 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.151 10.073 15.860 1.00 0.00 H new ATOM 0 HG3 LYS A 29 3.512 9.484 14.338 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.271 11.476 15.111 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.219 10.078 15.016 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.769 11.340 17.062 1.00 0.00 H new ATOM 0 HE3 LYS A 29 1.387 9.748 17.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.389 11.471 18.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.557 10.697 17.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.994 12.241 17.413 1.00 0.00 H new ATOM 78 N THR A 30 1.894 5.887 13.702 1.00 0.00 N ATOM 79 CA THR A 30 1.901 5.481 12.332 1.00 0.00 C ATOM 80 C THR A 30 0.457 5.448 11.811 1.00 0.00 C ATOM 81 O THR A 30 -0.292 4.500 12.066 1.00 0.00 O ATOM 82 CB THR A 30 2.560 4.096 12.203 1.00 0.00 C ATOM 83 OG1 THR A 30 3.815 4.115 12.929 1.00 0.00 O ATOM 84 CG2 THR A 30 2.837 3.757 10.741 1.00 0.00 C ATOM 0 H THR A 30 1.912 5.116 14.369 1.00 0.00 H new ATOM 0 HA THR A 30 2.476 6.190 11.736 1.00 0.00 H new ATOM 0 HB THR A 30 1.885 3.343 12.610 1.00 0.00 H new ATOM 0 HG1 THR A 30 4.247 3.238 12.858 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.303 2.774 10.677 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.900 3.751 10.185 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.507 4.504 10.315 1.00 0.00 H new ATOM 92 N ALA A 31 0.060 6.506 11.138 1.00 0.00 N ATOM 93 CA ALA A 31 -1.283 6.632 10.631 1.00 0.00 C ATOM 94 C ALA A 31 -1.420 5.878 9.326 1.00 0.00 C ATOM 95 O ALA A 31 -1.005 6.347 8.272 1.00 0.00 O ATOM 96 CB ALA A 31 -1.661 8.098 10.461 1.00 0.00 C ATOM 0 H ALA A 31 0.662 7.302 10.928 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.972 6.195 11.353 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.679 8.169 10.077 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.600 8.603 11.425 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -0.975 8.572 9.759 1.00 0.00 H new ATOM 102 N SER A 32 -1.933 4.684 9.415 1.00 0.00 N ATOM 103 CA SER A 32 -2.122 3.851 8.261 1.00 0.00 C ATOM 104 C SER A 32 -3.610 3.708 7.946 1.00 0.00 C ATOM 105 O SER A 32 -4.454 3.851 8.851 1.00 0.00 O ATOM 106 CB SER A 32 -1.506 2.483 8.535 1.00 0.00 C ATOM 107 OG SER A 32 -0.147 2.617 8.938 1.00 0.00 O ATOM 0 H SER A 32 -2.233 4.259 10.292 1.00 0.00 H new ATOM 0 HA SER A 32 -1.635 4.306 7.398 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.073 1.972 9.313 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.566 1.865 7.639 1.00 0.00 H new ATOM 0 HG SER A 32 0.232 1.730 9.111 1.00 0.00 H new ATOM 113 N GLU A 33 -3.910 3.484 6.657 1.00 0.00 N ATOM 114 CA GLU A 33 -5.267 3.228 6.148 1.00 0.00 C ATOM 115 C GLU A 33 -6.267 4.302 6.512 1.00 0.00 C ATOM 116 O GLU A 33 -7.005 4.170 7.492 1.00 0.00 O ATOM 117 CB GLU A 33 -5.801 1.851 6.566 1.00 0.00 C ATOM 118 CG GLU A 33 -5.081 0.673 5.945 1.00 0.00 C ATOM 119 CD GLU A 33 -5.174 0.668 4.436 1.00 0.00 C ATOM 120 OE1 GLU A 33 -6.260 0.925 3.880 1.00 0.00 O ATOM 121 OE2 GLU A 33 -4.170 0.358 3.778 1.00 0.00 O ATOM 0 H GLU A 33 -3.201 3.476 5.924 1.00 0.00 H new ATOM 0 HA GLU A 33 -5.157 3.244 5.064 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -5.737 1.767 7.651 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -6.857 1.792 6.304 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.032 0.695 6.241 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.503 -0.253 6.335 1.00 0.00 H new ATOM 128 N HIS A 34 -6.279 5.364 5.768 1.00 0.00 N ATOM 129 CA HIS A 34 -7.246 6.403 6.001 1.00 0.00 C ATOM 130 C HIS A 34 -8.483 6.082 5.193 1.00 0.00 C ATOM 131 O HIS A 34 -8.573 6.405 4.002 1.00 0.00 O ATOM 132 CB HIS A 34 -6.691 7.786 5.636 1.00 0.00 C ATOM 133 CG HIS A 34 -5.443 8.155 6.384 1.00 0.00 C ATOM 134 ND1 HIS A 34 -4.182 7.820 5.964 1.00 0.00 N ATOM 135 CD2 HIS A 34 -5.280 8.848 7.533 1.00 0.00 C ATOM 136 CE1 HIS A 34 -3.304 8.300 6.841 1.00 0.00 C ATOM 137 NE2 HIS A 34 -3.918 8.941 7.822 1.00 0.00 N ATOM 0 H HIS A 34 -5.635 5.538 4.996 1.00 0.00 H new ATOM 0 HA HIS A 34 -7.491 6.441 7.062 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -6.484 7.813 4.566 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -7.456 8.537 5.832 1.00 0.00 H new ATOM 0 HD1 HIS A 34 -3.955 7.292 5.121 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -6.077 9.264 8.132 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -2.233 8.182 6.763 1.00 0.00 H new ATOM 145 N ARG A 35 -9.396 5.383 5.805 1.00 0.00 N ATOM 146 CA ARG A 35 -10.592 4.946 5.130 1.00 0.00 C ATOM 147 C ARG A 35 -11.822 5.611 5.685 1.00 0.00 C ATOM 148 O ARG A 35 -12.164 5.440 6.854 1.00 0.00 O ATOM 149 CB ARG A 35 -10.707 3.413 5.136 1.00 0.00 C ATOM 150 CG ARG A 35 -9.710 2.717 4.203 1.00 0.00 C ATOM 151 CD ARG A 35 -10.005 3.091 2.760 1.00 0.00 C ATOM 152 NE ARG A 35 -9.086 2.510 1.790 1.00 0.00 N ATOM 153 CZ ARG A 35 -9.383 2.351 0.490 1.00 0.00 C ATOM 154 NH1 ARG A 35 -10.610 2.632 0.044 1.00 0.00 N ATOM 155 NH2 ARG A 35 -8.458 1.913 -0.350 1.00 0.00 N ATOM 0 H ARG A 35 -9.336 5.099 6.783 1.00 0.00 H new ATOM 0 HA ARG A 35 -10.515 5.258 4.088 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -10.554 3.050 6.152 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.719 3.132 4.846 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -8.692 3.008 4.462 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -9.775 1.636 4.328 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -11.020 2.776 2.516 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -9.976 4.176 2.665 1.00 0.00 H new ATOM 0 HE ARG A 35 -8.168 2.208 2.116 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -11.323 2.968 0.691 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.834 2.511 -0.944 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -7.521 1.697 -0.009 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -8.682 1.792 -1.338 1.00 0.00 H new ATOM 169 N LYS A 36 -12.469 6.363 4.838 1.00 0.00 N ATOM 170 CA LYS A 36 -13.658 7.105 5.163 1.00 0.00 C ATOM 171 C LYS A 36 -14.847 6.385 4.550 1.00 0.00 C ATOM 172 O LYS A 36 -14.709 5.718 3.524 1.00 0.00 O ATOM 173 CB LYS A 36 -13.504 8.540 4.582 1.00 0.00 C ATOM 174 CG LYS A 36 -14.691 9.508 4.737 1.00 0.00 C ATOM 175 CD LYS A 36 -15.091 9.855 6.188 1.00 0.00 C ATOM 176 CE LYS A 36 -13.967 10.461 7.051 1.00 0.00 C ATOM 177 NZ LYS A 36 -13.018 9.444 7.562 1.00 0.00 N ATOM 0 H LYS A 36 -12.174 6.481 3.869 1.00 0.00 H new ATOM 0 HA LYS A 36 -13.811 7.177 6.240 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.634 8.999 5.051 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.283 8.449 3.519 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -14.450 10.434 4.215 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.556 9.075 4.235 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -15.925 10.557 6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -15.453 8.949 6.675 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.420 11.197 6.461 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -14.410 10.993 7.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.542 9.809 8.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.536 8.575 7.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.308 9.233 6.831 1.00 0.00 H new ATOM 191 N SER A 37 -15.959 6.451 5.202 1.00 0.00 N ATOM 192 CA SER A 37 -17.178 5.888 4.699 1.00 0.00 C ATOM 193 C SER A 37 -18.244 6.975 4.836 1.00 0.00 C ATOM 194 O SER A 37 -17.898 8.149 5.042 1.00 0.00 O ATOM 195 CB SER A 37 -17.529 4.613 5.499 1.00 0.00 C ATOM 196 OG SER A 37 -18.649 3.917 4.953 1.00 0.00 O ATOM 0 H SER A 37 -16.054 6.902 6.112 1.00 0.00 H new ATOM 0 HA SER A 37 -17.097 5.584 3.655 1.00 0.00 H new ATOM 0 HB2 SER A 37 -16.665 3.949 5.515 1.00 0.00 H new ATOM 0 HB3 SER A 37 -17.742 4.884 6.533 1.00 0.00 H new ATOM 0 HG SER A 37 -18.832 3.118 5.491 1.00 0.00 H new ATOM 202 N SER A 38 -19.494 6.640 4.695 1.00 0.00 N ATOM 203 CA SER A 38 -20.532 7.622 4.846 1.00 0.00 C ATOM 204 C SER A 38 -20.907 7.694 6.325 1.00 0.00 C ATOM 205 O SER A 38 -21.302 8.746 6.858 1.00 0.00 O ATOM 206 CB SER A 38 -21.741 7.268 3.957 1.00 0.00 C ATOM 207 OG SER A 38 -22.677 8.338 3.886 1.00 0.00 O ATOM 0 H SER A 38 -19.820 5.698 4.477 1.00 0.00 H new ATOM 0 HA SER A 38 -20.184 8.603 4.521 1.00 0.00 H new ATOM 0 HB2 SER A 38 -21.394 7.021 2.953 1.00 0.00 H new ATOM 0 HB3 SER A 38 -22.234 6.379 4.351 1.00 0.00 H new ATOM 0 HG SER A 38 -23.428 8.078 3.313 1.00 0.00 H new ATOM 213 N LYS A 39 -20.762 6.579 6.970 1.00 0.00 N ATOM 214 CA LYS A 39 -21.018 6.445 8.376 1.00 0.00 C ATOM 215 C LYS A 39 -19.713 6.346 9.143 1.00 0.00 C ATOM 216 O LYS A 39 -18.832 5.561 8.762 1.00 0.00 O ATOM 217 CB LYS A 39 -21.844 5.201 8.663 1.00 0.00 C ATOM 218 CG LYS A 39 -23.293 5.196 8.194 1.00 0.00 C ATOM 219 CD LYS A 39 -24.252 5.866 9.180 1.00 0.00 C ATOM 220 CE LYS A 39 -24.190 7.387 9.183 1.00 0.00 C ATOM 221 NZ LYS A 39 -25.175 7.970 10.112 1.00 0.00 N ATOM 0 H LYS A 39 -20.455 5.714 6.526 1.00 0.00 H new ATOM 0 HA LYS A 39 -21.572 7.328 8.695 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -21.340 4.349 8.206 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -21.838 5.035 9.740 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -23.358 5.705 7.232 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -23.611 4.166 8.032 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -25.270 5.557 8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -24.033 5.504 10.184 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -23.188 7.710 9.465 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -24.374 7.761 8.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -25.104 9.007 10.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -26.133 7.682 9.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -24.984 7.633 11.077 1.00 0.00 H new ATOM 235 N PRO A 40 -19.594 7.083 10.256 1.00 0.00 N ATOM 236 CA PRO A 40 -18.406 7.030 11.120 1.00 0.00 C ATOM 237 C PRO A 40 -18.257 5.638 11.735 1.00 0.00 C ATOM 238 O PRO A 40 -17.164 5.113 11.871 1.00 0.00 O ATOM 239 CB PRO A 40 -18.696 8.067 12.219 1.00 0.00 C ATOM 240 CG PRO A 40 -20.174 8.293 12.171 1.00 0.00 C ATOM 241 CD PRO A 40 -20.598 8.033 10.754 1.00 0.00 C ATOM 0 HA PRO A 40 -17.483 7.236 10.577 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -18.386 7.700 13.197 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -18.151 8.993 12.039 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -20.691 7.625 12.860 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -20.421 9.312 12.469 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -21.603 7.614 10.708 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -20.608 8.950 10.165 1.00 0.00 H new ATOM 249 N ILE A 41 -19.390 5.042 12.071 1.00 0.00 N ATOM 250 CA ILE A 41 -19.427 3.712 12.637 1.00 0.00 C ATOM 251 C ILE A 41 -18.937 2.680 11.620 1.00 0.00 C ATOM 252 O ILE A 41 -18.095 1.853 11.939 1.00 0.00 O ATOM 253 CB ILE A 41 -20.858 3.343 13.176 1.00 0.00 C ATOM 254 CG1 ILE A 41 -20.919 1.878 13.638 1.00 0.00 C ATOM 255 CG2 ILE A 41 -21.943 3.630 12.139 1.00 0.00 C ATOM 256 CD1 ILE A 41 -22.263 1.443 14.195 1.00 0.00 C ATOM 0 H ILE A 41 -20.308 5.471 11.957 1.00 0.00 H new ATOM 0 HA ILE A 41 -18.751 3.699 13.492 1.00 0.00 H new ATOM 0 HB ILE A 41 -21.050 3.979 14.040 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -20.665 1.235 12.795 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -20.157 1.720 14.401 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -22.917 3.362 12.548 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -21.934 4.690 11.887 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -21.753 3.042 11.241 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -22.211 0.396 14.495 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -22.514 2.056 15.060 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -23.030 1.564 13.430 1.00 0.00 H new ATOM 268 N MET A 42 -19.402 2.796 10.387 1.00 0.00 N ATOM 269 CA MET A 42 -19.054 1.844 9.336 1.00 0.00 C ATOM 270 C MET A 42 -17.589 1.854 9.027 1.00 0.00 C ATOM 271 O MET A 42 -16.965 0.806 8.920 1.00 0.00 O ATOM 272 CB MET A 42 -19.855 2.100 8.077 1.00 0.00 C ATOM 273 CG MET A 42 -21.304 1.759 8.247 1.00 0.00 C ATOM 274 SD MET A 42 -21.539 0.001 8.540 1.00 0.00 S ATOM 275 CE MET A 42 -23.296 -0.040 8.816 1.00 0.00 C ATOM 0 H MET A 42 -20.026 3.544 10.084 1.00 0.00 H new ATOM 0 HA MET A 42 -19.306 0.854 9.716 1.00 0.00 H new ATOM 0 HB2 MET A 42 -19.761 3.149 7.796 1.00 0.00 H new ATOM 0 HB3 MET A 42 -19.439 1.512 7.258 1.00 0.00 H new ATOM 0 HG2 MET A 42 -21.717 2.326 9.082 1.00 0.00 H new ATOM 0 HG3 MET A 42 -21.856 2.057 7.355 1.00 0.00 H new ATOM 0 HE1 MET A 42 -23.609 -1.065 9.014 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.545 0.587 9.672 1.00 0.00 H new ATOM 0 HE3 MET A 42 -23.812 0.333 7.931 1.00 0.00 H new ATOM 285 N GLU A 43 -17.025 3.033 8.930 1.00 0.00 N ATOM 286 CA GLU A 43 -15.611 3.146 8.628 1.00 0.00 C ATOM 287 C GLU A 43 -14.770 2.729 9.821 1.00 0.00 C ATOM 288 O GLU A 43 -13.641 2.286 9.657 1.00 0.00 O ATOM 289 CB GLU A 43 -15.234 4.552 8.179 1.00 0.00 C ATOM 290 CG GLU A 43 -15.431 5.622 9.224 1.00 0.00 C ATOM 291 CD GLU A 43 -15.060 6.966 8.715 1.00 0.00 C ATOM 292 OE1 GLU A 43 -15.749 7.469 7.848 1.00 0.00 O ATOM 293 OE2 GLU A 43 -14.047 7.545 9.161 1.00 0.00 O ATOM 0 H GLU A 43 -17.512 3.921 9.053 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.405 2.469 7.798 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.188 4.552 7.871 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.825 4.809 7.300 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -16.473 5.630 9.544 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.829 5.387 10.102 1.00 0.00 H new ATOM 300 N LYS A 44 -15.341 2.828 11.014 1.00 0.00 N ATOM 301 CA LYS A 44 -14.630 2.497 12.217 1.00 0.00 C ATOM 302 C LYS A 44 -14.522 0.998 12.345 1.00 0.00 C ATOM 303 O LYS A 44 -13.443 0.464 12.594 1.00 0.00 O ATOM 304 CB LYS A 44 -15.318 3.102 13.430 1.00 0.00 C ATOM 305 CG LYS A 44 -14.548 2.917 14.717 1.00 0.00 C ATOM 306 CD LYS A 44 -15.132 3.741 15.837 1.00 0.00 C ATOM 307 CE LYS A 44 -16.475 3.219 16.319 1.00 0.00 C ATOM 308 NZ LYS A 44 -16.356 1.904 16.983 1.00 0.00 N ATOM 0 H LYS A 44 -16.301 3.138 11.163 1.00 0.00 H new ATOM 0 HA LYS A 44 -13.625 2.916 12.165 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -15.470 4.167 13.257 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.305 2.653 13.539 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.555 1.864 14.998 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.506 3.199 14.562 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.433 3.756 16.673 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.248 4.771 15.501 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.914 3.936 17.013 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -17.156 3.136 15.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.246 1.680 17.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.158 1.172 16.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.580 1.933 17.675 1.00 0.00 H new ATOM 322 N ARG A 45 -15.644 0.323 12.116 1.00 0.00 N ATOM 323 CA ARG A 45 -15.710 -1.135 12.169 1.00 0.00 C ATOM 324 C ARG A 45 -14.841 -1.708 11.071 1.00 0.00 C ATOM 325 O ARG A 45 -14.108 -2.683 11.277 1.00 0.00 O ATOM 326 CB ARG A 45 -17.146 -1.601 11.982 1.00 0.00 C ATOM 327 CG ARG A 45 -18.111 -1.001 12.978 1.00 0.00 C ATOM 328 CD ARG A 45 -19.534 -1.392 12.668 1.00 0.00 C ATOM 329 NE ARG A 45 -19.851 -2.783 13.051 1.00 0.00 N ATOM 330 CZ ARG A 45 -20.402 -3.708 12.253 1.00 0.00 C ATOM 331 NH1 ARG A 45 -20.445 -3.525 10.934 1.00 0.00 N ATOM 332 NH2 ARG A 45 -20.850 -4.852 12.777 1.00 0.00 N ATOM 0 H ARG A 45 -16.532 0.770 11.889 1.00 0.00 H new ATOM 0 HA ARG A 45 -15.354 -1.479 13.140 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -17.473 -1.347 10.974 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -17.180 -2.687 12.064 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -17.852 -1.332 13.983 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -18.020 0.085 12.967 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -20.212 -0.715 13.188 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -19.715 -1.266 11.601 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.631 -3.064 14.007 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -20.057 -2.676 10.524 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -20.866 -4.234 10.334 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.772 -5.018 13.780 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -21.270 -5.559 12.174 1.00 0.00 H new ATOM 346 N ARG A 46 -14.916 -1.070 9.900 1.00 0.00 N ATOM 347 CA ARG A 46 -14.103 -1.428 8.762 1.00 0.00 C ATOM 348 C ARG A 46 -12.629 -1.318 9.114 1.00 0.00 C ATOM 349 O ARG A 46 -11.904 -2.285 9.017 1.00 0.00 O ATOM 350 CB ARG A 46 -14.399 -0.510 7.567 1.00 0.00 C ATOM 351 CG ARG A 46 -13.510 -0.782 6.359 1.00 0.00 C ATOM 352 CD ARG A 46 -13.619 0.318 5.311 1.00 0.00 C ATOM 353 NE ARG A 46 -14.878 0.290 4.559 1.00 0.00 N ATOM 354 CZ ARG A 46 -15.288 1.219 3.676 1.00 0.00 C ATOM 355 NH1 ARG A 46 -14.644 2.383 3.550 1.00 0.00 N ATOM 356 NH2 ARG A 46 -16.350 0.970 2.930 1.00 0.00 N ATOM 0 H ARG A 46 -15.549 -0.289 9.726 1.00 0.00 H new ATOM 0 HA ARG A 46 -14.343 -2.456 8.491 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -15.442 -0.631 7.275 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -14.272 0.528 7.876 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.474 -0.871 6.684 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -13.787 -1.737 5.912 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.520 1.286 5.801 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -12.787 0.227 4.613 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.498 -0.504 4.720 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -13.827 2.579 4.129 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -14.969 3.075 2.875 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.846 0.084 3.028 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -16.674 1.664 2.256 1.00 0.00 H new ATOM 370 N ARG A 47 -12.214 -0.136 9.552 1.00 0.00 N ATOM 371 CA ARG A 47 -10.820 0.162 9.837 1.00 0.00 C ATOM 372 C ARG A 47 -10.263 -0.734 10.924 1.00 0.00 C ATOM 373 O ARG A 47 -9.149 -1.249 10.786 1.00 0.00 O ATOM 374 CB ARG A 47 -10.648 1.635 10.189 1.00 0.00 C ATOM 375 CG ARG A 47 -9.219 2.120 10.122 1.00 0.00 C ATOM 376 CD ARG A 47 -9.137 3.600 10.411 1.00 0.00 C ATOM 377 NE ARG A 47 -7.800 4.121 10.159 1.00 0.00 N ATOM 378 CZ ARG A 47 -7.271 5.187 10.731 1.00 0.00 C ATOM 379 NH1 ARG A 47 -7.988 5.911 11.580 1.00 0.00 N ATOM 380 NH2 ARG A 47 -6.031 5.546 10.429 1.00 0.00 N ATOM 0 H ARG A 47 -12.843 0.649 9.720 1.00 0.00 H new ATOM 0 HA ARG A 47 -10.246 -0.042 8.933 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.256 2.233 9.511 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.032 1.805 11.195 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.611 1.571 10.841 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.807 1.915 9.134 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.859 4.133 9.792 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -9.410 3.784 11.450 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.224 3.620 9.483 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.950 5.645 11.792 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.578 6.734 12.021 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -5.491 5.000 9.758 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.617 6.369 10.868 1.00 0.00 H new ATOM 394 N ALA A 48 -11.048 -0.950 11.972 1.00 0.00 N ATOM 395 CA ALA A 48 -10.664 -1.826 13.051 1.00 0.00 C ATOM 396 C ALA A 48 -10.413 -3.213 12.510 1.00 0.00 C ATOM 397 O ALA A 48 -9.344 -3.767 12.714 1.00 0.00 O ATOM 398 CB ALA A 48 -11.731 -1.858 14.136 1.00 0.00 C ATOM 0 H ALA A 48 -11.965 -0.520 12.090 1.00 0.00 H new ATOM 0 HA ALA A 48 -9.747 -1.446 13.502 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -11.415 -2.526 14.937 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.873 -0.854 14.536 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.669 -2.217 13.713 1.00 0.00 H new ATOM 404 N ARG A 49 -11.361 -3.735 11.734 1.00 0.00 N ATOM 405 CA ARG A 49 -11.205 -5.063 11.179 1.00 0.00 C ATOM 406 C ARG A 49 -10.091 -5.142 10.157 1.00 0.00 C ATOM 407 O ARG A 49 -9.516 -6.197 9.988 1.00 0.00 O ATOM 408 CB ARG A 49 -12.480 -5.655 10.606 1.00 0.00 C ATOM 409 CG ARG A 49 -13.503 -6.109 11.616 1.00 0.00 C ATOM 410 CD ARG A 49 -14.576 -6.915 10.908 1.00 0.00 C ATOM 411 NE ARG A 49 -15.571 -7.455 11.827 1.00 0.00 N ATOM 412 CZ ARG A 49 -16.189 -8.635 11.686 1.00 0.00 C ATOM 413 NH1 ARG A 49 -15.799 -9.502 10.745 1.00 0.00 N ATOM 414 NH2 ARG A 49 -17.157 -8.971 12.528 1.00 0.00 N ATOM 0 H ARG A 49 -12.229 -3.262 11.483 1.00 0.00 H new ATOM 0 HA ARG A 49 -10.933 -5.674 12.040 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -12.943 -4.913 9.956 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -12.214 -6.506 9.979 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -13.027 -6.713 12.388 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -13.947 -5.247 12.114 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -15.072 -6.284 10.171 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -14.109 -7.735 10.362 1.00 0.00 H new ATOM 0 HE ARG A 49 -15.815 -6.890 12.640 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -15.023 -9.268 10.125 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -16.277 -10.398 10.647 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -17.426 -8.333 13.277 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -17.632 -9.868 12.427 1.00 0.00 H new ATOM 428 N ILE A 50 -9.804 -4.049 9.457 1.00 0.00 N ATOM 429 CA ILE A 50 -8.679 -4.015 8.537 1.00 0.00 C ATOM 430 C ILE A 50 -7.397 -4.297 9.308 1.00 0.00 C ATOM 431 O ILE A 50 -6.649 -5.227 8.997 1.00 0.00 O ATOM 432 CB ILE A 50 -8.556 -2.634 7.834 1.00 0.00 C ATOM 433 CG1 ILE A 50 -9.753 -2.405 6.916 1.00 0.00 C ATOM 434 CG2 ILE A 50 -7.250 -2.539 7.046 1.00 0.00 C ATOM 435 CD1 ILE A 50 -9.839 -1.016 6.343 1.00 0.00 C ATOM 0 H ILE A 50 -10.334 -3.179 9.511 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.843 -4.773 7.771 1.00 0.00 H new ATOM 0 HB ILE A 50 -8.546 -1.857 8.598 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -9.709 -3.121 6.096 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -10.667 -2.613 7.472 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -7.187 -1.564 6.563 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.406 -2.664 7.724 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -7.225 -3.322 6.288 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -10.718 -0.940 5.703 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -9.917 -0.292 7.154 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.944 -0.808 5.756 1.00 0.00 H new ATOM 447 N ASN A 51 -7.196 -3.536 10.350 1.00 0.00 N ATOM 448 CA ASN A 51 -6.000 -3.641 11.169 1.00 0.00 C ATOM 449 C ASN A 51 -5.962 -4.980 11.863 1.00 0.00 C ATOM 450 O ASN A 51 -4.948 -5.687 11.826 1.00 0.00 O ATOM 451 CB ASN A 51 -5.953 -2.511 12.204 1.00 0.00 C ATOM 452 CG ASN A 51 -5.998 -1.134 11.571 1.00 0.00 C ATOM 453 OD1 ASN A 51 -5.480 -0.915 10.479 1.00 0.00 O ATOM 454 ND2 ASN A 51 -6.646 -0.213 12.216 1.00 0.00 N ATOM 0 H ASN A 51 -7.853 -2.822 10.663 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.129 -3.552 10.520 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -6.793 -2.618 12.891 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -5.043 -2.604 12.796 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.735 0.722 11.818 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -7.066 -0.424 13.121 1.00 0.00 H new ATOM 461 N GLU A 52 -7.076 -5.353 12.457 1.00 0.00 N ATOM 462 CA GLU A 52 -7.181 -6.609 13.180 1.00 0.00 C ATOM 463 C GLU A 52 -7.002 -7.841 12.267 1.00 0.00 C ATOM 464 O GLU A 52 -6.381 -8.823 12.671 1.00 0.00 O ATOM 465 CB GLU A 52 -8.474 -6.698 14.007 1.00 0.00 C ATOM 466 CG GLU A 52 -8.607 -5.595 15.064 1.00 0.00 C ATOM 467 CD GLU A 52 -9.705 -5.866 16.067 1.00 0.00 C ATOM 468 OE1 GLU A 52 -9.478 -6.683 16.991 1.00 0.00 O ATOM 469 OE2 GLU A 52 -10.787 -5.275 15.976 1.00 0.00 O ATOM 0 H GLU A 52 -7.932 -4.799 12.454 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.348 -6.620 13.883 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.330 -6.649 13.334 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -8.513 -7.669 14.501 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.659 -5.489 15.591 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.803 -4.645 14.567 1.00 0.00 H new ATOM 476 N SER A 53 -7.504 -7.787 11.044 1.00 0.00 N ATOM 477 CA SER A 53 -7.361 -8.910 10.148 1.00 0.00 C ATOM 478 C SER A 53 -5.952 -8.980 9.551 1.00 0.00 C ATOM 479 O SER A 53 -5.406 -10.053 9.410 1.00 0.00 O ATOM 480 CB SER A 53 -8.438 -8.908 9.066 1.00 0.00 C ATOM 481 OG SER A 53 -9.735 -8.899 9.658 1.00 0.00 O ATOM 0 H SER A 53 -8.006 -6.988 10.658 1.00 0.00 H new ATOM 0 HA SER A 53 -7.503 -9.815 10.738 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.317 -8.035 8.425 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.327 -9.787 8.431 1.00 0.00 H new ATOM 0 HG SER A 53 -9.972 -7.983 9.913 1.00 0.00 H new ATOM 487 N LEU A 54 -5.342 -7.820 9.269 1.00 0.00 N ATOM 488 CA LEU A 54 -4.017 -7.783 8.655 1.00 0.00 C ATOM 489 C LEU A 54 -2.978 -8.240 9.685 1.00 0.00 C ATOM 490 O LEU A 54 -1.979 -8.889 9.360 1.00 0.00 O ATOM 491 CB LEU A 54 -3.717 -6.344 8.182 1.00 0.00 C ATOM 492 CG LEU A 54 -2.859 -6.175 6.908 1.00 0.00 C ATOM 493 CD1 LEU A 54 -2.784 -4.710 6.516 1.00 0.00 C ATOM 494 CD2 LEU A 54 -1.453 -6.739 7.067 1.00 0.00 C ATOM 0 H LEU A 54 -5.746 -6.903 9.457 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.979 -8.450 7.794 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.669 -5.840 8.016 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.217 -5.820 8.996 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.350 -6.746 6.119 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.177 -4.605 5.617 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.788 -4.333 6.322 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.333 -4.139 7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.896 -6.593 6.142 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.945 -6.224 7.882 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.511 -7.804 7.291 1.00 0.00 H new ATOM 506 N SER A 55 -3.241 -7.929 10.927 1.00 0.00 N ATOM 507 CA SER A 55 -2.351 -8.277 11.986 1.00 0.00 C ATOM 508 C SER A 55 -2.379 -9.782 12.296 1.00 0.00 C ATOM 509 O SER A 55 -1.327 -10.401 12.447 1.00 0.00 O ATOM 510 CB SER A 55 -2.614 -7.404 13.199 1.00 0.00 C ATOM 511 OG SER A 55 -3.977 -7.443 13.589 1.00 0.00 O ATOM 0 H SER A 55 -4.078 -7.428 11.225 1.00 0.00 H new ATOM 0 HA SER A 55 -1.330 -8.077 11.662 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.989 -7.735 14.028 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.329 -6.376 12.976 1.00 0.00 H new ATOM 0 HG SER A 55 -4.502 -6.857 13.004 1.00 0.00 H new ATOM 517 N GLN A 56 -3.564 -10.385 12.349 1.00 0.00 N ATOM 518 CA GLN A 56 -3.644 -11.831 12.566 1.00 0.00 C ATOM 519 C GLN A 56 -3.103 -12.563 11.337 1.00 0.00 C ATOM 520 O GLN A 56 -2.493 -13.621 11.454 1.00 0.00 O ATOM 521 CB GLN A 56 -5.075 -12.284 12.904 1.00 0.00 C ATOM 522 CG GLN A 56 -6.092 -11.993 11.823 1.00 0.00 C ATOM 523 CD GLN A 56 -7.489 -12.387 12.211 1.00 0.00 C ATOM 524 OE1 GLN A 56 -7.931 -13.507 11.962 1.00 0.00 O ATOM 525 NE2 GLN A 56 -8.192 -11.482 12.824 1.00 0.00 N ATOM 0 H GLN A 56 -4.462 -9.912 12.248 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.029 -12.084 13.429 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.067 -13.356 13.100 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -5.391 -11.794 13.825 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -6.072 -10.928 11.590 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -5.810 -12.524 10.914 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.789 -10.564 13.012 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -9.147 -11.690 13.117 1.00 0.00 H new ATOM 534 N LEU A 57 -3.293 -11.939 10.179 1.00 0.00 N ATOM 535 CA LEU A 57 -2.811 -12.429 8.898 1.00 0.00 C ATOM 536 C LEU A 57 -1.299 -12.637 8.939 1.00 0.00 C ATOM 537 O LEU A 57 -0.826 -13.766 8.791 1.00 0.00 O ATOM 538 CB LEU A 57 -3.257 -11.423 7.798 1.00 0.00 C ATOM 539 CG LEU A 57 -2.789 -11.612 6.356 1.00 0.00 C ATOM 540 CD1 LEU A 57 -3.833 -11.040 5.403 1.00 0.00 C ATOM 541 CD2 LEU A 57 -1.503 -10.855 6.138 1.00 0.00 C ATOM 0 H LEU A 57 -3.799 -11.057 10.107 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.239 -13.404 8.667 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.347 -11.417 7.787 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.936 -10.431 8.116 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.642 -12.676 6.171 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.499 -11.175 4.374 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.781 -11.559 5.548 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.966 -9.977 5.605 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.171 -10.991 5.109 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.668 -9.795 6.329 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.739 -11.231 6.819 1.00 0.00 H new ATOM 553 N LYS A 58 -0.555 -11.567 9.230 1.00 0.00 N ATOM 554 CA LYS A 58 0.913 -11.643 9.301 1.00 0.00 C ATOM 555 C LYS A 58 1.354 -12.634 10.387 1.00 0.00 C ATOM 556 O LYS A 58 2.358 -13.330 10.237 1.00 0.00 O ATOM 557 CB LYS A 58 1.555 -10.255 9.572 1.00 0.00 C ATOM 558 CG LYS A 58 1.218 -9.671 10.935 1.00 0.00 C ATOM 559 CD LYS A 58 1.961 -8.385 11.235 1.00 0.00 C ATOM 560 CE LYS A 58 1.664 -7.929 12.660 1.00 0.00 C ATOM 561 NZ LYS A 58 2.423 -6.724 13.041 1.00 0.00 N ATOM 0 H LYS A 58 -0.939 -10.641 9.420 1.00 0.00 H new ATOM 0 HA LYS A 58 1.259 -11.993 8.328 1.00 0.00 H new ATOM 0 HB2 LYS A 58 2.638 -10.344 9.484 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.229 -9.559 8.799 1.00 0.00 H new ATOM 0 HG2 LYS A 58 0.145 -9.484 10.988 1.00 0.00 H new ATOM 0 HG3 LYS A 58 1.451 -10.406 11.705 1.00 0.00 H new ATOM 0 HD2 LYS A 58 3.033 -8.537 11.109 1.00 0.00 H new ATOM 0 HD3 LYS A 58 1.664 -7.611 10.528 1.00 0.00 H new ATOM 0 HE2 LYS A 58 0.597 -7.728 12.758 1.00 0.00 H new ATOM 0 HE3 LYS A 58 1.901 -8.737 13.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 2.184 -6.457 14.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 3.442 -6.920 12.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 2.179 -5.943 12.399 1.00 0.00 H new ATOM 575 N THR A 59 0.556 -12.723 11.448 1.00 0.00 N ATOM 576 CA THR A 59 0.858 -13.567 12.564 1.00 0.00 C ATOM 577 C THR A 59 0.805 -15.033 12.160 1.00 0.00 C ATOM 578 O THR A 59 1.776 -15.763 12.334 1.00 0.00 O ATOM 579 CB THR A 59 -0.128 -13.303 13.726 1.00 0.00 C ATOM 580 OG1 THR A 59 -0.017 -11.929 14.149 1.00 0.00 O ATOM 581 CG2 THR A 59 0.156 -14.214 14.910 1.00 0.00 C ATOM 0 H THR A 59 -0.317 -12.204 11.543 1.00 0.00 H new ATOM 0 HA THR A 59 1.868 -13.335 12.900 1.00 0.00 H new ATOM 0 HB THR A 59 -1.137 -13.508 13.367 1.00 0.00 H new ATOM 0 HG1 THR A 59 -0.692 -11.389 13.688 1.00 0.00 H new ATOM 0 HG21 THR A 59 -0.554 -14.003 15.710 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.056 -15.254 14.601 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.170 -14.038 15.269 1.00 0.00 H new ATOM 589 N LEU A 60 -0.303 -15.433 11.572 1.00 0.00 N ATOM 590 CA LEU A 60 -0.525 -16.814 11.211 1.00 0.00 C ATOM 591 C LEU A 60 0.418 -17.256 10.119 1.00 0.00 C ATOM 592 O LEU A 60 0.953 -18.365 10.172 1.00 0.00 O ATOM 593 CB LEU A 60 -1.974 -17.030 10.812 1.00 0.00 C ATOM 594 CG LEU A 60 -3.000 -16.679 11.888 1.00 0.00 C ATOM 595 CD1 LEU A 60 -4.392 -16.933 11.394 1.00 0.00 C ATOM 596 CD2 LEU A 60 -2.737 -17.444 13.171 1.00 0.00 C ATOM 0 H LEU A 60 -1.073 -14.809 11.332 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.317 -17.432 12.085 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.183 -16.434 9.924 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.106 -18.075 10.533 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.901 -15.616 12.109 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.108 -16.677 12.175 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.583 -16.321 10.512 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.500 -17.986 11.135 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.484 -17.172 13.917 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.794 -18.515 12.974 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.744 -17.196 13.545 1.00 0.00 H new ATOM 608 N ILE A 61 0.652 -16.378 9.158 1.00 0.00 N ATOM 609 CA ILE A 61 1.576 -16.656 8.077 1.00 0.00 C ATOM 610 C ILE A 61 2.969 -16.919 8.620 1.00 0.00 C ATOM 611 O ILE A 61 3.558 -17.979 8.386 1.00 0.00 O ATOM 612 CB ILE A 61 1.627 -15.490 7.050 1.00 0.00 C ATOM 613 CG1 ILE A 61 0.283 -15.354 6.336 1.00 0.00 C ATOM 614 CG2 ILE A 61 2.764 -15.674 6.042 1.00 0.00 C ATOM 615 CD1 ILE A 61 -0.149 -16.600 5.600 1.00 0.00 C ATOM 0 H ILE A 61 0.210 -15.460 9.107 1.00 0.00 H new ATOM 0 HA ILE A 61 1.214 -17.547 7.564 1.00 0.00 H new ATOM 0 HB ILE A 61 1.827 -14.569 7.598 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.481 -15.093 7.068 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.341 -14.528 5.628 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.767 -14.839 5.341 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.717 -15.708 6.570 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.619 -16.606 5.496 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.111 -16.424 5.120 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.594 -16.851 4.843 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.241 -17.426 6.306 1.00 0.00 H new ATOM 627 N LEU A 62 3.467 -15.993 9.403 1.00 0.00 N ATOM 628 CA LEU A 62 4.797 -16.097 9.916 1.00 0.00 C ATOM 629 C LEU A 62 4.936 -17.232 10.910 1.00 0.00 C ATOM 630 O LEU A 62 5.991 -17.792 11.055 1.00 0.00 O ATOM 631 CB LEU A 62 5.198 -14.827 10.566 1.00 0.00 C ATOM 632 CG LEU A 62 6.683 -14.713 10.842 1.00 0.00 C ATOM 633 CD1 LEU A 62 7.495 -14.835 9.554 1.00 0.00 C ATOM 634 CD2 LEU A 62 6.937 -13.416 11.445 1.00 0.00 C ATOM 0 H LEU A 62 2.962 -15.157 9.696 1.00 0.00 H new ATOM 0 HA LEU A 62 5.451 -16.305 9.069 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.893 -13.995 9.932 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.656 -14.726 11.506 1.00 0.00 H new ATOM 0 HG LEU A 62 6.983 -15.520 11.510 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.557 -14.749 9.784 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.301 -15.803 9.092 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.207 -14.040 8.866 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.002 -13.313 11.652 1.00 0.00 H new ATOM 0 HD22 LEU A 62 6.623 -12.628 10.760 1.00 0.00 H new ATOM 0 HD23 LEU A 62 6.377 -13.332 12.376 1.00 0.00 H new ATOM 646 N ASP A 63 3.858 -17.585 11.549 1.00 0.00 N ATOM 647 CA ASP A 63 3.878 -18.631 12.577 1.00 0.00 C ATOM 648 C ASP A 63 3.824 -20.018 11.949 1.00 0.00 C ATOM 649 O ASP A 63 4.245 -20.998 12.547 1.00 0.00 O ATOM 650 CB ASP A 63 2.692 -18.477 13.487 1.00 0.00 C ATOM 651 CG ASP A 63 2.902 -19.077 14.859 1.00 0.00 C ATOM 652 OD1 ASP A 63 3.472 -18.380 15.732 1.00 0.00 O ATOM 653 OD2 ASP A 63 2.473 -20.221 15.105 1.00 0.00 O ATOM 0 H ASP A 63 2.940 -17.171 11.388 1.00 0.00 H new ATOM 0 HA ASP A 63 4.806 -18.526 13.139 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.462 -17.417 13.594 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.825 -18.946 13.023 1.00 0.00 H new ATOM 658 N ALA A 64 3.264 -20.108 10.760 1.00 0.00 N ATOM 659 CA ALA A 64 3.164 -21.368 10.065 1.00 0.00 C ATOM 660 C ALA A 64 4.443 -21.642 9.329 1.00 0.00 C ATOM 661 O ALA A 64 4.901 -22.782 9.223 1.00 0.00 O ATOM 662 CB ALA A 64 1.990 -21.346 9.100 1.00 0.00 C ATOM 0 H ALA A 64 2.869 -19.315 10.254 1.00 0.00 H new ATOM 0 HA ALA A 64 2.996 -22.164 10.791 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.927 -22.303 8.582 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.067 -21.171 9.653 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.133 -20.548 8.371 1.00 0.00 H new ATOM 668 N LEU A 65 5.041 -20.576 8.843 1.00 0.00 N ATOM 669 CA LEU A 65 6.221 -20.697 8.020 1.00 0.00 C ATOM 670 C LEU A 65 7.461 -20.593 8.853 1.00 0.00 C ATOM 671 O LEU A 65 8.429 -21.312 8.619 1.00 0.00 O ATOM 672 CB LEU A 65 6.222 -19.612 6.935 1.00 0.00 C ATOM 673 CG LEU A 65 4.918 -19.472 6.149 1.00 0.00 C ATOM 674 CD1 LEU A 65 5.064 -18.559 4.955 1.00 0.00 C ATOM 675 CD2 LEU A 65 4.369 -20.816 5.766 1.00 0.00 C ATOM 0 H LEU A 65 4.729 -19.618 9.004 1.00 0.00 H new ATOM 0 HA LEU A 65 6.208 -21.677 7.543 1.00 0.00 H new ATOM 0 HB2 LEU A 65 6.450 -18.654 7.403 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.029 -19.824 6.233 1.00 0.00 H new ATOM 0 HG LEU A 65 4.193 -18.997 6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.111 -18.492 4.430 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.364 -17.566 5.291 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.822 -18.959 4.282 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.442 -20.685 5.208 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.094 -21.342 5.145 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.172 -21.398 6.666 1.00 0.00 H new ATOM 687 N LYS A 66 7.405 -19.705 9.845 1.00 0.00 N ATOM 688 CA LYS A 66 8.504 -19.434 10.765 1.00 0.00 C ATOM 689 C LYS A 66 9.773 -19.154 10.022 1.00 0.00 C ATOM 690 O LYS A 66 10.716 -19.945 10.008 1.00 0.00 O ATOM 691 CB LYS A 66 8.631 -20.546 11.789 1.00 0.00 C ATOM 692 CG LYS A 66 7.430 -20.628 12.735 1.00 0.00 C ATOM 693 CD LYS A 66 7.251 -22.026 13.293 1.00 0.00 C ATOM 694 CE LYS A 66 6.767 -22.977 12.202 1.00 0.00 C ATOM 695 NZ LYS A 66 6.593 -24.355 12.693 1.00 0.00 N ATOM 0 H LYS A 66 6.575 -19.143 10.034 1.00 0.00 H new ATOM 0 HA LYS A 66 8.283 -18.526 11.326 1.00 0.00 H new ATOM 0 HB2 LYS A 66 8.744 -21.498 11.271 1.00 0.00 H new ATOM 0 HB3 LYS A 66 9.538 -20.392 12.374 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.564 -19.923 13.555 1.00 0.00 H new ATOM 0 HG3 LYS A 66 6.527 -20.330 12.203 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.195 -22.384 13.704 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.533 -22.008 14.113 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.820 -22.615 11.802 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.482 -22.975 11.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.263 -24.962 11.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.501 -24.713 13.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 5.891 -24.364 13.460 1.00 0.00 H new ATOM 709 N LYS A 67 9.742 -18.067 9.302 1.00 0.00 N ATOM 710 CA LYS A 67 10.873 -17.664 8.556 1.00 0.00 C ATOM 711 C LYS A 67 11.784 -16.850 9.440 1.00 0.00 C ATOM 712 O LYS A 67 12.728 -17.383 10.023 1.00 0.00 O ATOM 713 CB LYS A 67 10.485 -16.869 7.309 1.00 0.00 C ATOM 714 CG LYS A 67 9.525 -17.575 6.358 1.00 0.00 C ATOM 715 CD LYS A 67 9.366 -16.784 5.078 1.00 0.00 C ATOM 716 CE LYS A 67 8.384 -17.446 4.122 1.00 0.00 C ATOM 717 NZ LYS A 67 8.915 -18.696 3.530 1.00 0.00 N ATOM 0 H LYS A 67 8.934 -17.449 9.224 1.00 0.00 H new ATOM 0 HA LYS A 67 11.392 -18.558 8.212 1.00 0.00 H new ATOM 0 HB2 LYS A 67 10.032 -15.929 7.624 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.393 -16.618 6.761 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.898 -18.574 6.131 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.554 -17.699 6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.021 -15.777 5.314 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.336 -16.683 4.590 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.458 -17.666 4.654 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.135 -16.748 3.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.213 -19.095 2.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.793 -18.489 3.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.112 -19.382 4.286 1.00 0.00 H new ATOM 731 N ASP A 68 11.449 -15.577 9.618 1.00 0.00 N ATOM 732 CA ASP A 68 12.278 -14.681 10.389 1.00 0.00 C ATOM 733 C ASP A 68 11.502 -13.578 11.012 1.00 0.00 C ATOM 734 O ASP A 68 10.720 -12.889 10.348 1.00 0.00 O ATOM 735 CB ASP A 68 13.431 -14.078 9.570 1.00 0.00 C ATOM 736 CG ASP A 68 14.593 -15.008 9.378 1.00 0.00 C ATOM 737 OD1 ASP A 68 15.383 -15.188 10.334 1.00 0.00 O ATOM 738 OD2 ASP A 68 14.737 -15.595 8.282 1.00 0.00 O ATOM 0 H ASP A 68 10.606 -15.149 9.235 1.00 0.00 H new ATOM 0 HA ASP A 68 12.699 -15.306 11.176 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.052 -13.780 8.593 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.781 -13.173 10.066 1.00 0.00 H new ATOM 743 N SER A 69 11.753 -13.386 12.271 1.00 0.00 N ATOM 744 CA SER A 69 11.178 -12.317 13.031 1.00 0.00 C ATOM 745 C SER A 69 11.955 -11.027 12.743 1.00 0.00 C ATOM 746 O SER A 69 11.493 -9.933 13.037 1.00 0.00 O ATOM 747 CB SER A 69 11.243 -12.669 14.509 1.00 0.00 C ATOM 748 OG SER A 69 10.637 -13.937 14.739 1.00 0.00 O ATOM 0 H SER A 69 12.379 -13.983 12.812 1.00 0.00 H new ATOM 0 HA SER A 69 10.135 -12.167 12.753 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.281 -12.688 14.841 1.00 0.00 H new ATOM 0 HB3 SER A 69 10.735 -11.903 15.095 1.00 0.00 H new ATOM 0 HG SER A 69 10.686 -14.155 15.693 1.00 0.00 H new ATOM 754 N SER A 70 13.137 -11.187 12.160 1.00 0.00 N ATOM 755 CA SER A 70 13.976 -10.077 11.761 1.00 0.00 C ATOM 756 C SER A 70 13.352 -9.358 10.552 1.00 0.00 C ATOM 757 O SER A 70 13.465 -8.140 10.404 1.00 0.00 O ATOM 758 CB SER A 70 15.354 -10.618 11.412 1.00 0.00 C ATOM 759 OG SER A 70 15.802 -11.502 12.436 1.00 0.00 O ATOM 0 H SER A 70 13.538 -12.101 11.952 1.00 0.00 H new ATOM 0 HA SER A 70 14.063 -9.356 12.574 1.00 0.00 H new ATOM 0 HB2 SER A 70 15.317 -11.143 10.457 1.00 0.00 H new ATOM 0 HB3 SER A 70 16.059 -9.795 11.296 1.00 0.00 H new ATOM 0 HG SER A 70 16.689 -11.848 12.204 1.00 0.00 H new ATOM 765 N ARG A 71 12.681 -10.124 9.691 1.00 0.00 N ATOM 766 CA ARG A 71 11.992 -9.536 8.557 1.00 0.00 C ATOM 767 C ARG A 71 10.600 -9.116 8.961 1.00 0.00 C ATOM 768 O ARG A 71 10.001 -8.248 8.354 1.00 0.00 O ATOM 769 CB ARG A 71 12.094 -10.427 7.285 1.00 0.00 C ATOM 770 CG ARG A 71 11.475 -11.809 7.338 1.00 0.00 C ATOM 771 CD ARG A 71 10.003 -11.799 6.972 1.00 0.00 C ATOM 772 NE ARG A 71 9.768 -11.259 5.614 1.00 0.00 N ATOM 773 CZ ARG A 71 9.483 -12.007 4.522 1.00 0.00 C ATOM 774 NH1 ARG A 71 9.785 -13.297 4.505 1.00 0.00 N ATOM 775 NH2 ARG A 71 9.002 -11.444 3.419 1.00 0.00 N ATOM 0 H ARG A 71 12.604 -11.139 9.761 1.00 0.00 H new ATOM 0 HA ARG A 71 12.494 -8.618 8.253 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.633 -9.885 6.459 1.00 0.00 H new ATOM 0 HB3 ARG A 71 13.150 -10.542 7.041 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.011 -12.470 6.657 1.00 0.00 H new ATOM 0 HG3 ARG A 71 11.594 -12.219 8.341 1.00 0.00 H new ATOM 0 HD2 ARG A 71 9.609 -12.814 7.031 1.00 0.00 H new ATOM 0 HD3 ARG A 71 9.454 -11.201 7.699 1.00 0.00 H new ATOM 0 HE ARG A 71 9.825 -10.248 5.492 1.00 0.00 H new ATOM 0 HH11 ARG A 71 10.232 -13.727 5.315 1.00 0.00 H new ATOM 0 HH12 ARG A 71 9.570 -13.860 3.682 1.00 0.00 H new ATOM 0 HH21 ARG A 71 8.843 -10.437 3.388 1.00 0.00 H new ATOM 0 HH22 ARG A 71 8.791 -12.019 2.603 1.00 0.00 H new ATOM 789 N HIS A 72 10.119 -9.695 10.046 1.00 0.00 N ATOM 790 CA HIS A 72 8.877 -9.259 10.641 1.00 0.00 C ATOM 791 C HIS A 72 9.133 -7.893 11.292 1.00 0.00 C ATOM 792 O HIS A 72 10.244 -7.633 11.745 1.00 0.00 O ATOM 793 CB HIS A 72 8.389 -10.278 11.671 1.00 0.00 C ATOM 794 CG HIS A 72 7.047 -9.952 12.272 1.00 0.00 C ATOM 795 ND1 HIS A 72 6.862 -9.602 13.585 1.00 0.00 N ATOM 796 CD2 HIS A 72 5.812 -9.935 11.705 1.00 0.00 C ATOM 797 CE1 HIS A 72 5.562 -9.389 13.776 1.00 0.00 C ATOM 798 NE2 HIS A 72 4.875 -9.575 12.663 1.00 0.00 N ATOM 0 H HIS A 72 10.573 -10.469 10.531 1.00 0.00 H new ATOM 0 HA HIS A 72 8.097 -9.173 9.885 1.00 0.00 H new ATOM 0 HB2 HIS A 72 8.335 -11.259 11.198 1.00 0.00 H new ATOM 0 HB3 HIS A 72 9.125 -10.350 12.471 1.00 0.00 H new ATOM 0 HD1 HIS A 72 7.593 -9.519 14.292 1.00 0.00 H new ATOM 0 HD2 HIS A 72 5.594 -10.165 10.672 1.00 0.00 H new ATOM 0 HE1 HIS A 72 5.125 -9.101 14.720 1.00 0.00 H new ATOM 806 N SER A 73 8.134 -7.014 11.265 1.00 0.00 N ATOM 807 CA SER A 73 8.244 -5.625 11.760 1.00 0.00 C ATOM 808 C SER A 73 9.099 -4.756 10.818 1.00 0.00 C ATOM 809 O SER A 73 9.342 -3.564 11.058 1.00 0.00 O ATOM 810 CB SER A 73 8.717 -5.563 13.218 1.00 0.00 C ATOM 811 OG SER A 73 7.818 -6.287 14.061 1.00 0.00 O ATOM 0 H SER A 73 7.210 -7.239 10.896 1.00 0.00 H new ATOM 0 HA SER A 73 7.241 -5.199 11.755 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.720 -5.981 13.300 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.777 -4.525 13.545 1.00 0.00 H new ATOM 0 HG SER A 73 8.131 -6.242 14.989 1.00 0.00 H new ATOM 817 N LYS A 74 9.546 -5.378 9.760 1.00 0.00 N ATOM 818 CA LYS A 74 10.232 -4.732 8.665 1.00 0.00 C ATOM 819 C LYS A 74 9.540 -5.244 7.407 1.00 0.00 C ATOM 820 O LYS A 74 10.065 -5.233 6.280 1.00 0.00 O ATOM 821 CB LYS A 74 11.738 -5.066 8.673 1.00 0.00 C ATOM 822 CG LYS A 74 12.616 -4.368 7.594 1.00 0.00 C ATOM 823 CD LYS A 74 12.664 -2.827 7.711 1.00 0.00 C ATOM 824 CE LYS A 74 11.455 -2.135 7.062 1.00 0.00 C ATOM 825 NZ LYS A 74 11.523 -0.662 7.189 1.00 0.00 N ATOM 0 H LYS A 74 9.440 -6.384 9.629 1.00 0.00 H new ATOM 0 HA LYS A 74 10.180 -3.645 8.733 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.138 -4.810 9.654 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.848 -6.144 8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 74 13.632 -4.757 7.662 1.00 0.00 H new ATOM 0 HG3 LYS A 74 12.238 -4.634 6.607 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.711 -2.550 8.764 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.578 -2.461 7.244 1.00 0.00 H new ATOM 0 HE2 LYS A 74 11.406 -2.406 6.007 1.00 0.00 H new ATOM 0 HE3 LYS A 74 10.538 -2.497 7.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.688 -0.236 6.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 11.544 -0.401 8.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 12.385 -0.313 6.723 1.00 0.00 H new ATOM 839 N LEU A 75 8.346 -5.694 7.643 1.00 0.00 N ATOM 840 CA LEU A 75 7.483 -6.208 6.648 1.00 0.00 C ATOM 841 C LEU A 75 6.594 -5.120 6.163 1.00 0.00 C ATOM 842 O LEU A 75 5.808 -4.536 6.926 1.00 0.00 O ATOM 843 CB LEU A 75 6.676 -7.393 7.179 1.00 0.00 C ATOM 844 CG LEU A 75 7.309 -8.765 6.993 1.00 0.00 C ATOM 845 CD1 LEU A 75 6.559 -9.828 7.778 1.00 0.00 C ATOM 846 CD2 LEU A 75 7.311 -9.121 5.515 1.00 0.00 C ATOM 0 H LEU A 75 7.938 -5.710 8.578 1.00 0.00 H new ATOM 0 HA LEU A 75 8.077 -6.577 5.812 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.497 -7.238 8.243 1.00 0.00 H new ATOM 0 HB3 LEU A 75 5.703 -7.394 6.689 1.00 0.00 H new ATOM 0 HG LEU A 75 8.332 -8.728 7.368 1.00 0.00 H new ATOM 0 HD11 LEU A 75 7.035 -10.797 7.625 1.00 0.00 H new ATOM 0 HD12 LEU A 75 6.578 -9.578 8.839 1.00 0.00 H new ATOM 0 HD13 LEU A 75 5.526 -9.873 7.434 1.00 0.00 H new ATOM 0 HD21 LEU A 75 7.764 -10.103 5.378 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.286 -9.139 5.144 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.884 -8.377 4.962 1.00 0.00 H new ATOM 858 N GLU A 76 6.753 -4.812 4.926 1.00 0.00 N ATOM 859 CA GLU A 76 5.985 -3.801 4.291 1.00 0.00 C ATOM 860 C GLU A 76 4.642 -4.399 3.937 1.00 0.00 C ATOM 861 O GLU A 76 4.546 -5.606 3.748 1.00 0.00 O ATOM 862 CB GLU A 76 6.710 -3.353 3.040 1.00 0.00 C ATOM 863 CG GLU A 76 8.169 -3.002 3.282 1.00 0.00 C ATOM 864 CD GLU A 76 8.851 -2.591 2.028 1.00 0.00 C ATOM 865 OE1 GLU A 76 8.651 -1.458 1.582 1.00 0.00 O ATOM 866 OE2 GLU A 76 9.581 -3.404 1.443 1.00 0.00 O ATOM 0 H GLU A 76 7.433 -5.264 4.315 1.00 0.00 H new ATOM 0 HA GLU A 76 5.845 -2.939 4.943 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.653 -4.145 2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.199 -2.485 2.624 1.00 0.00 H new ATOM 0 HG2 GLU A 76 8.233 -2.195 4.012 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.684 -3.862 3.711 1.00 0.00 H new ATOM 873 N LYS A 77 3.632 -3.571 3.841 1.00 0.00 N ATOM 874 CA LYS A 77 2.266 -4.002 3.553 1.00 0.00 C ATOM 875 C LYS A 77 2.196 -4.935 2.347 1.00 0.00 C ATOM 876 O LYS A 77 1.654 -6.029 2.430 1.00 0.00 O ATOM 877 CB LYS A 77 1.390 -2.775 3.366 1.00 0.00 C ATOM 878 CG LYS A 77 -0.030 -3.068 2.914 1.00 0.00 C ATOM 879 CD LYS A 77 -0.936 -1.847 3.090 1.00 0.00 C ATOM 880 CE LYS A 77 -1.137 -1.504 4.562 1.00 0.00 C ATOM 881 NZ LYS A 77 -1.843 -0.224 4.759 1.00 0.00 N ATOM 0 H LYS A 77 3.726 -2.562 3.961 1.00 0.00 H new ATOM 0 HA LYS A 77 1.897 -4.582 4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.351 -2.227 4.308 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.861 -2.118 2.635 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.025 -3.371 1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.430 -3.905 3.486 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -0.500 -0.992 2.573 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.903 -2.041 2.626 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.702 -2.303 5.043 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.166 -1.458 5.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.892 -0.008 5.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.329 0.535 4.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.806 -0.296 4.373 1.00 0.00 H new ATOM 895 N ALA A 78 2.810 -4.512 1.271 1.00 0.00 N ATOM 896 CA ALA A 78 2.864 -5.279 0.028 1.00 0.00 C ATOM 897 C ALA A 78 3.583 -6.617 0.213 1.00 0.00 C ATOM 898 O ALA A 78 3.276 -7.607 -0.454 1.00 0.00 O ATOM 899 CB ALA A 78 3.599 -4.467 -1.009 1.00 0.00 C ATOM 0 H ALA A 78 3.296 -3.616 1.221 1.00 0.00 H new ATOM 0 HA ALA A 78 1.842 -5.489 -0.287 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.647 -5.027 -1.943 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.072 -3.528 -1.176 1.00 0.00 H new ATOM 0 HB3 ALA A 78 4.610 -4.258 -0.658 1.00 0.00 H new ATOM 905 N ASP A 79 4.487 -6.645 1.161 1.00 0.00 N ATOM 906 CA ASP A 79 5.351 -7.793 1.376 1.00 0.00 C ATOM 907 C ASP A 79 4.587 -8.846 2.130 1.00 0.00 C ATOM 908 O ASP A 79 4.658 -10.039 1.821 1.00 0.00 O ATOM 909 CB ASP A 79 6.595 -7.362 2.152 1.00 0.00 C ATOM 910 CG ASP A 79 7.814 -8.162 1.751 1.00 0.00 C ATOM 911 OD1 ASP A 79 8.394 -7.877 0.683 1.00 0.00 O ATOM 912 OD2 ASP A 79 8.221 -9.079 2.471 1.00 0.00 O ATOM 0 H ASP A 79 4.649 -5.874 1.809 1.00 0.00 H new ATOM 0 HA ASP A 79 5.672 -8.206 0.420 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.783 -6.302 1.978 1.00 0.00 H new ATOM 0 HB3 ASP A 79 6.417 -7.483 3.220 1.00 0.00 H new ATOM 917 N ILE A 80 3.817 -8.375 3.081 1.00 0.00 N ATOM 918 CA ILE A 80 2.967 -9.196 3.919 1.00 0.00 C ATOM 919 C ILE A 80 1.834 -9.803 3.092 1.00 0.00 C ATOM 920 O ILE A 80 1.587 -11.015 3.163 1.00 0.00 O ATOM 921 CB ILE A 80 2.375 -8.334 5.053 1.00 0.00 C ATOM 922 CG1 ILE A 80 3.504 -7.694 5.828 1.00 0.00 C ATOM 923 CG2 ILE A 80 1.527 -9.182 5.985 1.00 0.00 C ATOM 924 CD1 ILE A 80 3.082 -6.564 6.721 1.00 0.00 C ATOM 0 H ILE A 80 3.761 -7.381 3.302 1.00 0.00 H new ATOM 0 HA ILE A 80 3.563 -10.003 4.345 1.00 0.00 H new ATOM 0 HB ILE A 80 1.739 -7.563 4.618 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.990 -8.458 6.435 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.249 -7.325 5.123 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.119 -8.555 6.778 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.710 -9.634 5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 80 2.143 -9.967 6.424 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.954 -6.164 7.238 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.624 -5.778 6.121 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.361 -6.928 7.453 1.00 0.00 H new ATOM 936 N LEU A 81 1.168 -8.961 2.289 1.00 0.00 N ATOM 937 CA LEU A 81 0.053 -9.407 1.438 1.00 0.00 C ATOM 938 C LEU A 81 0.476 -10.580 0.566 1.00 0.00 C ATOM 939 O LEU A 81 -0.147 -11.644 0.595 1.00 0.00 O ATOM 940 CB LEU A 81 -0.454 -8.274 0.535 1.00 0.00 C ATOM 941 CG LEU A 81 -0.961 -7.000 1.217 1.00 0.00 C ATOM 942 CD1 LEU A 81 -1.432 -6.006 0.171 1.00 0.00 C ATOM 943 CD2 LEU A 81 -2.079 -7.302 2.214 1.00 0.00 C ATOM 0 H LEU A 81 1.381 -7.967 2.210 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.753 -9.716 2.104 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.355 -7.995 -0.141 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.262 -8.670 -0.081 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.134 -6.564 1.778 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.791 -5.102 0.663 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.603 -5.754 -0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.240 -6.447 -0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.413 -6.374 2.678 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.915 -7.769 1.693 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.707 -7.979 2.983 1.00 0.00 H new ATOM 955 N GLU A 82 1.572 -10.398 -0.157 1.00 0.00 N ATOM 956 CA GLU A 82 2.096 -11.420 -1.041 1.00 0.00 C ATOM 957 C GLU A 82 2.519 -12.667 -0.282 1.00 0.00 C ATOM 958 O GLU A 82 2.302 -13.756 -0.748 1.00 0.00 O ATOM 959 CB GLU A 82 3.250 -10.860 -1.870 1.00 0.00 C ATOM 960 CG GLU A 82 4.083 -11.863 -2.595 1.00 0.00 C ATOM 961 CD GLU A 82 5.268 -11.223 -3.242 1.00 0.00 C ATOM 962 OE1 GLU A 82 5.133 -10.696 -4.365 1.00 0.00 O ATOM 963 OE2 GLU A 82 6.359 -11.215 -2.624 1.00 0.00 O ATOM 0 H GLU A 82 2.120 -9.538 -0.145 1.00 0.00 H new ATOM 0 HA GLU A 82 1.295 -11.720 -1.716 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.841 -10.161 -2.600 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.900 -10.286 -1.210 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.418 -12.632 -1.898 1.00 0.00 H new ATOM 0 HG3 GLU A 82 3.478 -12.361 -3.353 1.00 0.00 H new ATOM 970 N MET A 83 3.035 -12.497 0.919 1.00 0.00 N ATOM 971 CA MET A 83 3.561 -13.613 1.703 1.00 0.00 C ATOM 972 C MET A 83 2.408 -14.526 2.108 1.00 0.00 C ATOM 973 O MET A 83 2.549 -15.750 2.179 1.00 0.00 O ATOM 974 CB MET A 83 4.294 -13.065 2.936 1.00 0.00 C ATOM 975 CG MET A 83 5.078 -14.083 3.754 1.00 0.00 C ATOM 976 SD MET A 83 5.895 -13.308 5.162 1.00 0.00 S ATOM 977 CE MET A 83 6.547 -14.736 5.985 1.00 0.00 C ATOM 0 H MET A 83 3.105 -11.591 1.382 1.00 0.00 H new ATOM 0 HA MET A 83 4.270 -14.193 1.112 1.00 0.00 H new ATOM 0 HB2 MET A 83 4.981 -12.285 2.609 1.00 0.00 H new ATOM 0 HB3 MET A 83 3.561 -12.591 3.589 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.405 -14.864 4.107 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.822 -14.566 3.120 1.00 0.00 H new ATOM 0 HE1 MET A 83 7.524 -14.499 6.406 1.00 0.00 H new ATOM 0 HE2 MET A 83 5.870 -15.035 6.785 1.00 0.00 H new ATOM 0 HE3 MET A 83 6.648 -15.553 5.271 1.00 0.00 H new ATOM 987 N THR A 84 1.263 -13.911 2.288 1.00 0.00 N ATOM 988 CA THR A 84 0.045 -14.580 2.648 1.00 0.00 C ATOM 989 C THR A 84 -0.537 -15.308 1.421 1.00 0.00 C ATOM 990 O THR A 84 -0.885 -16.499 1.491 1.00 0.00 O ATOM 991 CB THR A 84 -0.938 -13.523 3.180 1.00 0.00 C ATOM 992 OG1 THR A 84 -0.234 -12.748 4.149 1.00 0.00 O ATOM 993 CG2 THR A 84 -2.150 -14.155 3.861 1.00 0.00 C ATOM 0 H THR A 84 1.155 -12.902 2.184 1.00 0.00 H new ATOM 0 HA THR A 84 0.230 -15.328 3.419 1.00 0.00 H new ATOM 0 HB THR A 84 -1.301 -12.925 2.344 1.00 0.00 H new ATOM 0 HG1 THR A 84 0.281 -12.048 3.696 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.816 -13.370 4.220 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.682 -14.783 3.147 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.818 -14.763 4.703 1.00 0.00 H new ATOM 1001 N VAL A 85 -0.590 -14.606 0.287 1.00 0.00 N ATOM 1002 CA VAL A 85 -1.099 -15.190 -0.957 1.00 0.00 C ATOM 1003 C VAL A 85 -0.214 -16.362 -1.380 1.00 0.00 C ATOM 1004 O VAL A 85 -0.699 -17.431 -1.732 1.00 0.00 O ATOM 1005 CB VAL A 85 -1.145 -14.149 -2.106 1.00 0.00 C ATOM 1006 CG1 VAL A 85 -1.728 -14.736 -3.394 1.00 0.00 C ATOM 1007 CG2 VAL A 85 -1.914 -12.930 -1.694 1.00 0.00 C ATOM 0 H VAL A 85 -0.288 -13.635 0.204 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.116 -15.533 -0.766 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.114 -13.861 -2.314 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -1.740 -13.970 -4.170 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -1.114 -15.575 -3.722 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -2.745 -15.081 -3.209 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.932 -12.216 -2.517 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.935 -13.213 -1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.436 -12.474 -0.827 1.00 0.00 H new ATOM 1017 N LYS A 86 1.082 -16.170 -1.289 1.00 0.00 N ATOM 1018 CA LYS A 86 2.025 -17.199 -1.654 1.00 0.00 C ATOM 1019 C LYS A 86 1.914 -18.418 -0.735 1.00 0.00 C ATOM 1020 O LYS A 86 2.079 -19.554 -1.174 1.00 0.00 O ATOM 1021 CB LYS A 86 3.453 -16.671 -1.717 1.00 0.00 C ATOM 1022 CG LYS A 86 3.663 -15.570 -2.760 1.00 0.00 C ATOM 1023 CD LYS A 86 5.132 -15.414 -3.066 1.00 0.00 C ATOM 1024 CE LYS A 86 5.368 -14.691 -4.366 1.00 0.00 C ATOM 1025 NZ LYS A 86 6.786 -14.734 -4.757 1.00 0.00 N ATOM 0 H LYS A 86 1.509 -15.303 -0.962 1.00 0.00 H new ATOM 0 HA LYS A 86 1.763 -17.525 -2.661 1.00 0.00 H new ATOM 0 HB2 LYS A 86 3.731 -16.286 -0.736 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.127 -17.499 -1.937 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.118 -15.815 -3.672 1.00 0.00 H new ATOM 0 HG3 LYS A 86 3.259 -14.627 -2.391 1.00 0.00 H new ATOM 0 HD2 LYS A 86 5.614 -14.868 -2.255 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.599 -16.398 -3.109 1.00 0.00 H new ATOM 0 HE2 LYS A 86 4.759 -15.142 -5.150 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.047 -13.654 -4.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.914 -14.227 -5.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.363 -14.282 -4.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.085 -15.724 -4.872 1.00 0.00 H new ATOM 1039 N HIS A 87 1.571 -18.184 0.527 1.00 0.00 N ATOM 1040 CA HIS A 87 1.377 -19.276 1.466 1.00 0.00 C ATOM 1041 C HIS A 87 0.172 -20.112 1.073 1.00 0.00 C ATOM 1042 O HIS A 87 0.197 -21.337 1.209 1.00 0.00 O ATOM 1043 CB HIS A 87 1.256 -18.772 2.923 1.00 0.00 C ATOM 1044 CG HIS A 87 0.928 -19.852 3.950 1.00 0.00 C ATOM 1045 ND1 HIS A 87 1.646 -21.017 4.114 1.00 0.00 N ATOM 1046 CD2 HIS A 87 -0.084 -19.921 4.853 1.00 0.00 C ATOM 1047 CE1 HIS A 87 1.070 -21.728 5.078 1.00 0.00 C ATOM 1048 NE2 HIS A 87 0.016 -21.114 5.564 1.00 0.00 N ATOM 0 H HIS A 87 1.423 -17.254 0.919 1.00 0.00 H new ATOM 0 HA HIS A 87 2.264 -19.908 1.421 1.00 0.00 H new ATOM 0 HB2 HIS A 87 2.194 -18.294 3.206 1.00 0.00 H new ATOM 0 HB3 HIS A 87 0.483 -18.005 2.964 1.00 0.00 H new ATOM 0 HD1 HIS A 87 2.476 -21.287 3.587 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -0.846 -19.169 4.997 1.00 0.00 H new ATOM 0 HE1 HIS A 87 1.424 -22.690 5.419 1.00 0.00 H new ATOM 1056 N LEU A 88 -0.862 -19.477 0.517 1.00 0.00 N ATOM 1057 CA LEU A 88 -2.034 -20.227 0.164 1.00 0.00 C ATOM 1058 C LEU A 88 -1.731 -21.078 -1.050 1.00 0.00 C ATOM 1059 O LEU A 88 -2.262 -22.147 -1.188 1.00 0.00 O ATOM 1060 CB LEU A 88 -3.306 -19.332 -0.002 1.00 0.00 C ATOM 1061 CG LEU A 88 -3.414 -18.413 -1.232 1.00 0.00 C ATOM 1062 CD1 LEU A 88 -3.963 -19.156 -2.446 1.00 0.00 C ATOM 1063 CD2 LEU A 88 -4.252 -17.194 -0.924 1.00 0.00 C ATOM 0 H LEU A 88 -0.899 -18.478 0.313 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.288 -20.891 0.990 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.174 -19.991 -0.006 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.386 -18.705 0.886 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.405 -18.082 -1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.024 -18.473 -3.293 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -3.301 -19.985 -2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.957 -19.541 -2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.313 -16.561 -1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.255 -17.506 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.794 -16.634 -0.109 1.00 0.00 H new ATOM 1075 N ARG A 89 -0.798 -20.610 -1.889 1.00 0.00 N ATOM 1076 CA ARG A 89 -0.381 -21.368 -3.075 1.00 0.00 C ATOM 1077 C ARG A 89 0.341 -22.616 -2.603 1.00 0.00 C ATOM 1078 O ARG A 89 0.120 -23.714 -3.104 1.00 0.00 O ATOM 1079 CB ARG A 89 0.602 -20.577 -3.959 1.00 0.00 C ATOM 1080 CG ARG A 89 0.297 -19.101 -4.161 1.00 0.00 C ATOM 1081 CD ARG A 89 -1.095 -18.831 -4.657 1.00 0.00 C ATOM 1082 NE ARG A 89 -1.403 -19.536 -5.896 1.00 0.00 N ATOM 1083 CZ ARG A 89 -1.608 -18.955 -7.074 1.00 0.00 C ATOM 1084 NH1 ARG A 89 -1.248 -17.675 -7.273 1.00 0.00 N ATOM 1085 NH2 ARG A 89 -2.109 -19.669 -8.075 1.00 0.00 N ATOM 0 H ARG A 89 -0.321 -19.717 -1.770 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.273 -21.591 -3.661 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.597 -20.663 -3.523 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.640 -21.054 -4.938 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.444 -18.577 -3.217 1.00 0.00 H new ATOM 0 HG3 ARG A 89 1.012 -18.686 -4.871 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.812 -19.125 -3.890 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.218 -17.759 -4.815 1.00 0.00 H new ATOM 0 HE ARG A 89 -1.466 -20.553 -5.856 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -0.815 -17.144 -6.518 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.408 -17.235 -8.179 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -2.333 -20.654 -7.936 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -2.270 -19.232 -8.983 1.00 0.00 H new ATOM 1099 N ASN A 90 1.188 -22.420 -1.593 1.00 0.00 N ATOM 1100 CA ASN A 90 1.979 -23.495 -0.988 1.00 0.00 C ATOM 1101 C ASN A 90 1.076 -24.533 -0.401 1.00 0.00 C ATOM 1102 O ASN A 90 1.302 -25.729 -0.544 1.00 0.00 O ATOM 1103 CB ASN A 90 2.892 -22.984 0.121 1.00 0.00 C ATOM 1104 CG ASN A 90 3.977 -22.012 -0.312 1.00 0.00 C ATOM 1105 OD1 ASN A 90 4.450 -22.035 -1.441 1.00 0.00 O ATOM 1106 ND2 ASN A 90 4.408 -21.179 0.608 1.00 0.00 N ATOM 0 H ASN A 90 1.347 -21.506 -1.168 1.00 0.00 H new ATOM 0 HA ASN A 90 2.592 -23.917 -1.784 1.00 0.00 H new ATOM 0 HB2 ASN A 90 2.276 -22.498 0.878 1.00 0.00 H new ATOM 0 HB3 ASN A 90 3.367 -23.841 0.598 1.00 0.00 H new ATOM 0 HD21 ASN A 90 5.160 -20.524 0.391 1.00 0.00 H new ATOM 0 HD22 ASN A 90 3.991 -21.187 1.539 1.00 0.00 H new ATOM 1113 N LEU A 91 0.065 -24.078 0.273 1.00 0.00 N ATOM 1114 CA LEU A 91 -0.920 -24.959 0.818 1.00 0.00 C ATOM 1115 C LEU A 91 -1.653 -25.667 -0.298 1.00 0.00 C ATOM 1116 O LEU A 91 -1.746 -26.880 -0.304 1.00 0.00 O ATOM 1117 CB LEU A 91 -1.885 -24.182 1.700 1.00 0.00 C ATOM 1118 CG LEU A 91 -1.290 -23.631 2.997 1.00 0.00 C ATOM 1119 CD1 LEU A 91 -2.249 -22.662 3.657 1.00 0.00 C ATOM 1120 CD2 LEU A 91 -0.984 -24.775 3.948 1.00 0.00 C ATOM 0 H LEU A 91 -0.100 -23.089 0.460 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.428 -25.711 1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -2.288 -23.350 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -2.724 -24.831 1.952 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.369 -23.099 2.757 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -1.806 -22.282 4.578 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.449 -21.831 2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.183 -23.175 3.888 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -0.560 -24.378 4.870 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.903 -25.316 4.174 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.269 -25.453 3.483 1.00 0.00 H new ATOM 1132 N GLN A 92 -2.055 -24.915 -1.297 1.00 0.00 N ATOM 1133 CA GLN A 92 -2.854 -25.428 -2.413 1.00 0.00 C ATOM 1134 C GLN A 92 -2.139 -26.474 -3.239 1.00 0.00 C ATOM 1135 O GLN A 92 -2.766 -27.358 -3.795 1.00 0.00 O ATOM 1136 CB GLN A 92 -3.375 -24.293 -3.299 1.00 0.00 C ATOM 1137 CG GLN A 92 -4.543 -23.523 -2.703 1.00 0.00 C ATOM 1138 CD GLN A 92 -5.799 -24.348 -2.576 1.00 0.00 C ATOM 1139 OE1 GLN A 92 -5.771 -25.568 -2.397 1.00 0.00 O ATOM 1140 NE2 GLN A 92 -6.903 -23.702 -2.660 1.00 0.00 N ATOM 0 H GLN A 92 -1.841 -23.920 -1.369 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.706 -25.931 -1.956 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.559 -23.598 -3.497 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.680 -24.708 -4.260 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -4.260 -23.152 -1.718 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -4.750 -22.652 -3.325 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -6.893 -22.693 -2.808 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -7.791 -24.197 -2.578 1.00 0.00 H new ATOM 1149 N ARG A 93 -0.837 -26.408 -3.291 1.00 0.00 N ATOM 1150 CA ARG A 93 -0.082 -27.373 -4.062 1.00 0.00 C ATOM 1151 C ARG A 93 0.126 -28.652 -3.277 1.00 0.00 C ATOM 1152 O ARG A 93 0.539 -29.670 -3.827 1.00 0.00 O ATOM 1153 CB ARG A 93 1.253 -26.768 -4.563 1.00 0.00 C ATOM 1154 CG ARG A 93 2.199 -26.216 -3.484 1.00 0.00 C ATOM 1155 CD ARG A 93 2.891 -27.305 -2.658 1.00 0.00 C ATOM 1156 NE ARG A 93 3.552 -28.304 -3.491 1.00 0.00 N ATOM 1157 CZ ARG A 93 4.011 -29.487 -3.068 1.00 0.00 C ATOM 1158 NH1 ARG A 93 3.960 -29.822 -1.774 1.00 0.00 N ATOM 1159 NH2 ARG A 93 4.523 -30.332 -3.945 1.00 0.00 N ATOM 0 H ARG A 93 -0.274 -25.703 -2.814 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.663 -27.632 -4.947 1.00 0.00 H new ATOM 0 HB2 ARG A 93 1.786 -27.535 -5.125 1.00 0.00 H new ATOM 0 HB3 ARG A 93 1.023 -25.963 -5.261 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.958 -25.596 -3.961 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.634 -25.568 -2.814 1.00 0.00 H new ATOM 0 HD2 ARG A 93 3.626 -26.844 -1.998 1.00 0.00 H new ATOM 0 HD3 ARG A 93 2.155 -27.797 -2.022 1.00 0.00 H new ATOM 0 HE ARG A 93 3.674 -28.082 -4.479 1.00 0.00 H new ATOM 0 HH11 ARG A 93 3.567 -29.171 -1.094 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.314 -30.728 -1.467 1.00 0.00 H new ATOM 0 HH21 ARG A 93 4.565 -30.079 -4.932 1.00 0.00 H new ATOM 0 HH22 ARG A 93 4.876 -31.237 -3.635 1.00 0.00 H new ATOM 1173 N ALA A 94 -0.159 -28.585 -1.990 1.00 0.00 N ATOM 1174 CA ALA A 94 0.041 -29.699 -1.097 1.00 0.00 C ATOM 1175 C ALA A 94 -1.116 -30.675 -1.181 1.00 0.00 C ATOM 1176 O ALA A 94 -0.955 -31.883 -0.937 1.00 0.00 O ATOM 1177 CB ALA A 94 0.188 -29.202 0.325 1.00 0.00 C ATOM 0 H ALA A 94 -0.536 -27.752 -1.538 1.00 0.00 H new ATOM 0 HA ALA A 94 0.952 -30.217 -1.397 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.339 -30.050 0.993 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.046 -28.532 0.390 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -0.714 -28.665 0.618 1.00 0.00 H new ATOM 1183 N GLN A 95 -2.268 -30.154 -1.523 1.00 0.00 N ATOM 1184 CA GLN A 95 -3.471 -30.917 -1.611 1.00 0.00 C ATOM 1185 C GLN A 95 -4.417 -30.367 -2.666 1.00 0.00 C ATOM 1186 O GLN A 95 -4.407 -30.883 -3.806 1.00 0.00 O ATOM 1187 CB GLN A 95 -4.135 -31.160 -0.217 1.00 0.00 C ATOM 1188 CG GLN A 95 -4.063 -30.023 0.841 1.00 0.00 C ATOM 1189 CD GLN A 95 -4.837 -28.755 0.509 1.00 0.00 C ATOM 1190 OE1 GLN A 95 -6.030 -28.648 0.815 1.00 0.00 O ATOM 1191 NE2 GLN A 95 -4.168 -27.766 -0.017 1.00 0.00 N ATOM 0 H GLN A 95 -2.390 -29.167 -1.751 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.196 -31.913 -1.960 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -5.187 -31.392 -0.385 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -3.679 -32.049 0.218 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -4.432 -30.412 1.790 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -3.016 -29.758 0.990 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -3.184 -27.887 -0.258 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -4.629 -26.872 -0.187 1.00 0.00 H new TER 1200 GLN A 95 ATOM 1201 N MET B 26 7.575 28.127 -8.443 1.00 0.00 N ATOM 1202 CA MET B 26 6.696 27.157 -7.798 1.00 0.00 C ATOM 1203 C MET B 26 7.318 25.782 -7.848 1.00 0.00 C ATOM 1204 O MET B 26 7.996 25.433 -8.821 1.00 0.00 O ATOM 1205 CB MET B 26 5.300 27.145 -8.446 1.00 0.00 C ATOM 1206 CG MET B 26 5.305 26.875 -9.941 1.00 0.00 C ATOM 1207 SD MET B 26 3.655 26.831 -10.663 1.00 0.00 S ATOM 1208 CE MET B 26 3.051 28.481 -10.275 1.00 0.00 C ATOM 0 HA MET B 26 6.571 27.452 -6.756 1.00 0.00 H new ATOM 0 HB2 MET B 26 4.691 26.387 -7.954 1.00 0.00 H new ATOM 0 HB3 MET B 26 4.820 28.107 -8.264 1.00 0.00 H new ATOM 0 HG2 MET B 26 5.892 27.646 -10.440 1.00 0.00 H new ATOM 0 HG3 MET B 26 5.802 25.923 -10.130 1.00 0.00 H new ATOM 0 HE1 MET B 26 2.211 28.723 -10.926 1.00 0.00 H new ATOM 0 HE2 MET B 26 2.726 28.514 -9.235 1.00 0.00 H new ATOM 0 HE3 MET B 26 3.850 29.206 -10.429 1.00 0.00 H new ATOM 1220 N LYS B 27 7.097 25.012 -6.817 1.00 0.00 N ATOM 1221 CA LYS B 27 7.640 23.674 -6.703 1.00 0.00 C ATOM 1222 C LYS B 27 6.503 22.672 -6.552 1.00 0.00 C ATOM 1223 O LYS B 27 5.417 23.046 -6.106 1.00 0.00 O ATOM 1224 CB LYS B 27 8.585 23.602 -5.494 1.00 0.00 C ATOM 1225 CG LYS B 27 9.808 24.487 -5.630 1.00 0.00 C ATOM 1226 CD LYS B 27 10.686 24.421 -4.405 1.00 0.00 C ATOM 1227 CE LYS B 27 11.899 25.316 -4.559 1.00 0.00 C ATOM 1228 NZ LYS B 27 12.719 25.343 -3.338 1.00 0.00 N ATOM 0 H LYS B 27 6.528 25.295 -6.019 1.00 0.00 H new ATOM 0 HA LYS B 27 8.204 23.430 -7.603 1.00 0.00 H new ATOM 0 HB2 LYS B 27 8.037 23.889 -4.597 1.00 0.00 H new ATOM 0 HB3 LYS B 27 8.907 22.570 -5.355 1.00 0.00 H new ATOM 0 HG2 LYS B 27 10.382 24.182 -6.505 1.00 0.00 H new ATOM 0 HG3 LYS B 27 9.494 25.517 -5.797 1.00 0.00 H new ATOM 0 HD2 LYS B 27 10.115 24.724 -3.527 1.00 0.00 H new ATOM 0 HD3 LYS B 27 11.007 23.393 -4.238 1.00 0.00 H new ATOM 0 HE2 LYS B 27 12.504 24.966 -5.395 1.00 0.00 H new ATOM 0 HE3 LYS B 27 11.575 26.328 -4.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 13.539 25.966 -3.484 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 12.149 25.701 -2.545 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 13.050 24.381 -3.121 1.00 0.00 H new ATOM 1242 N PRO B 28 6.719 21.397 -6.926 1.00 0.00 N ATOM 1243 CA PRO B 28 5.688 20.352 -6.815 1.00 0.00 C ATOM 1244 C PRO B 28 5.389 19.999 -5.355 1.00 0.00 C ATOM 1245 O PRO B 28 6.157 20.350 -4.440 1.00 0.00 O ATOM 1246 CB PRO B 28 6.342 19.154 -7.510 1.00 0.00 C ATOM 1247 CG PRO B 28 7.792 19.380 -7.293 1.00 0.00 C ATOM 1248 CD PRO B 28 7.979 20.850 -7.482 1.00 0.00 C ATOM 0 HA PRO B 28 4.737 20.661 -7.248 1.00 0.00 H new ATOM 0 HB2 PRO B 28 6.013 18.209 -7.077 1.00 0.00 H new ATOM 0 HB3 PRO B 28 6.095 19.121 -8.571 1.00 0.00 H new ATOM 0 HG2 PRO B 28 8.096 19.067 -6.294 1.00 0.00 H new ATOM 0 HG3 PRO B 28 8.392 18.810 -8.002 1.00 0.00 H new ATOM 0 HD2 PRO B 28 8.855 21.221 -6.949 1.00 0.00 H new ATOM 0 HD3 PRO B 28 8.109 21.113 -8.532 1.00 0.00 H new ATOM 1256 N LYS B 29 4.301 19.311 -5.143 1.00 0.00 N ATOM 1257 CA LYS B 29 3.900 18.894 -3.824 1.00 0.00 C ATOM 1258 C LYS B 29 3.309 17.485 -3.878 1.00 0.00 C ATOM 1259 O LYS B 29 2.521 17.164 -4.780 1.00 0.00 O ATOM 1260 CB LYS B 29 2.938 19.930 -3.205 1.00 0.00 C ATOM 1261 CG LYS B 29 1.784 20.317 -4.109 1.00 0.00 C ATOM 1262 CD LYS B 29 0.958 21.451 -3.534 1.00 0.00 C ATOM 1263 CE LYS B 29 -0.130 21.879 -4.510 1.00 0.00 C ATOM 1264 NZ LYS B 29 -1.061 20.775 -4.834 1.00 0.00 N ATOM 0 H LYS B 29 3.663 19.021 -5.884 1.00 0.00 H new ATOM 0 HA LYS B 29 4.770 18.847 -3.170 1.00 0.00 H new ATOM 0 HB2 LYS B 29 2.538 19.528 -2.274 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.502 20.827 -2.949 1.00 0.00 H new ATOM 0 HG2 LYS B 29 2.172 20.611 -5.084 1.00 0.00 H new ATOM 0 HG3 LYS B 29 1.144 19.449 -4.269 1.00 0.00 H new ATOM 0 HD2 LYS B 29 0.505 21.136 -2.594 1.00 0.00 H new ATOM 0 HD3 LYS B 29 1.604 22.299 -3.309 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -0.691 22.711 -4.083 1.00 0.00 H new ATOM 0 HE3 LYS B 29 0.331 22.243 -5.428 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -1.891 21.156 -5.332 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -0.580 20.082 -5.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -1.367 20.310 -3.956 1.00 0.00 H new ATOM 1278 N THR B 30 3.730 16.654 -2.945 1.00 0.00 N ATOM 1279 CA THR B 30 3.339 15.254 -2.860 1.00 0.00 C ATOM 1280 C THR B 30 1.841 15.046 -2.541 1.00 0.00 C ATOM 1281 O THR B 30 1.137 15.985 -2.109 1.00 0.00 O ATOM 1282 CB THR B 30 4.211 14.570 -1.805 1.00 0.00 C ATOM 1283 OG1 THR B 30 4.336 15.454 -0.665 1.00 0.00 O ATOM 1284 CG2 THR B 30 5.590 14.261 -2.366 1.00 0.00 C ATOM 0 H THR B 30 4.371 16.938 -2.204 1.00 0.00 H new ATOM 0 HA THR B 30 3.492 14.808 -3.843 1.00 0.00 H new ATOM 0 HB THR B 30 3.745 13.631 -1.507 1.00 0.00 H new ATOM 0 HG1 THR B 30 4.891 15.027 0.020 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.194 13.775 -1.600 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.493 13.598 -3.226 1.00 0.00 H new ATOM 0 HG23 THR B 30 6.073 15.188 -2.675 1.00 0.00 H new ATOM 1292 N ALA B 31 1.376 13.821 -2.732 1.00 0.00 N ATOM 1293 CA ALA B 31 -0.012 13.455 -2.533 1.00 0.00 C ATOM 1294 C ALA B 31 -0.084 12.153 -1.726 1.00 0.00 C ATOM 1295 O ALA B 31 0.878 11.824 -1.014 1.00 0.00 O ATOM 1296 CB ALA B 31 -0.685 13.290 -3.896 1.00 0.00 C ATOM 0 H ALA B 31 1.964 13.044 -3.034 1.00 0.00 H new ATOM 0 HA ALA B 31 -0.533 14.234 -1.977 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -1.730 13.014 -3.755 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -0.629 14.229 -4.446 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -0.177 12.508 -4.460 1.00 0.00 H new ATOM 1302 N SER B 32 -1.233 11.448 -1.818 1.00 0.00 N ATOM 1303 CA SER B 32 -1.486 10.166 -1.140 1.00 0.00 C ATOM 1304 C SER B 32 -1.746 10.360 0.370 1.00 0.00 C ATOM 1305 O SER B 32 -1.484 11.443 0.915 1.00 0.00 O ATOM 1306 CB SER B 32 -0.357 9.168 -1.440 1.00 0.00 C ATOM 1307 OG SER B 32 -0.215 9.008 -2.855 1.00 0.00 O ATOM 0 H SER B 32 -2.024 11.764 -2.378 1.00 0.00 H new ATOM 0 HA SER B 32 -2.404 9.735 -1.540 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.579 9.523 -1.009 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.576 8.206 -0.976 1.00 0.00 H new ATOM 0 HG SER B 32 0.719 8.800 -3.069 1.00 0.00 H new ATOM 1313 N GLU B 33 -2.307 9.353 1.033 1.00 0.00 N ATOM 1314 CA GLU B 33 -2.630 9.502 2.440 1.00 0.00 C ATOM 1315 C GLU B 33 -1.609 8.891 3.415 1.00 0.00 C ATOM 1316 O GLU B 33 -1.258 9.534 4.404 1.00 0.00 O ATOM 1317 CB GLU B 33 -4.124 9.196 2.775 1.00 0.00 C ATOM 1318 CG GLU B 33 -4.726 7.918 2.177 1.00 0.00 C ATOM 1319 CD GLU B 33 -4.046 6.666 2.629 1.00 0.00 C ATOM 1320 OE1 GLU B 33 -4.287 6.202 3.764 1.00 0.00 O ATOM 1321 OE2 GLU B 33 -3.227 6.130 1.869 1.00 0.00 O ATOM 0 H GLU B 33 -2.541 8.447 0.627 1.00 0.00 H new ATOM 0 HA GLU B 33 -2.522 10.571 2.626 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -4.223 9.142 3.859 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -4.726 10.042 2.442 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -5.781 7.865 2.444 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -4.675 7.977 1.090 1.00 0.00 H new ATOM 1328 N HIS B 34 -1.124 7.681 3.164 1.00 0.00 N ATOM 1329 CA HIS B 34 -0.090 7.128 4.033 1.00 0.00 C ATOM 1330 C HIS B 34 1.082 6.593 3.220 1.00 0.00 C ATOM 1331 O HIS B 34 0.928 5.688 2.395 1.00 0.00 O ATOM 1332 CB HIS B 34 -0.634 6.071 5.065 1.00 0.00 C ATOM 1333 CG HIS B 34 -1.043 4.697 4.543 1.00 0.00 C ATOM 1334 ND1 HIS B 34 -2.240 4.422 3.930 1.00 0.00 N ATOM 1335 CD2 HIS B 34 -0.382 3.509 4.601 1.00 0.00 C ATOM 1336 CE1 HIS B 34 -2.284 3.124 3.640 1.00 0.00 C ATOM 1337 NE2 HIS B 34 -1.176 2.511 4.028 1.00 0.00 N ATOM 0 H HIS B 34 -1.417 7.080 2.393 1.00 0.00 H new ATOM 0 HA HIS B 34 0.276 7.955 4.641 1.00 0.00 H new ATOM 0 HB2 HIS B 34 0.133 5.923 5.826 1.00 0.00 H new ATOM 0 HB3 HIS B 34 -1.499 6.508 5.565 1.00 0.00 H new ATOM 0 HD1 HIS B 34 -2.975 5.101 3.730 1.00 0.00 H new ATOM 0 HD2 HIS B 34 0.601 3.360 5.023 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -3.114 2.635 3.152 1.00 0.00 H new ATOM 1345 N ARG B 35 2.239 7.172 3.421 1.00 0.00 N ATOM 1346 CA ARG B 35 3.429 6.735 2.740 1.00 0.00 C ATOM 1347 C ARG B 35 4.559 6.719 3.739 1.00 0.00 C ATOM 1348 O ARG B 35 4.547 7.479 4.698 1.00 0.00 O ATOM 1349 CB ARG B 35 3.810 7.663 1.550 1.00 0.00 C ATOM 1350 CG ARG B 35 4.344 9.046 1.956 1.00 0.00 C ATOM 1351 CD ARG B 35 4.896 9.817 0.762 1.00 0.00 C ATOM 1352 NE ARG B 35 5.597 11.046 1.181 1.00 0.00 N ATOM 1353 CZ ARG B 35 6.524 11.705 0.453 1.00 0.00 C ATOM 1354 NH1 ARG B 35 6.887 11.270 -0.746 1.00 0.00 N ATOM 1355 NH2 ARG B 35 7.092 12.799 0.945 1.00 0.00 N ATOM 0 H ARG B 35 2.381 7.956 4.058 1.00 0.00 H new ATOM 0 HA ARG B 35 3.243 5.744 2.327 1.00 0.00 H new ATOM 0 HB2 ARG B 35 4.564 7.162 0.944 1.00 0.00 H new ATOM 0 HB3 ARG B 35 2.932 7.799 0.918 1.00 0.00 H new ATOM 0 HG2 ARG B 35 3.544 9.622 2.421 1.00 0.00 H new ATOM 0 HG3 ARG B 35 5.127 8.927 2.705 1.00 0.00 H new ATOM 0 HD2 ARG B 35 5.582 9.180 0.203 1.00 0.00 H new ATOM 0 HD3 ARG B 35 4.080 10.076 0.087 1.00 0.00 H new ATOM 0 HE ARG B 35 5.362 11.430 2.096 1.00 0.00 H new ATOM 0 HH11 ARG B 35 6.464 10.426 -1.132 1.00 0.00 H new ATOM 0 HH12 ARG B 35 7.589 11.780 -1.283 1.00 0.00 H new ATOM 0 HH21 ARG B 35 6.828 13.139 1.870 1.00 0.00 H new ATOM 0 HH22 ARG B 35 7.793 13.300 0.398 1.00 0.00 H new ATOM 1369 N LYS B 36 5.511 5.860 3.540 1.00 0.00 N ATOM 1370 CA LYS B 36 6.666 5.854 4.385 1.00 0.00 C ATOM 1371 C LYS B 36 7.894 5.646 3.544 1.00 0.00 C ATOM 1372 O LYS B 36 8.501 4.571 3.508 1.00 0.00 O ATOM 1373 CB LYS B 36 6.542 4.860 5.534 1.00 0.00 C ATOM 1374 CG LYS B 36 7.675 4.926 6.565 1.00 0.00 C ATOM 1375 CD LYS B 36 7.868 6.339 7.147 1.00 0.00 C ATOM 1376 CE LYS B 36 6.608 6.901 7.815 1.00 0.00 C ATOM 1377 NZ LYS B 36 6.835 8.261 8.361 1.00 0.00 N ATOM 0 H LYS B 36 5.512 5.156 2.802 1.00 0.00 H new ATOM 0 HA LYS B 36 6.754 6.824 4.874 1.00 0.00 H new ATOM 0 HB2 LYS B 36 5.594 5.032 6.044 1.00 0.00 H new ATOM 0 HB3 LYS B 36 6.503 3.852 5.121 1.00 0.00 H new ATOM 0 HG2 LYS B 36 7.464 4.229 7.376 1.00 0.00 H new ATOM 0 HG3 LYS B 36 8.605 4.600 6.099 1.00 0.00 H new ATOM 0 HD2 LYS B 36 8.677 6.316 7.877 1.00 0.00 H new ATOM 0 HD3 LYS B 36 8.178 7.013 6.349 1.00 0.00 H new ATOM 0 HE2 LYS B 36 5.795 6.931 7.090 1.00 0.00 H new ATOM 0 HE3 LYS B 36 6.294 6.234 8.618 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 5.961 8.607 8.805 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 7.594 8.228 9.071 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 7.110 8.903 7.590 1.00 0.00 H new ATOM 1391 N SER B 37 8.141 6.665 2.795 1.00 0.00 N ATOM 1392 CA SER B 37 9.226 6.816 1.864 1.00 0.00 C ATOM 1393 C SER B 37 9.322 8.290 1.558 1.00 0.00 C ATOM 1394 O SER B 37 8.364 9.034 1.805 1.00 0.00 O ATOM 1395 CB SER B 37 8.946 6.062 0.550 1.00 0.00 C ATOM 1396 OG SER B 37 8.874 4.667 0.747 1.00 0.00 O ATOM 0 H SER B 37 7.541 7.490 2.814 1.00 0.00 H new ATOM 0 HA SER B 37 10.144 6.414 2.293 1.00 0.00 H new ATOM 0 HB2 SER B 37 8.009 6.417 0.121 1.00 0.00 H new ATOM 0 HB3 SER B 37 9.732 6.286 -0.171 1.00 0.00 H new ATOM 0 HG SER B 37 8.773 4.219 -0.119 1.00 0.00 H new ATOM 1402 N SER B 38 10.446 8.709 1.079 1.00 0.00 N ATOM 1403 CA SER B 38 10.644 10.084 0.681 1.00 0.00 C ATOM 1404 C SER B 38 10.546 10.201 -0.808 1.00 0.00 C ATOM 1405 O SER B 38 10.173 11.229 -1.368 1.00 0.00 O ATOM 1406 CB SER B 38 12.029 10.494 1.102 1.00 0.00 C ATOM 1407 OG SER B 38 12.171 10.381 2.523 1.00 0.00 O ATOM 0 H SER B 38 11.263 8.113 0.948 1.00 0.00 H new ATOM 0 HA SER B 38 9.887 10.717 1.144 1.00 0.00 H new ATOM 0 HB2 SER B 38 12.768 9.866 0.605 1.00 0.00 H new ATOM 0 HB3 SER B 38 12.222 11.521 0.791 1.00 0.00 H new ATOM 0 HG SER B 38 13.077 10.649 2.784 1.00 0.00 H new ATOM 1413 N LYS B 39 10.852 9.137 -1.411 1.00 0.00 N ATOM 1414 CA LYS B 39 11.038 9.036 -2.758 1.00 0.00 C ATOM 1415 C LYS B 39 9.780 8.491 -3.430 1.00 0.00 C ATOM 1416 O LYS B 39 9.333 7.374 -3.111 1.00 0.00 O ATOM 1417 CB LYS B 39 12.117 8.072 -2.804 1.00 0.00 C ATOM 1418 CG LYS B 39 12.707 7.675 -4.062 1.00 0.00 C ATOM 1419 CD LYS B 39 13.773 8.612 -4.660 1.00 0.00 C ATOM 1420 CE LYS B 39 13.259 9.964 -5.117 1.00 0.00 C ATOM 1421 NZ LYS B 39 14.320 10.763 -5.765 1.00 0.00 N ATOM 0 H LYS B 39 10.986 8.251 -0.923 1.00 0.00 H new ATOM 0 HA LYS B 39 11.251 9.975 -3.269 1.00 0.00 H new ATOM 0 HB2 LYS B 39 12.922 8.465 -2.183 1.00 0.00 H new ATOM 0 HB3 LYS B 39 11.755 7.165 -2.320 1.00 0.00 H new ATOM 0 HG2 LYS B 39 13.157 6.691 -3.930 1.00 0.00 H new ATOM 0 HG3 LYS B 39 11.905 7.564 -4.792 1.00 0.00 H new ATOM 0 HD2 LYS B 39 14.554 8.770 -3.916 1.00 0.00 H new ATOM 0 HD3 LYS B 39 14.239 8.112 -5.509 1.00 0.00 H new ATOM 0 HE2 LYS B 39 12.433 9.822 -5.814 1.00 0.00 H new ATOM 0 HE3 LYS B 39 12.863 10.511 -4.261 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 13.931 11.680 -6.064 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 15.097 10.920 -5.092 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 14.680 10.253 -6.596 1.00 0.00 H new ATOM 1435 N PRO B 40 9.233 9.257 -4.384 1.00 0.00 N ATOM 1436 CA PRO B 40 8.005 8.912 -5.109 1.00 0.00 C ATOM 1437 C PRO B 40 8.081 7.565 -5.831 1.00 0.00 C ATOM 1438 O PRO B 40 7.075 6.912 -6.022 1.00 0.00 O ATOM 1439 CB PRO B 40 7.831 10.054 -6.126 1.00 0.00 C ATOM 1440 CG PRO B 40 9.139 10.760 -6.150 1.00 0.00 C ATOM 1441 CD PRO B 40 9.755 10.554 -4.806 1.00 0.00 C ATOM 0 HA PRO B 40 7.168 8.807 -4.418 1.00 0.00 H new ATOM 0 HB2 PRO B 40 7.575 9.667 -7.112 1.00 0.00 H new ATOM 0 HB3 PRO B 40 7.026 10.726 -5.829 1.00 0.00 H new ATOM 0 HG2 PRO B 40 9.781 10.362 -6.936 1.00 0.00 H new ATOM 0 HG3 PRO B 40 9.003 11.822 -6.356 1.00 0.00 H new ATOM 0 HD2 PRO B 40 10.844 10.550 -4.860 1.00 0.00 H new ATOM 0 HD3 PRO B 40 9.474 11.345 -4.111 1.00 0.00 H new ATOM 1449 N ILE B 41 9.279 7.132 -6.200 1.00 0.00 N ATOM 1450 CA ILE B 41 9.409 5.861 -6.903 1.00 0.00 C ATOM 1451 C ILE B 41 9.294 4.701 -5.929 1.00 0.00 C ATOM 1452 O ILE B 41 8.599 3.720 -6.197 1.00 0.00 O ATOM 1453 CB ILE B 41 10.707 5.751 -7.771 1.00 0.00 C ATOM 1454 CG1 ILE B 41 10.771 4.402 -8.488 1.00 0.00 C ATOM 1455 CG2 ILE B 41 11.971 6.007 -6.969 1.00 0.00 C ATOM 1456 CD1 ILE B 41 11.993 4.236 -9.351 1.00 0.00 C ATOM 0 H ILE B 41 10.155 7.627 -6.030 1.00 0.00 H new ATOM 0 HA ILE B 41 8.582 5.814 -7.611 1.00 0.00 H new ATOM 0 HB ILE B 41 10.652 6.539 -8.522 1.00 0.00 H new ATOM 0 HG12 ILE B 41 10.749 3.604 -7.746 1.00 0.00 H new ATOM 0 HG13 ILE B 41 9.881 4.286 -9.107 1.00 0.00 H new ATOM 0 HG21 ILE B 41 12.840 5.918 -7.621 1.00 0.00 H new ATOM 0 HG22 ILE B 41 11.936 7.011 -6.546 1.00 0.00 H new ATOM 0 HG23 ILE B 41 12.045 5.276 -6.164 1.00 0.00 H new ATOM 0 HD11 ILE B 41 11.971 3.256 -9.828 1.00 0.00 H new ATOM 0 HD12 ILE B 41 12.006 5.012 -10.116 1.00 0.00 H new ATOM 0 HD13 ILE B 41 12.888 4.319 -8.734 1.00 0.00 H new ATOM 1468 N MET B 42 9.917 4.854 -4.781 1.00 0.00 N ATOM 1469 CA MET B 42 9.894 3.830 -3.740 1.00 0.00 C ATOM 1470 C MET B 42 8.489 3.622 -3.212 1.00 0.00 C ATOM 1471 O MET B 42 8.034 2.480 -3.044 1.00 0.00 O ATOM 1472 CB MET B 42 10.830 4.193 -2.594 1.00 0.00 C ATOM 1473 CG MET B 42 12.290 4.223 -2.988 1.00 0.00 C ATOM 1474 SD MET B 42 12.927 2.606 -3.488 1.00 0.00 S ATOM 1475 CE MET B 42 12.714 1.661 -1.968 1.00 0.00 C ATOM 0 H MET B 42 10.454 5.686 -4.536 1.00 0.00 H new ATOM 0 HA MET B 42 10.239 2.899 -4.190 1.00 0.00 H new ATOM 0 HB2 MET B 42 10.548 5.170 -2.202 1.00 0.00 H new ATOM 0 HB3 MET B 42 10.696 3.475 -1.785 1.00 0.00 H new ATOM 0 HG2 MET B 42 12.424 4.928 -3.808 1.00 0.00 H new ATOM 0 HG3 MET B 42 12.878 4.594 -2.149 1.00 0.00 H new ATOM 0 HE1 MET B 42 13.336 0.767 -2.006 1.00 0.00 H new ATOM 0 HE2 MET B 42 13.009 2.272 -1.115 1.00 0.00 H new ATOM 0 HE3 MET B 42 11.668 1.372 -1.863 1.00 0.00 H new ATOM 1485 N GLU B 43 7.788 4.716 -2.977 1.00 0.00 N ATOM 1486 CA GLU B 43 6.433 4.638 -2.479 1.00 0.00 C ATOM 1487 C GLU B 43 5.503 4.086 -3.554 1.00 0.00 C ATOM 1488 O GLU B 43 4.572 3.358 -3.247 1.00 0.00 O ATOM 1489 CB GLU B 43 5.938 6.002 -1.977 1.00 0.00 C ATOM 1490 CG GLU B 43 5.848 7.059 -3.053 1.00 0.00 C ATOM 1491 CD GLU B 43 5.358 8.375 -2.537 1.00 0.00 C ATOM 1492 OE1 GLU B 43 6.175 9.155 -2.048 1.00 0.00 O ATOM 1493 OE2 GLU B 43 4.133 8.635 -2.612 1.00 0.00 O ATOM 0 H GLU B 43 8.135 5.664 -3.123 1.00 0.00 H new ATOM 0 HA GLU B 43 6.427 3.955 -1.629 1.00 0.00 H new ATOM 0 HB2 GLU B 43 4.955 5.875 -1.524 1.00 0.00 H new ATOM 0 HB3 GLU B 43 6.608 6.353 -1.192 1.00 0.00 H new ATOM 0 HG2 GLU B 43 6.831 7.195 -3.505 1.00 0.00 H new ATOM 0 HG3 GLU B 43 5.180 6.712 -3.841 1.00 0.00 H new ATOM 1500 N LYS B 44 5.816 4.387 -4.813 1.00 0.00 N ATOM 1501 CA LYS B 44 5.002 3.976 -5.946 1.00 0.00 C ATOM 1502 C LYS B 44 5.062 2.481 -6.113 1.00 0.00 C ATOM 1503 O LYS B 44 4.031 1.819 -6.251 1.00 0.00 O ATOM 1504 CB LYS B 44 5.510 4.632 -7.206 1.00 0.00 C ATOM 1505 CG LYS B 44 4.675 4.330 -8.418 1.00 0.00 C ATOM 1506 CD LYS B 44 5.212 5.026 -9.632 1.00 0.00 C ATOM 1507 CE LYS B 44 6.589 4.513 -10.025 1.00 0.00 C ATOM 1508 NZ LYS B 44 7.059 5.110 -11.284 1.00 0.00 N ATOM 0 H LYS B 44 6.644 4.924 -5.072 1.00 0.00 H new ATOM 0 HA LYS B 44 3.971 4.279 -5.762 1.00 0.00 H new ATOM 0 HB2 LYS B 44 5.542 5.711 -7.057 1.00 0.00 H new ATOM 0 HB3 LYS B 44 6.534 4.305 -7.389 1.00 0.00 H new ATOM 0 HG2 LYS B 44 4.656 3.254 -8.591 1.00 0.00 H new ATOM 0 HG3 LYS B 44 3.646 4.643 -8.241 1.00 0.00 H new ATOM 0 HD2 LYS B 44 4.522 4.885 -10.464 1.00 0.00 H new ATOM 0 HD3 LYS B 44 5.266 6.098 -9.440 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.300 4.737 -9.230 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.556 3.428 -10.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 8.001 4.734 -11.516 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.394 4.876 -12.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 7.115 6.143 -11.179 1.00 0.00 H new ATOM 1522 N ARG B 45 6.282 1.966 -6.087 1.00 0.00 N ATOM 1523 CA ARG B 45 6.554 0.541 -6.205 1.00 0.00 C ATOM 1524 C ARG B 45 5.824 -0.221 -5.129 1.00 0.00 C ATOM 1525 O ARG B 45 5.186 -1.241 -5.397 1.00 0.00 O ATOM 1526 CB ARG B 45 8.041 0.293 -6.077 1.00 0.00 C ATOM 1527 CG ARG B 45 8.863 0.798 -7.239 1.00 0.00 C ATOM 1528 CD ARG B 45 10.320 0.751 -6.890 1.00 0.00 C ATOM 1529 NE ARG B 45 11.186 0.952 -8.041 1.00 0.00 N ATOM 1530 CZ ARG B 45 12.519 0.843 -8.017 1.00 0.00 C ATOM 1531 NH1 ARG B 45 13.150 0.553 -6.872 1.00 0.00 N ATOM 1532 NH2 ARG B 45 13.211 1.012 -9.143 1.00 0.00 N ATOM 0 H ARG B 45 7.123 2.534 -5.982 1.00 0.00 H new ATOM 0 HA ARG B 45 6.209 0.198 -7.180 1.00 0.00 H new ATOM 0 HB2 ARG B 45 8.398 0.767 -5.163 1.00 0.00 H new ATOM 0 HB3 ARG B 45 8.210 -0.778 -5.968 1.00 0.00 H new ATOM 0 HG2 ARG B 45 8.672 0.190 -8.123 1.00 0.00 H new ATOM 0 HG3 ARG B 45 8.572 1.819 -7.486 1.00 0.00 H new ATOM 0 HD2 ARG B 45 10.534 1.515 -6.143 1.00 0.00 H new ATOM 0 HD3 ARG B 45 10.548 -0.213 -6.434 1.00 0.00 H new ATOM 0 HE ARG B 45 10.746 1.193 -8.929 1.00 0.00 H new ATOM 0 HH11 ARG B 45 12.614 0.415 -6.015 1.00 0.00 H new ATOM 0 HH12 ARG B 45 14.167 0.470 -6.857 1.00 0.00 H new ATOM 0 HH21 ARG B 45 12.724 1.223 -10.014 1.00 0.00 H new ATOM 0 HH22 ARG B 45 14.228 0.931 -9.134 1.00 0.00 H new ATOM 1546 N ARG B 46 5.898 0.300 -3.914 1.00 0.00 N ATOM 1547 CA ARG B 46 5.229 -0.306 -2.794 1.00 0.00 C ATOM 1548 C ARG B 46 3.734 -0.283 -3.013 1.00 0.00 C ATOM 1549 O ARG B 46 3.100 -1.303 -2.952 1.00 0.00 O ATOM 1550 CB ARG B 46 5.560 0.418 -1.502 1.00 0.00 C ATOM 1551 CG ARG B 46 4.920 -0.220 -0.275 1.00 0.00 C ATOM 1552 CD ARG B 46 5.279 0.534 0.981 1.00 0.00 C ATOM 1553 NE ARG B 46 6.713 0.460 1.261 1.00 0.00 N ATOM 1554 CZ ARG B 46 7.546 1.487 1.349 1.00 0.00 C ATOM 1555 NH1 ARG B 46 7.116 2.724 1.134 1.00 0.00 N ATOM 1556 NH2 ARG B 46 8.815 1.255 1.624 1.00 0.00 N ATOM 0 H ARG B 46 6.420 1.146 -3.687 1.00 0.00 H new ATOM 0 HA ARG B 46 5.574 -1.337 -2.713 1.00 0.00 H new ATOM 0 HB2 ARG B 46 6.642 0.437 -1.371 1.00 0.00 H new ATOM 0 HB3 ARG B 46 5.230 1.454 -1.579 1.00 0.00 H new ATOM 0 HG2 ARG B 46 3.837 -0.238 -0.394 1.00 0.00 H new ATOM 0 HG3 ARG B 46 5.248 -1.256 -0.187 1.00 0.00 H new ATOM 0 HD2 ARG B 46 4.981 1.577 0.878 1.00 0.00 H new ATOM 0 HD3 ARG B 46 4.721 0.125 1.824 1.00 0.00 H new ATOM 0 HE ARG B 46 7.109 -0.469 1.402 1.00 0.00 H new ATOM 0 HH11 ARG B 46 6.137 2.890 0.899 1.00 0.00 H new ATOM 0 HH12 ARG B 46 7.764 3.509 1.204 1.00 0.00 H new ATOM 0 HH21 ARG B 46 9.140 0.298 1.765 1.00 0.00 H new ATOM 0 HH22 ARG B 46 9.472 2.032 1.696 1.00 0.00 H new ATOM 1570 N ARG B 47 3.213 0.898 -3.288 1.00 0.00 N ATOM 1571 CA ARG B 47 1.793 1.150 -3.505 1.00 0.00 C ATOM 1572 C ARG B 47 1.201 0.207 -4.544 1.00 0.00 C ATOM 1573 O ARG B 47 0.207 -0.474 -4.273 1.00 0.00 O ATOM 1574 CB ARG B 47 1.623 2.597 -3.932 1.00 0.00 C ATOM 1575 CG ARG B 47 0.201 3.074 -4.116 1.00 0.00 C ATOM 1576 CD ARG B 47 0.210 4.561 -4.403 1.00 0.00 C ATOM 1577 NE ARG B 47 0.830 5.303 -3.294 1.00 0.00 N ATOM 1578 CZ ARG B 47 1.736 6.284 -3.420 1.00 0.00 C ATOM 1579 NH1 ARG B 47 2.139 6.696 -4.623 1.00 0.00 N ATOM 1580 NH2 ARG B 47 2.231 6.851 -2.336 1.00 0.00 N ATOM 0 H ARG B 47 3.783 1.740 -3.370 1.00 0.00 H new ATOM 0 HA ARG B 47 1.254 0.966 -2.576 1.00 0.00 H new ATOM 0 HB2 ARG B 47 2.104 3.233 -3.189 1.00 0.00 H new ATOM 0 HB3 ARG B 47 2.158 2.743 -4.871 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -0.273 2.536 -4.937 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -0.384 2.868 -3.220 1.00 0.00 H new ATOM 0 HD2 ARG B 47 0.756 4.755 -5.326 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -0.810 4.913 -4.556 1.00 0.00 H new ATOM 0 HE ARG B 47 0.546 5.049 -2.348 1.00 0.00 H new ATOM 0 HH11 ARG B 47 1.757 6.264 -5.464 1.00 0.00 H new ATOM 0 HH12 ARG B 47 2.829 7.443 -4.701 1.00 0.00 H new ATOM 0 HH21 ARG B 47 1.924 6.542 -1.414 1.00 0.00 H new ATOM 0 HH22 ARG B 47 2.921 7.598 -2.421 1.00 0.00 H new ATOM 1594 N ALA B 48 1.815 0.149 -5.703 1.00 0.00 N ATOM 1595 CA ALA B 48 1.372 -0.703 -6.770 1.00 0.00 C ATOM 1596 C ALA B 48 1.404 -2.154 -6.335 1.00 0.00 C ATOM 1597 O ALA B 48 0.427 -2.869 -6.510 1.00 0.00 O ATOM 1598 CB ALA B 48 2.222 -0.492 -8.006 1.00 0.00 C ATOM 0 H ALA B 48 2.644 0.699 -5.929 1.00 0.00 H new ATOM 0 HA ALA B 48 0.343 -0.443 -7.018 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.872 -1.146 -8.804 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.145 0.547 -8.328 1.00 0.00 H new ATOM 0 HB3 ALA B 48 3.262 -0.724 -7.776 1.00 0.00 H new ATOM 1604 N ARG B 49 2.500 -2.562 -5.700 1.00 0.00 N ATOM 1605 CA ARG B 49 2.649 -3.933 -5.243 1.00 0.00 C ATOM 1606 C ARG B 49 1.583 -4.263 -4.179 1.00 0.00 C ATOM 1607 O ARG B 49 1.087 -5.376 -4.135 1.00 0.00 O ATOM 1608 CB ARG B 49 4.074 -4.187 -4.712 1.00 0.00 C ATOM 1609 CG ARG B 49 4.380 -5.644 -4.362 1.00 0.00 C ATOM 1610 CD ARG B 49 5.766 -5.779 -3.737 1.00 0.00 C ATOM 1611 NE ARG B 49 6.042 -7.149 -3.266 1.00 0.00 N ATOM 1612 CZ ARG B 49 6.760 -7.457 -2.170 1.00 0.00 C ATOM 1613 NH1 ARG B 49 7.319 -6.508 -1.435 1.00 0.00 N ATOM 1614 NH2 ARG B 49 6.945 -8.712 -1.815 1.00 0.00 N ATOM 0 H ARG B 49 3.296 -1.959 -5.492 1.00 0.00 H new ATOM 0 HA ARG B 49 2.495 -4.599 -6.092 1.00 0.00 H new ATOM 0 HB2 ARG B 49 4.791 -3.850 -5.461 1.00 0.00 H new ATOM 0 HB3 ARG B 49 4.230 -3.575 -3.824 1.00 0.00 H new ATOM 0 HG2 ARG B 49 3.627 -6.021 -3.670 1.00 0.00 H new ATOM 0 HG3 ARG B 49 4.322 -6.257 -5.261 1.00 0.00 H new ATOM 0 HD2 ARG B 49 6.521 -5.491 -4.469 1.00 0.00 H new ATOM 0 HD3 ARG B 49 5.853 -5.086 -2.900 1.00 0.00 H new ATOM 0 HE ARG B 49 5.660 -7.921 -3.812 1.00 0.00 H new ATOM 0 HH11 ARG B 49 7.208 -5.528 -1.697 1.00 0.00 H new ATOM 0 HH12 ARG B 49 7.860 -6.757 -0.607 1.00 0.00 H new ATOM 0 HH21 ARG B 49 6.542 -9.465 -2.373 1.00 0.00 H new ATOM 0 HH22 ARG B 49 7.491 -8.931 -0.982 1.00 0.00 H new ATOM 1628 N ILE B 50 1.231 -3.279 -3.337 1.00 0.00 N ATOM 1629 CA ILE B 50 0.167 -3.435 -2.343 1.00 0.00 C ATOM 1630 C ILE B 50 -1.138 -3.765 -3.044 1.00 0.00 C ATOM 1631 O ILE B 50 -1.707 -4.844 -2.847 1.00 0.00 O ATOM 1632 CB ILE B 50 -0.038 -2.136 -1.496 1.00 0.00 C ATOM 1633 CG1 ILE B 50 1.206 -1.820 -0.674 1.00 0.00 C ATOM 1634 CG2 ILE B 50 -1.257 -2.265 -0.577 1.00 0.00 C ATOM 1635 CD1 ILE B 50 1.180 -0.466 -0.015 1.00 0.00 C ATOM 0 H ILE B 50 1.675 -2.361 -3.328 1.00 0.00 H new ATOM 0 HA ILE B 50 0.463 -4.241 -1.672 1.00 0.00 H new ATOM 0 HB ILE B 50 -0.214 -1.314 -2.190 1.00 0.00 H new ATOM 0 HG12 ILE B 50 1.324 -2.584 0.094 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.081 -1.881 -1.321 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -1.376 -1.348 0.000 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -2.150 -2.434 -1.179 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -1.113 -3.105 0.102 1.00 0.00 H new ATOM 0 HD11 ILE B 50 2.100 -0.319 0.550 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.095 0.308 -0.778 1.00 0.00 H new ATOM 0 HD13 ILE B 50 0.326 -0.406 0.660 1.00 0.00 H new ATOM 1647 N ASN B 51 -1.562 -2.858 -3.915 1.00 0.00 N ATOM 1648 CA ASN B 51 -2.832 -2.997 -4.634 1.00 0.00 C ATOM 1649 C ASN B 51 -2.876 -4.277 -5.414 1.00 0.00 C ATOM 1650 O ASN B 51 -3.850 -5.022 -5.342 1.00 0.00 O ATOM 1651 CB ASN B 51 -3.104 -1.818 -5.589 1.00 0.00 C ATOM 1652 CG ASN B 51 -3.376 -0.512 -4.885 1.00 0.00 C ATOM 1653 OD1 ASN B 51 -4.517 -0.194 -4.546 1.00 0.00 O ATOM 1654 ND2 ASN B 51 -2.353 0.261 -4.667 1.00 0.00 N ATOM 0 H ASN B 51 -1.044 -2.010 -4.145 1.00 0.00 H new ATOM 0 HA ASN B 51 -3.609 -3.004 -3.870 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -2.246 -1.692 -6.249 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -3.958 -2.064 -6.220 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -2.483 1.160 -4.203 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -1.421 -0.032 -4.960 1.00 0.00 H new ATOM 1661 N GLU B 52 -1.810 -4.556 -6.119 1.00 0.00 N ATOM 1662 CA GLU B 52 -1.732 -5.739 -6.953 1.00 0.00 C ATOM 1663 C GLU B 52 -1.701 -7.042 -6.154 1.00 0.00 C ATOM 1664 O GLU B 52 -2.292 -8.042 -6.579 1.00 0.00 O ATOM 1665 CB GLU B 52 -0.564 -5.651 -7.925 1.00 0.00 C ATOM 1666 CG GLU B 52 -0.694 -4.490 -8.896 1.00 0.00 C ATOM 1667 CD GLU B 52 -1.997 -4.551 -9.665 1.00 0.00 C ATOM 1668 OE1 GLU B 52 -2.094 -5.336 -10.623 1.00 0.00 O ATOM 1669 OE2 GLU B 52 -2.949 -3.826 -9.319 1.00 0.00 O ATOM 0 H GLU B 52 -0.972 -3.975 -6.135 1.00 0.00 H new ATOM 0 HA GLU B 52 -2.656 -5.766 -7.531 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.364 -5.547 -7.363 1.00 0.00 H new ATOM 0 HB3 GLU B 52 -0.493 -6.583 -8.487 1.00 0.00 H new ATOM 0 HG2 GLU B 52 -0.637 -3.549 -8.349 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.143 -4.503 -9.595 1.00 0.00 H new ATOM 1676 N SER B 53 -1.060 -7.042 -4.992 1.00 0.00 N ATOM 1677 CA SER B 53 -1.014 -8.247 -4.196 1.00 0.00 C ATOM 1678 C SER B 53 -2.361 -8.474 -3.535 1.00 0.00 C ATOM 1679 O SER B 53 -2.837 -9.586 -3.473 1.00 0.00 O ATOM 1680 CB SER B 53 0.109 -8.196 -3.157 1.00 0.00 C ATOM 1681 OG SER B 53 1.366 -7.987 -3.788 1.00 0.00 O ATOM 0 H SER B 53 -0.577 -6.237 -4.592 1.00 0.00 H new ATOM 0 HA SER B 53 -0.796 -9.087 -4.856 1.00 0.00 H new ATOM 0 HB2 SER B 53 -0.084 -7.394 -2.444 1.00 0.00 H new ATOM 0 HB3 SER B 53 0.131 -9.127 -2.591 1.00 0.00 H new ATOM 0 HG SER B 53 1.558 -7.027 -3.824 1.00 0.00 H new ATOM 1687 N LEU B 54 -2.991 -7.389 -3.109 1.00 0.00 N ATOM 1688 CA LEU B 54 -4.288 -7.437 -2.464 1.00 0.00 C ATOM 1689 C LEU B 54 -5.350 -7.860 -3.501 1.00 0.00 C ATOM 1690 O LEU B 54 -6.292 -8.595 -3.192 1.00 0.00 O ATOM 1691 CB LEU B 54 -4.599 -6.035 -1.898 1.00 0.00 C ATOM 1692 CG LEU B 54 -5.439 -5.950 -0.612 1.00 0.00 C ATOM 1693 CD1 LEU B 54 -5.484 -4.517 -0.113 1.00 0.00 C ATOM 1694 CD2 LEU B 54 -6.852 -6.466 -0.814 1.00 0.00 C ATOM 0 H LEU B 54 -2.612 -6.447 -3.203 1.00 0.00 H new ATOM 0 HA LEU B 54 -4.294 -8.161 -1.650 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.651 -5.531 -1.712 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -5.115 -5.468 -2.673 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.958 -6.587 0.131 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -6.081 -4.467 0.798 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -4.471 -4.173 0.098 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.932 -3.880 -0.876 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -7.406 -6.386 0.121 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -7.349 -5.874 -1.582 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -6.817 -7.510 -1.126 1.00 0.00 H new ATOM 1706 N SER B 55 -5.159 -7.422 -4.735 1.00 0.00 N ATOM 1707 CA SER B 55 -6.077 -7.722 -5.800 1.00 0.00 C ATOM 1708 C SER B 55 -6.029 -9.220 -6.131 1.00 0.00 C ATOM 1709 O SER B 55 -7.066 -9.888 -6.175 1.00 0.00 O ATOM 1710 CB SER B 55 -5.758 -6.869 -7.040 1.00 0.00 C ATOM 1711 OG SER B 55 -6.854 -6.827 -7.942 1.00 0.00 O ATOM 0 H SER B 55 -4.363 -6.851 -5.017 1.00 0.00 H new ATOM 0 HA SER B 55 -7.088 -7.477 -5.476 1.00 0.00 H new ATOM 0 HB2 SER B 55 -5.503 -5.856 -6.729 1.00 0.00 H new ATOM 0 HB3 SER B 55 -4.884 -7.277 -7.548 1.00 0.00 H new ATOM 0 HG SER B 55 -6.619 -6.276 -8.717 1.00 0.00 H new ATOM 1717 N GLN B 56 -4.830 -9.767 -6.320 1.00 0.00 N ATOM 1718 CA GLN B 56 -4.706 -11.189 -6.637 1.00 0.00 C ATOM 1719 C GLN B 56 -5.119 -12.030 -5.429 1.00 0.00 C ATOM 1720 O GLN B 56 -5.651 -13.121 -5.576 1.00 0.00 O ATOM 1721 CB GLN B 56 -3.287 -11.546 -7.118 1.00 0.00 C ATOM 1722 CG GLN B 56 -2.199 -11.352 -6.082 1.00 0.00 C ATOM 1723 CD GLN B 56 -0.820 -11.611 -6.629 1.00 0.00 C ATOM 1724 OE1 GLN B 56 -0.319 -12.738 -6.596 1.00 0.00 O ATOM 1725 NE2 GLN B 56 -0.197 -10.586 -7.144 1.00 0.00 N ATOM 0 H GLN B 56 -3.947 -9.260 -6.261 1.00 0.00 H new ATOM 0 HA GLN B 56 -5.380 -11.416 -7.463 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -3.279 -12.587 -7.442 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -3.051 -10.938 -7.991 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -2.247 -10.333 -5.698 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -2.382 -12.019 -5.240 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -0.644 -9.669 -7.153 1.00 0.00 H new ATOM 0 HE22 GLN B 56 0.737 -10.702 -7.537 1.00 0.00 H new ATOM 1734 N LEU B 57 -4.910 -11.470 -4.251 1.00 0.00 N ATOM 1735 CA LEU B 57 -5.279 -12.071 -2.984 1.00 0.00 C ATOM 1736 C LEU B 57 -6.772 -12.410 -2.956 1.00 0.00 C ATOM 1737 O LEU B 57 -7.134 -13.581 -2.850 1.00 0.00 O ATOM 1738 CB LEU B 57 -4.832 -11.114 -1.850 1.00 0.00 C ATOM 1739 CG LEU B 57 -5.224 -11.400 -0.408 1.00 0.00 C ATOM 1740 CD1 LEU B 57 -4.128 -10.899 0.526 1.00 0.00 C ATOM 1741 CD2 LEU B 57 -6.493 -10.653 -0.081 1.00 0.00 C ATOM 0 H LEU B 57 -4.466 -10.558 -4.148 1.00 0.00 H new ATOM 0 HA LEU B 57 -4.771 -13.024 -2.838 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -3.744 -11.058 -1.884 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -5.210 -10.122 -2.097 1.00 0.00 H new ATOM 0 HG LEU B 57 -5.367 -12.473 -0.282 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -4.409 -11.104 1.559 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -3.193 -11.409 0.296 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -3.998 -9.825 0.391 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -6.778 -10.855 0.952 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -6.329 -9.583 -0.210 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -7.290 -10.981 -0.748 1.00 0.00 H new ATOM 1753 N LYS B 58 -7.624 -11.403 -3.144 1.00 0.00 N ATOM 1754 CA LYS B 58 -9.075 -11.626 -3.145 1.00 0.00 C ATOM 1755 C LYS B 58 -9.510 -12.536 -4.296 1.00 0.00 C ATOM 1756 O LYS B 58 -10.455 -13.322 -4.167 1.00 0.00 O ATOM 1757 CB LYS B 58 -9.879 -10.281 -3.086 1.00 0.00 C ATOM 1758 CG LYS B 58 -9.614 -9.237 -4.194 1.00 0.00 C ATOM 1759 CD LYS B 58 -10.288 -9.577 -5.517 1.00 0.00 C ATOM 1760 CE LYS B 58 -9.984 -8.532 -6.581 1.00 0.00 C ATOM 1761 NZ LYS B 58 -10.611 -8.864 -7.875 1.00 0.00 N ATOM 0 H LYS B 58 -7.342 -10.435 -3.296 1.00 0.00 H new ATOM 0 HA LYS B 58 -9.321 -12.160 -2.227 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -10.941 -10.524 -3.102 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -9.674 -9.810 -2.125 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -9.965 -8.262 -3.856 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -8.539 -9.152 -4.353 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -9.949 -10.555 -5.859 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -11.366 -9.646 -5.371 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -10.340 -7.558 -6.245 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -8.905 -8.450 -6.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -10.495 -8.066 -8.532 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -10.156 -9.710 -8.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -11.624 -9.050 -7.732 1.00 0.00 H new ATOM 1775 N THR B 59 -8.768 -12.466 -5.378 1.00 0.00 N ATOM 1776 CA THR B 59 -9.033 -13.241 -6.556 1.00 0.00 C ATOM 1777 C THR B 59 -8.797 -14.744 -6.302 1.00 0.00 C ATOM 1778 O THR B 59 -9.684 -15.557 -6.547 1.00 0.00 O ATOM 1779 CB THR B 59 -8.158 -12.728 -7.710 1.00 0.00 C ATOM 1780 OG1 THR B 59 -8.450 -11.334 -7.907 1.00 0.00 O ATOM 1781 CG2 THR B 59 -8.436 -13.475 -8.999 1.00 0.00 C ATOM 0 H THR B 59 -7.953 -11.858 -5.460 1.00 0.00 H new ATOM 0 HA THR B 59 -10.082 -13.125 -6.827 1.00 0.00 H new ATOM 0 HB THR B 59 -7.111 -12.884 -7.451 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.951 -10.800 -7.254 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.798 -13.084 -9.791 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.229 -14.536 -8.857 1.00 0.00 H new ATOM 0 HG23 THR B 59 -9.482 -13.344 -9.277 1.00 0.00 H new ATOM 1789 N LEU B 60 -7.629 -15.095 -5.772 1.00 0.00 N ATOM 1790 CA LEU B 60 -7.291 -16.496 -5.506 1.00 0.00 C ATOM 1791 C LEU B 60 -8.135 -17.089 -4.386 1.00 0.00 C ATOM 1792 O LEU B 60 -8.464 -18.285 -4.415 1.00 0.00 O ATOM 1793 CB LEU B 60 -5.781 -16.706 -5.239 1.00 0.00 C ATOM 1794 CG LEU B 60 -4.845 -16.835 -6.472 1.00 0.00 C ATOM 1795 CD1 LEU B 60 -5.238 -18.025 -7.328 1.00 0.00 C ATOM 1796 CD2 LEU B 60 -4.809 -15.570 -7.315 1.00 0.00 C ATOM 0 H LEU B 60 -6.898 -14.431 -5.517 1.00 0.00 H new ATOM 0 HA LEU B 60 -7.531 -17.038 -6.421 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -5.427 -15.871 -4.634 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -5.668 -17.607 -4.636 1.00 0.00 H new ATOM 0 HG LEU B 60 -3.839 -16.992 -6.082 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -4.568 -18.094 -8.185 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -5.166 -18.938 -6.737 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -6.263 -17.899 -7.678 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.140 -15.717 -8.163 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -5.812 -15.347 -7.679 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -4.450 -14.739 -6.708 1.00 0.00 H new ATOM 1808 N ILE B 61 -8.498 -16.263 -3.419 1.00 0.00 N ATOM 1809 CA ILE B 61 -9.350 -16.703 -2.327 1.00 0.00 C ATOM 1810 C ILE B 61 -10.723 -17.108 -2.861 1.00 0.00 C ATOM 1811 O ILE B 61 -11.171 -18.258 -2.692 1.00 0.00 O ATOM 1812 CB ILE B 61 -9.490 -15.609 -1.234 1.00 0.00 C ATOM 1813 CG1 ILE B 61 -8.143 -15.360 -0.568 1.00 0.00 C ATOM 1814 CG2 ILE B 61 -10.527 -15.988 -0.191 1.00 0.00 C ATOM 1815 CD1 ILE B 61 -7.557 -16.583 0.095 1.00 0.00 C ATOM 0 H ILE B 61 -8.216 -15.284 -3.368 1.00 0.00 H new ATOM 0 HA ILE B 61 -8.880 -17.570 -1.863 1.00 0.00 H new ATOM 0 HB ILE B 61 -9.828 -14.694 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.441 -14.992 -1.316 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.257 -14.573 0.178 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.596 -15.198 0.557 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.496 -16.118 -0.672 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.233 -16.920 0.292 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -6.599 -16.328 0.547 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.239 -16.940 0.867 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.410 -17.365 -0.650 1.00 0.00 H new ATOM 1827 N LEU B 62 -11.356 -16.198 -3.567 1.00 0.00 N ATOM 1828 CA LEU B 62 -12.654 -16.459 -4.160 1.00 0.00 C ATOM 1829 C LEU B 62 -12.582 -17.504 -5.250 1.00 0.00 C ATOM 1830 O LEU B 62 -13.559 -18.068 -5.599 1.00 0.00 O ATOM 1831 CB LEU B 62 -13.351 -15.185 -4.654 1.00 0.00 C ATOM 1832 CG LEU B 62 -14.376 -14.545 -3.697 1.00 0.00 C ATOM 1833 CD1 LEU B 62 -15.584 -15.457 -3.513 1.00 0.00 C ATOM 1834 CD2 LEU B 62 -13.754 -14.238 -2.353 1.00 0.00 C ATOM 0 H LEU B 62 -10.992 -15.262 -3.747 1.00 0.00 H new ATOM 0 HA LEU B 62 -13.271 -16.863 -3.358 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.585 -14.443 -4.879 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -13.857 -15.415 -5.591 1.00 0.00 H new ATOM 0 HG LEU B 62 -14.704 -13.608 -4.146 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -16.295 -14.986 -2.834 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -16.062 -15.627 -4.478 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -15.260 -16.410 -3.095 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -14.502 -13.788 -1.700 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -13.388 -15.160 -1.902 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -12.924 -13.544 -2.486 1.00 0.00 H new ATOM 1846 N ASP B 63 -11.426 -17.732 -5.776 1.00 0.00 N ATOM 1847 CA ASP B 63 -11.230 -18.732 -6.830 1.00 0.00 C ATOM 1848 C ASP B 63 -11.203 -20.133 -6.273 1.00 0.00 C ATOM 1849 O ASP B 63 -11.601 -21.076 -6.929 1.00 0.00 O ATOM 1850 CB ASP B 63 -9.916 -18.491 -7.486 1.00 0.00 C ATOM 1851 CG ASP B 63 -9.600 -19.423 -8.633 1.00 0.00 C ATOM 1852 OD1 ASP B 63 -10.306 -19.396 -9.649 1.00 0.00 O ATOM 1853 OD2 ASP B 63 -8.623 -20.194 -8.543 1.00 0.00 O ATOM 0 H ASP B 63 -10.574 -17.242 -5.503 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.060 -18.640 -7.531 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -9.892 -17.465 -7.853 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -9.130 -18.580 -6.736 1.00 0.00 H new ATOM 1858 N ALA B 64 -10.713 -20.273 -5.084 1.00 0.00 N ATOM 1859 CA ALA B 64 -10.573 -21.582 -4.502 1.00 0.00 C ATOM 1860 C ALA B 64 -11.865 -22.008 -3.886 1.00 0.00 C ATOM 1861 O ALA B 64 -12.218 -23.192 -3.872 1.00 0.00 O ATOM 1862 CB ALA B 64 -9.480 -21.572 -3.467 1.00 0.00 C ATOM 0 H ALA B 64 -10.401 -19.503 -4.492 1.00 0.00 H new ATOM 0 HA ALA B 64 -10.307 -22.292 -5.285 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -9.382 -22.567 -3.032 1.00 0.00 H new ATOM 0 HB2 ALA B 64 -8.538 -21.286 -3.935 1.00 0.00 H new ATOM 0 HB3 ALA B 64 -9.728 -20.856 -2.683 1.00 0.00 H new ATOM 1868 N LEU B 65 -12.578 -21.043 -3.399 1.00 0.00 N ATOM 1869 CA LEU B 65 -13.791 -21.302 -2.679 1.00 0.00 C ATOM 1870 C LEU B 65 -15.002 -21.047 -3.538 1.00 0.00 C ATOM 1871 O LEU B 65 -15.942 -21.840 -3.532 1.00 0.00 O ATOM 1872 CB LEU B 65 -13.784 -20.391 -1.489 1.00 0.00 C ATOM 1873 CG LEU B 65 -12.603 -20.615 -0.569 1.00 0.00 C ATOM 1874 CD1 LEU B 65 -12.226 -19.335 0.121 1.00 0.00 C ATOM 1875 CD2 LEU B 65 -12.921 -21.709 0.429 1.00 0.00 C ATOM 0 H LEU B 65 -12.340 -20.055 -3.487 1.00 0.00 H new ATOM 0 HA LEU B 65 -13.842 -22.348 -2.375 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -13.777 -19.357 -1.832 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -14.706 -20.534 -0.926 1.00 0.00 H new ATOM 0 HG LEU B 65 -11.746 -20.937 -1.161 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -11.375 -19.513 0.779 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -11.958 -18.585 -0.624 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -13.071 -18.976 0.709 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -12.065 -21.862 1.086 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -13.787 -21.419 1.023 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -13.140 -22.635 -0.103 1.00 0.00 H new ATOM 1887 N LYS B 66 -14.939 -19.975 -4.338 1.00 0.00 N ATOM 1888 CA LYS B 66 -16.015 -19.574 -5.262 1.00 0.00 C ATOM 1889 C LYS B 66 -17.355 -19.525 -4.548 1.00 0.00 C ATOM 1890 O LYS B 66 -18.388 -19.906 -5.104 1.00 0.00 O ATOM 1891 CB LYS B 66 -16.017 -20.535 -6.450 1.00 0.00 C ATOM 1892 CG LYS B 66 -14.764 -20.411 -7.326 1.00 0.00 C ATOM 1893 CD LYS B 66 -14.547 -21.641 -8.178 1.00 0.00 C ATOM 1894 CE LYS B 66 -14.111 -22.821 -7.321 1.00 0.00 C ATOM 1895 NZ LYS B 66 -13.826 -24.019 -8.137 1.00 0.00 N ATOM 0 H LYS B 66 -14.131 -19.353 -4.364 1.00 0.00 H new ATOM 0 HA LYS B 66 -15.837 -18.565 -5.633 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -16.096 -21.558 -6.082 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -16.900 -20.347 -7.061 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -14.856 -19.536 -7.969 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -13.892 -20.250 -6.692 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -15.467 -21.890 -8.707 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -13.790 -21.436 -8.935 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -13.221 -22.548 -6.753 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -14.892 -23.052 -6.597 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -13.532 -24.800 -7.516 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -14.682 -24.295 -8.659 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -13.063 -23.807 -8.811 1.00 0.00 H new ATOM 1909 N LYS B 67 -17.313 -19.005 -3.315 1.00 0.00 N ATOM 1910 CA LYS B 67 -18.474 -18.925 -2.437 1.00 0.00 C ATOM 1911 C LYS B 67 -19.606 -18.189 -3.109 1.00 0.00 C ATOM 1912 O LYS B 67 -20.670 -18.767 -3.377 1.00 0.00 O ATOM 1913 CB LYS B 67 -18.133 -18.208 -1.118 1.00 0.00 C ATOM 1914 CG LYS B 67 -16.977 -18.808 -0.344 1.00 0.00 C ATOM 1915 CD LYS B 67 -16.853 -18.173 1.030 1.00 0.00 C ATOM 1916 CE LYS B 67 -15.675 -18.750 1.780 1.00 0.00 C ATOM 1917 NZ LYS B 67 -15.591 -18.257 3.167 1.00 0.00 N ATOM 0 H LYS B 67 -16.462 -18.626 -2.900 1.00 0.00 H new ATOM 0 HA LYS B 67 -18.778 -19.949 -2.219 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -17.902 -17.166 -1.338 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -19.018 -18.211 -0.481 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -17.124 -19.883 -0.240 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -16.050 -18.665 -0.899 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -16.733 -17.094 0.928 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -17.769 -18.340 1.597 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -15.751 -19.837 1.789 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -14.755 -18.499 1.253 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -14.829 -18.758 3.668 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -15.389 -17.237 3.161 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -16.495 -18.428 3.652 1.00 0.00 H new ATOM 1931 N ASP B 68 -19.369 -16.932 -3.412 1.00 0.00 N ATOM 1932 CA ASP B 68 -20.364 -16.099 -4.011 1.00 0.00 C ATOM 1933 C ASP B 68 -19.711 -14.930 -4.615 1.00 0.00 C ATOM 1934 O ASP B 68 -18.835 -14.310 -3.998 1.00 0.00 O ATOM 1935 CB ASP B 68 -21.318 -15.635 -2.966 1.00 0.00 C ATOM 1936 CG ASP B 68 -22.362 -14.700 -3.451 1.00 0.00 C ATOM 1937 OD1 ASP B 68 -23.280 -15.113 -4.185 1.00 0.00 O ATOM 1938 OD2 ASP B 68 -22.302 -13.540 -3.071 1.00 0.00 O ATOM 0 H ASP B 68 -18.477 -16.467 -3.246 1.00 0.00 H new ATOM 0 HA ASP B 68 -20.901 -16.663 -4.774 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -21.805 -16.505 -2.526 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -20.755 -15.148 -2.170 1.00 0.00 H new ATOM 1943 N SER B 69 -20.109 -14.617 -5.786 1.00 0.00 N ATOM 1944 CA SER B 69 -19.516 -13.550 -6.474 1.00 0.00 C ATOM 1945 C SER B 69 -20.204 -12.201 -6.139 1.00 0.00 C ATOM 1946 O SER B 69 -19.645 -11.125 -6.373 1.00 0.00 O ATOM 1947 CB SER B 69 -19.478 -13.858 -7.958 1.00 0.00 C ATOM 1948 OG SER B 69 -18.843 -15.121 -8.183 1.00 0.00 O ATOM 0 H SER B 69 -20.855 -15.095 -6.292 1.00 0.00 H new ATOM 0 HA SER B 69 -18.485 -13.434 -6.141 1.00 0.00 H new ATOM 0 HB2 SER B 69 -20.491 -13.875 -8.360 1.00 0.00 H new ATOM 0 HB3 SER B 69 -18.939 -13.072 -8.487 1.00 0.00 H new ATOM 0 HG SER B 69 -18.825 -15.311 -9.144 1.00 0.00 H new ATOM 1954 N SER B 70 -21.381 -12.273 -5.553 1.00 0.00 N ATOM 1955 CA SER B 70 -22.130 -11.102 -5.175 1.00 0.00 C ATOM 1956 C SER B 70 -21.419 -10.414 -4.000 1.00 0.00 C ATOM 1957 O SER B 70 -21.208 -9.196 -4.009 1.00 0.00 O ATOM 1958 CB SER B 70 -23.571 -11.512 -4.806 1.00 0.00 C ATOM 1959 OG SER B 70 -24.429 -10.388 -4.647 1.00 0.00 O ATOM 0 H SER B 70 -21.844 -13.153 -5.326 1.00 0.00 H new ATOM 0 HA SER B 70 -22.185 -10.397 -6.004 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.971 -12.164 -5.582 1.00 0.00 H new ATOM 0 HB3 SER B 70 -23.557 -12.089 -3.881 1.00 0.00 H new ATOM 0 HG SER B 70 -25.331 -10.695 -4.416 1.00 0.00 H new ATOM 1965 N ARG B 71 -21.004 -11.209 -3.021 1.00 0.00 N ATOM 1966 CA ARG B 71 -20.263 -10.698 -1.871 1.00 0.00 C ATOM 1967 C ARG B 71 -18.836 -10.383 -2.254 1.00 0.00 C ATOM 1968 O ARG B 71 -18.180 -9.604 -1.610 1.00 0.00 O ATOM 1969 CB ARG B 71 -20.353 -11.644 -0.671 1.00 0.00 C ATOM 1970 CG ARG B 71 -19.840 -13.048 -0.920 1.00 0.00 C ATOM 1971 CD ARG B 71 -18.628 -13.358 -0.069 1.00 0.00 C ATOM 1972 NE ARG B 71 -18.906 -13.213 1.376 1.00 0.00 N ATOM 1973 CZ ARG B 71 -18.125 -12.550 2.258 1.00 0.00 C ATOM 1974 NH1 ARG B 71 -17.029 -11.935 1.847 1.00 0.00 N ATOM 1975 NH2 ARG B 71 -18.455 -12.503 3.536 1.00 0.00 N ATOM 0 H ARG B 71 -21.169 -12.215 -3.000 1.00 0.00 H new ATOM 0 HA ARG B 71 -20.728 -9.764 -1.555 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -19.792 -11.210 0.157 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -21.394 -11.705 -0.353 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -20.630 -13.768 -0.705 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -19.584 -13.161 -1.973 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -18.294 -14.376 -0.272 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -17.811 -12.693 -0.348 1.00 0.00 H new ATOM 0 HE ARG B 71 -19.755 -13.648 1.736 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -16.770 -11.960 0.861 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -16.443 -11.436 2.516 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -19.302 -12.968 3.861 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -17.862 -12.001 4.198 1.00 0.00 H new ATOM 1989 N HIS B 72 -18.374 -10.979 -3.336 1.00 0.00 N ATOM 1990 CA HIS B 72 -17.065 -10.644 -3.896 1.00 0.00 C ATOM 1991 C HIS B 72 -17.130 -9.229 -4.488 1.00 0.00 C ATOM 1992 O HIS B 72 -16.151 -8.487 -4.496 1.00 0.00 O ATOM 1993 CB HIS B 72 -16.664 -11.675 -4.974 1.00 0.00 C ATOM 1994 CG HIS B 72 -15.370 -11.380 -5.693 1.00 0.00 C ATOM 1995 ND1 HIS B 72 -15.297 -11.069 -7.030 1.00 0.00 N ATOM 1996 CD2 HIS B 72 -14.091 -11.365 -5.239 1.00 0.00 C ATOM 1997 CE1 HIS B 72 -14.016 -10.882 -7.345 1.00 0.00 C ATOM 1998 NE2 HIS B 72 -13.237 -11.048 -6.292 1.00 0.00 N ATOM 0 H HIS B 72 -18.881 -11.699 -3.850 1.00 0.00 H new ATOM 0 HA HIS B 72 -16.307 -10.672 -3.113 1.00 0.00 H new ATOM 0 HB2 HIS B 72 -16.585 -12.656 -4.505 1.00 0.00 H new ATOM 0 HB3 HIS B 72 -17.465 -11.737 -5.711 1.00 0.00 H new ATOM 0 HD1 HIS B 72 -16.087 -10.994 -7.671 1.00 0.00 H new ATOM 0 HD2 HIS B 72 -13.785 -11.567 -4.223 1.00 0.00 H new ATOM 0 HE1 HIS B 72 -13.661 -10.628 -8.333 1.00 0.00 H new ATOM 2006 N SER B 73 -18.313 -8.855 -4.919 1.00 0.00 N ATOM 2007 CA SER B 73 -18.559 -7.565 -5.515 1.00 0.00 C ATOM 2008 C SER B 73 -18.978 -6.535 -4.445 1.00 0.00 C ATOM 2009 O SER B 73 -19.525 -5.476 -4.754 1.00 0.00 O ATOM 2010 CB SER B 73 -19.627 -7.719 -6.588 1.00 0.00 C ATOM 2011 OG SER B 73 -19.235 -8.706 -7.542 1.00 0.00 O ATOM 0 H SER B 73 -19.142 -9.447 -4.864 1.00 0.00 H new ATOM 0 HA SER B 73 -17.643 -7.191 -5.973 1.00 0.00 H new ATOM 0 HB2 SER B 73 -20.574 -8.003 -6.129 1.00 0.00 H new ATOM 0 HB3 SER B 73 -19.789 -6.764 -7.089 1.00 0.00 H new ATOM 0 HG SER B 73 -19.365 -9.599 -7.161 1.00 0.00 H new ATOM 2017 N LYS B 74 -18.736 -6.875 -3.199 1.00 0.00 N ATOM 2018 CA LYS B 74 -18.941 -6.000 -2.070 1.00 0.00 C ATOM 2019 C LYS B 74 -18.019 -6.457 -0.979 1.00 0.00 C ATOM 2020 O LYS B 74 -18.413 -7.102 -0.001 1.00 0.00 O ATOM 2021 CB LYS B 74 -20.423 -5.924 -1.609 1.00 0.00 C ATOM 2022 CG LYS B 74 -20.736 -5.031 -0.368 1.00 0.00 C ATOM 2023 CD LYS B 74 -20.257 -3.565 -0.495 1.00 0.00 C ATOM 2024 CE LYS B 74 -18.829 -3.374 0.038 1.00 0.00 C ATOM 2025 NZ LYS B 74 -18.347 -1.980 -0.068 1.00 0.00 N ATOM 0 H LYS B 74 -18.381 -7.795 -2.937 1.00 0.00 H new ATOM 0 HA LYS B 74 -18.707 -4.975 -2.357 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -21.020 -5.561 -2.446 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -20.762 -6.937 -1.391 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -21.812 -5.035 -0.196 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -20.271 -5.477 0.511 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -20.297 -3.261 -1.541 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -20.938 -2.913 0.053 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -18.794 -3.685 1.082 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.153 -4.028 -0.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -17.975 -1.670 0.852 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -17.593 -1.927 -0.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -19.134 -1.361 -0.349 1.00 0.00 H new ATOM 2039 N LEU B 75 -16.781 -6.201 -1.203 1.00 0.00 N ATOM 2040 CA LEU B 75 -15.770 -6.584 -0.321 1.00 0.00 C ATOM 2041 C LEU B 75 -15.066 -5.406 0.249 1.00 0.00 C ATOM 2042 O LEU B 75 -14.480 -4.592 -0.466 1.00 0.00 O ATOM 2043 CB LEU B 75 -14.800 -7.534 -0.986 1.00 0.00 C ATOM 2044 CG LEU B 75 -15.223 -8.991 -1.046 1.00 0.00 C ATOM 2045 CD1 LEU B 75 -14.193 -9.829 -1.778 1.00 0.00 C ATOM 2046 CD2 LEU B 75 -15.449 -9.535 0.355 1.00 0.00 C ATOM 0 H LEU B 75 -16.447 -5.706 -2.030 1.00 0.00 H new ATOM 0 HA LEU B 75 -16.241 -7.113 0.508 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -14.623 -7.186 -2.004 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -13.847 -7.475 -0.459 1.00 0.00 H new ATOM 0 HG LEU B 75 -16.160 -9.048 -1.600 1.00 0.00 H new ATOM 0 HD11 LEU B 75 -14.522 -10.868 -1.806 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -14.079 -9.457 -2.796 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -13.237 -9.765 -1.259 1.00 0.00 H new ATOM 0 HD21 LEU B 75 -15.752 -10.580 0.295 1.00 0.00 H new ATOM 0 HD22 LEU B 75 -14.526 -9.457 0.929 1.00 0.00 H new ATOM 0 HD23 LEU B 75 -16.232 -8.958 0.847 1.00 0.00 H new ATOM 2058 N GLU B 76 -15.171 -5.305 1.523 1.00 0.00 N ATOM 2059 CA GLU B 76 -14.493 -4.304 2.287 1.00 0.00 C ATOM 2060 C GLU B 76 -13.086 -4.790 2.482 1.00 0.00 C ATOM 2061 O GLU B 76 -12.879 -5.996 2.501 1.00 0.00 O ATOM 2062 CB GLU B 76 -15.179 -4.183 3.639 1.00 0.00 C ATOM 2063 CG GLU B 76 -16.623 -3.755 3.540 1.00 0.00 C ATOM 2064 CD GLU B 76 -16.752 -2.309 3.179 1.00 0.00 C ATOM 2065 OE1 GLU B 76 -16.641 -1.955 1.989 1.00 0.00 O ATOM 2066 OE2 GLU B 76 -16.955 -1.488 4.098 1.00 0.00 O ATOM 0 H GLU B 76 -15.746 -5.931 2.087 1.00 0.00 H new ATOM 0 HA GLU B 76 -14.505 -3.334 1.789 1.00 0.00 H new ATOM 0 HB2 GLU B 76 -15.126 -5.143 4.153 1.00 0.00 H new ATOM 0 HB3 GLU B 76 -14.635 -3.464 4.251 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -17.131 -4.363 2.792 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -17.122 -3.938 4.492 1.00 0.00 H new ATOM 2073 N LYS B 77 -12.123 -3.894 2.630 1.00 0.00 N ATOM 2074 CA LYS B 77 -10.730 -4.307 2.860 1.00 0.00 C ATOM 2075 C LYS B 77 -10.626 -5.281 4.031 1.00 0.00 C ATOM 2076 O LYS B 77 -9.951 -6.305 3.954 1.00 0.00 O ATOM 2077 CB LYS B 77 -9.833 -3.096 3.077 1.00 0.00 C ATOM 2078 CG LYS B 77 -8.423 -3.462 3.518 1.00 0.00 C ATOM 2079 CD LYS B 77 -7.436 -2.313 3.382 1.00 0.00 C ATOM 2080 CE LYS B 77 -7.318 -1.822 1.944 1.00 0.00 C ATOM 2081 NZ LYS B 77 -6.289 -0.788 1.813 1.00 0.00 N ATOM 0 H LYS B 77 -12.268 -2.885 2.597 1.00 0.00 H new ATOM 0 HA LYS B 77 -10.386 -4.827 1.966 1.00 0.00 H new ATOM 0 HB2 LYS B 77 -9.779 -2.522 2.152 1.00 0.00 H new ATOM 0 HB3 LYS B 77 -10.285 -2.448 3.828 1.00 0.00 H new ATOM 0 HG2 LYS B 77 -8.448 -3.790 4.557 1.00 0.00 H new ATOM 0 HG3 LYS B 77 -8.072 -4.307 2.925 1.00 0.00 H new ATOM 0 HD2 LYS B 77 -7.751 -1.488 4.021 1.00 0.00 H new ATOM 0 HD3 LYS B 77 -6.456 -2.634 3.736 1.00 0.00 H new ATOM 0 HE2 LYS B 77 -7.078 -2.661 1.291 1.00 0.00 H new ATOM 0 HE3 LYS B 77 -8.278 -1.425 1.614 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 -6.199 -0.512 0.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 -6.557 0.042 2.379 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 -5.379 -1.159 2.153 1.00 0.00 H new ATOM 2095 N ALA B 78 -11.349 -4.962 5.067 1.00 0.00 N ATOM 2096 CA ALA B 78 -11.451 -5.769 6.268 1.00 0.00 C ATOM 2097 C ALA B 78 -11.978 -7.169 5.960 1.00 0.00 C ATOM 2098 O ALA B 78 -11.529 -8.147 6.530 1.00 0.00 O ATOM 2099 CB ALA B 78 -12.403 -5.092 7.220 1.00 0.00 C ATOM 0 H ALA B 78 -11.904 -4.108 5.108 1.00 0.00 H new ATOM 0 HA ALA B 78 -10.457 -5.867 6.704 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.492 -5.686 8.130 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.025 -4.101 7.469 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -13.382 -4.999 6.751 1.00 0.00 H new ATOM 2105 N ASP B 79 -12.877 -7.237 5.000 1.00 0.00 N ATOM 2106 CA ASP B 79 -13.587 -8.477 4.669 1.00 0.00 C ATOM 2107 C ASP B 79 -12.678 -9.344 3.843 1.00 0.00 C ATOM 2108 O ASP B 79 -12.584 -10.545 4.031 1.00 0.00 O ATOM 2109 CB ASP B 79 -14.861 -8.158 3.871 1.00 0.00 C ATOM 2110 CG ASP B 79 -15.904 -9.264 3.964 1.00 0.00 C ATOM 2111 OD1 ASP B 79 -15.683 -10.370 3.458 1.00 0.00 O ATOM 2112 OD2 ASP B 79 -16.982 -9.030 4.572 1.00 0.00 O ATOM 0 H ASP B 79 -13.143 -6.440 4.421 1.00 0.00 H new ATOM 0 HA ASP B 79 -13.869 -8.995 5.586 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.291 -7.226 4.238 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -14.599 -7.998 2.825 1.00 0.00 H new ATOM 2117 N ILE B 80 -11.970 -8.691 2.963 1.00 0.00 N ATOM 2118 CA ILE B 80 -11.017 -9.310 2.072 1.00 0.00 C ATOM 2119 C ILE B 80 -9.872 -9.941 2.849 1.00 0.00 C ATOM 2120 O ILE B 80 -9.564 -11.124 2.653 1.00 0.00 O ATOM 2121 CB ILE B 80 -10.476 -8.260 1.091 1.00 0.00 C ATOM 2122 CG1 ILE B 80 -11.624 -7.713 0.276 1.00 0.00 C ATOM 2123 CG2 ILE B 80 -9.430 -8.866 0.189 1.00 0.00 C ATOM 2124 CD1 ILE B 80 -11.322 -6.446 -0.468 1.00 0.00 C ATOM 0 H ILE B 80 -12.040 -7.681 2.839 1.00 0.00 H new ATOM 0 HA ILE B 80 -11.522 -10.101 1.517 1.00 0.00 H new ATOM 0 HB ILE B 80 -10.007 -7.450 1.649 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -11.936 -8.473 -0.441 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -12.470 -7.535 0.940 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -9.059 -8.107 -0.499 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -8.604 -9.244 0.792 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -9.870 -9.686 -0.379 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -12.205 -6.131 -1.023 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -11.041 -5.666 0.240 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -10.500 -6.619 -1.162 1.00 0.00 H new ATOM 2136 N LEU B 81 -9.260 -9.164 3.740 1.00 0.00 N ATOM 2137 CA LEU B 81 -8.147 -9.655 4.551 1.00 0.00 C ATOM 2138 C LEU B 81 -8.604 -10.863 5.339 1.00 0.00 C ATOM 2139 O LEU B 81 -7.965 -11.916 5.318 1.00 0.00 O ATOM 2140 CB LEU B 81 -7.650 -8.578 5.520 1.00 0.00 C ATOM 2141 CG LEU B 81 -7.171 -7.258 4.915 1.00 0.00 C ATOM 2142 CD1 LEU B 81 -6.727 -6.315 6.017 1.00 0.00 C ATOM 2143 CD2 LEU B 81 -6.042 -7.485 3.914 1.00 0.00 C ATOM 0 H LEU B 81 -9.515 -8.193 3.919 1.00 0.00 H new ATOM 0 HA LEU B 81 -7.326 -9.922 3.886 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -8.456 -8.356 6.220 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -6.830 -9.000 6.102 1.00 0.00 H new ATOM 0 HG LEU B 81 -8.003 -6.806 4.376 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.387 -5.377 5.578 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -7.564 -6.120 6.688 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -5.911 -6.770 6.578 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -5.723 -6.528 3.502 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -5.200 -7.962 4.417 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.394 -8.128 3.108 1.00 0.00 H new ATOM 2155 N GLU B 82 -9.752 -10.713 5.962 1.00 0.00 N ATOM 2156 CA GLU B 82 -10.369 -11.748 6.748 1.00 0.00 C ATOM 2157 C GLU B 82 -10.645 -13.004 5.943 1.00 0.00 C ATOM 2158 O GLU B 82 -10.338 -14.077 6.391 1.00 0.00 O ATOM 2159 CB GLU B 82 -11.637 -11.202 7.405 1.00 0.00 C ATOM 2160 CG GLU B 82 -12.621 -12.204 7.915 1.00 0.00 C ATOM 2161 CD GLU B 82 -13.792 -11.538 8.577 1.00 0.00 C ATOM 2162 OE1 GLU B 82 -13.714 -11.246 9.786 1.00 0.00 O ATOM 2163 OE2 GLU B 82 -14.824 -11.309 7.911 1.00 0.00 O ATOM 0 H GLU B 82 -10.291 -9.848 5.933 1.00 0.00 H new ATOM 0 HA GLU B 82 -9.668 -12.047 7.527 1.00 0.00 H new ATOM 0 HB2 GLU B 82 -11.340 -10.565 8.238 1.00 0.00 H new ATOM 0 HB3 GLU B 82 -12.146 -10.565 6.682 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -12.972 -12.823 7.090 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -12.130 -12.869 8.626 1.00 0.00 H new ATOM 2170 N MET B 83 -11.122 -12.857 4.726 1.00 0.00 N ATOM 2171 CA MET B 83 -11.524 -14.002 3.919 1.00 0.00 C ATOM 2172 C MET B 83 -10.294 -14.805 3.523 1.00 0.00 C ATOM 2173 O MET B 83 -10.332 -16.026 3.402 1.00 0.00 O ATOM 2174 CB MET B 83 -12.309 -13.525 2.685 1.00 0.00 C ATOM 2175 CG MET B 83 -13.008 -14.628 1.890 1.00 0.00 C ATOM 2176 SD MET B 83 -14.131 -15.630 2.887 1.00 0.00 S ATOM 2177 CE MET B 83 -15.218 -14.379 3.569 1.00 0.00 C ATOM 0 H MET B 83 -11.243 -11.954 4.267 1.00 0.00 H new ATOM 0 HA MET B 83 -12.180 -14.651 4.500 1.00 0.00 H new ATOM 0 HB2 MET B 83 -13.058 -12.802 3.008 1.00 0.00 H new ATOM 0 HB3 MET B 83 -11.624 -12.999 2.020 1.00 0.00 H new ATOM 0 HG2 MET B 83 -13.567 -14.176 1.070 1.00 0.00 H new ATOM 0 HG3 MET B 83 -12.255 -15.276 1.443 1.00 0.00 H new ATOM 0 HE1 MET B 83 -16.235 -14.769 3.620 1.00 0.00 H new ATOM 0 HE2 MET B 83 -14.882 -14.111 4.571 1.00 0.00 H new ATOM 0 HE3 MET B 83 -15.200 -13.495 2.932 1.00 0.00 H new ATOM 2187 N THR B 84 -9.202 -14.106 3.408 1.00 0.00 N ATOM 2188 CA THR B 84 -7.938 -14.679 3.061 1.00 0.00 C ATOM 2189 C THR B 84 -7.353 -15.437 4.266 1.00 0.00 C ATOM 2190 O THR B 84 -6.901 -16.585 4.144 1.00 0.00 O ATOM 2191 CB THR B 84 -7.004 -13.555 2.613 1.00 0.00 C ATOM 2192 OG1 THR B 84 -7.715 -12.784 1.648 1.00 0.00 O ATOM 2193 CG2 THR B 84 -5.749 -14.103 1.955 1.00 0.00 C ATOM 0 H THR B 84 -9.167 -13.098 3.557 1.00 0.00 H new ATOM 0 HA THR B 84 -8.058 -15.394 2.247 1.00 0.00 H new ATOM 0 HB THR B 84 -6.703 -12.966 3.480 1.00 0.00 H new ATOM 0 HG1 THR B 84 -8.224 -12.081 2.102 1.00 0.00 H new ATOM 0 HG21 THR B 84 -5.108 -13.276 1.649 1.00 0.00 H new ATOM 0 HG22 THR B 84 -5.213 -14.735 2.663 1.00 0.00 H new ATOM 0 HG23 THR B 84 -6.024 -14.692 1.080 1.00 0.00 H new ATOM 2201 N VAL B 85 -7.412 -14.807 5.427 1.00 0.00 N ATOM 2202 CA VAL B 85 -6.926 -15.403 6.659 1.00 0.00 C ATOM 2203 C VAL B 85 -7.780 -16.618 7.022 1.00 0.00 C ATOM 2204 O VAL B 85 -7.270 -17.665 7.399 1.00 0.00 O ATOM 2205 CB VAL B 85 -6.965 -14.383 7.813 1.00 0.00 C ATOM 2206 CG1 VAL B 85 -6.476 -14.977 9.117 1.00 0.00 C ATOM 2207 CG2 VAL B 85 -6.167 -13.167 7.472 1.00 0.00 C ATOM 0 H VAL B 85 -7.797 -13.870 5.542 1.00 0.00 H new ATOM 0 HA VAL B 85 -5.893 -15.715 6.504 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.008 -14.099 7.950 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -6.522 -14.221 9.901 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -7.107 -15.822 9.391 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -5.447 -15.316 8.999 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -6.208 -12.460 8.301 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -5.131 -13.451 7.289 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -6.579 -12.701 6.577 1.00 0.00 H new ATOM 2217 N LYS B 86 -9.072 -16.481 6.874 1.00 0.00 N ATOM 2218 CA LYS B 86 -9.988 -17.563 7.162 1.00 0.00 C ATOM 2219 C LYS B 86 -9.748 -18.757 6.234 1.00 0.00 C ATOM 2220 O LYS B 86 -9.807 -19.922 6.660 1.00 0.00 O ATOM 2221 CB LYS B 86 -11.441 -17.102 7.113 1.00 0.00 C ATOM 2222 CG LYS B 86 -11.789 -16.013 8.134 1.00 0.00 C ATOM 2223 CD LYS B 86 -13.291 -15.854 8.244 1.00 0.00 C ATOM 2224 CE LYS B 86 -13.709 -15.148 9.528 1.00 0.00 C ATOM 2225 NZ LYS B 86 -13.346 -15.925 10.730 1.00 0.00 N ATOM 0 H LYS B 86 -9.521 -15.623 6.553 1.00 0.00 H new ATOM 0 HA LYS B 86 -9.790 -17.892 8.182 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.659 -16.729 6.112 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.089 -17.962 7.281 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -11.372 -16.271 9.107 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -11.338 -15.067 7.835 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.657 -15.289 7.387 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.761 -16.836 8.203 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -13.235 -14.168 9.573 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -14.786 -14.981 9.516 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -13.956 -15.643 11.523 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -13.473 -16.939 10.539 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -12.352 -15.741 10.975 1.00 0.00 H new ATOM 2239 N HIS B 87 -9.418 -18.464 4.986 1.00 0.00 N ATOM 2240 CA HIS B 87 -9.113 -19.495 4.013 1.00 0.00 C ATOM 2241 C HIS B 87 -7.824 -20.223 4.389 1.00 0.00 C ATOM 2242 O HIS B 87 -7.708 -21.442 4.176 1.00 0.00 O ATOM 2243 CB HIS B 87 -9.012 -18.900 2.602 1.00 0.00 C ATOM 2244 CG HIS B 87 -8.751 -19.905 1.503 1.00 0.00 C ATOM 2245 ND1 HIS B 87 -9.383 -21.061 1.208 1.00 0.00 N flip ATOM 2246 CD2 HIS B 87 -7.801 -19.741 0.524 1.00 0.00 C flip ATOM 2247 CE1 HIS B 87 -8.836 -21.598 0.051 1.00 0.00 C flip ATOM 2248 NE2 HIS B 87 -7.890 -20.762 -0.318 1.00 0.00 N flip ATOM 0 H HIS B 87 -9.355 -17.513 4.624 1.00 0.00 H new ATOM 0 HA HIS B 87 -9.927 -20.219 4.016 1.00 0.00 H new ATOM 0 HB2 HIS B 87 -9.939 -18.373 2.379 1.00 0.00 H new ATOM 0 HB3 HIS B 87 -8.213 -18.158 2.593 1.00 0.00 H new ATOM 0 HD2 HIS B 87 -7.102 -18.921 0.452 1.00 0.00 H new ATOM 0 HE1 HIS B 87 -9.127 -22.513 -0.444 1.00 0.00 H new ATOM 0 HE2 HIS B 87 -7.302 -20.883 -1.143 1.00 0.00 H new ATOM 2256 N LEU B 88 -6.863 -19.502 4.977 1.00 0.00 N ATOM 2257 CA LEU B 88 -5.626 -20.143 5.354 1.00 0.00 C ATOM 2258 C LEU B 88 -5.872 -21.132 6.478 1.00 0.00 C ATOM 2259 O LEU B 88 -5.261 -22.169 6.498 1.00 0.00 O ATOM 2260 CB LEU B 88 -4.441 -19.149 5.628 1.00 0.00 C ATOM 2261 CG LEU B 88 -4.442 -18.281 6.908 1.00 0.00 C ATOM 2262 CD1 LEU B 88 -4.014 -19.075 8.144 1.00 0.00 C ATOM 2263 CD2 LEU B 88 -3.560 -17.060 6.730 1.00 0.00 C ATOM 0 H LEU B 88 -6.925 -18.507 5.191 1.00 0.00 H new ATOM 0 HA LEU B 88 -5.276 -20.705 4.489 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -3.521 -19.734 5.633 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -4.383 -18.471 4.776 1.00 0.00 H new ATOM 0 HG LEU B 88 -5.469 -17.953 7.071 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -4.030 -18.424 9.018 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -4.702 -19.907 8.298 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -3.005 -19.461 7.997 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -3.576 -16.464 7.642 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -2.538 -17.377 6.521 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -3.932 -16.461 5.899 1.00 0.00 H new ATOM 2275 N ARG B 89 -6.841 -20.824 7.386 1.00 0.00 N ATOM 2276 CA ARG B 89 -7.214 -21.788 8.442 1.00 0.00 C ATOM 2277 C ARG B 89 -7.656 -23.076 7.812 1.00 0.00 C ATOM 2278 O ARG B 89 -7.179 -24.141 8.175 1.00 0.00 O ATOM 2279 CB ARG B 89 -8.358 -21.319 9.362 1.00 0.00 C ATOM 2280 CG ARG B 89 -7.989 -20.426 10.535 1.00 0.00 C ATOM 2281 CD ARG B 89 -7.612 -19.034 10.125 1.00 0.00 C ATOM 2282 NE ARG B 89 -7.440 -18.178 11.294 1.00 0.00 N ATOM 2283 CZ ARG B 89 -8.098 -17.037 11.537 1.00 0.00 C ATOM 2284 NH1 ARG B 89 -9.061 -16.629 10.712 1.00 0.00 N ATOM 2285 NH2 ARG B 89 -7.820 -16.337 12.629 1.00 0.00 N ATOM 0 H ARG B 89 -7.358 -19.945 7.404 1.00 0.00 H new ATOM 0 HA ARG B 89 -6.320 -21.900 9.055 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -9.086 -20.787 8.750 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -8.858 -22.204 9.756 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -8.831 -20.378 11.225 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -7.157 -20.875 11.077 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -6.688 -19.058 9.547 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -8.383 -18.620 9.476 1.00 0.00 H new ATOM 0 HE ARG B 89 -6.756 -18.476 11.990 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -9.300 -17.186 9.892 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -9.560 -15.759 10.901 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -7.108 -16.668 13.280 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -8.319 -15.467 12.818 1.00 0.00 H new ATOM 2299 N ASN B 90 -8.552 -22.957 6.830 1.00 0.00 N ATOM 2300 CA ASN B 90 -9.115 -24.108 6.116 1.00 0.00 C ATOM 2301 C ASN B 90 -8.006 -24.963 5.564 1.00 0.00 C ATOM 2302 O ASN B 90 -7.910 -26.161 5.873 1.00 0.00 O ATOM 2303 CB ASN B 90 -9.981 -23.667 4.943 1.00 0.00 C ATOM 2304 CG ASN B 90 -11.137 -22.760 5.309 1.00 0.00 C ATOM 2305 OD1 ASN B 90 -11.515 -21.912 4.388 1.00 0.00 O flip ATOM 2306 ND2 ASN B 90 -11.694 -22.830 6.409 1.00 0.00 N flip ATOM 0 H ASN B 90 -8.909 -22.058 6.506 1.00 0.00 H new ATOM 0 HA ASN B 90 -9.722 -24.664 6.830 1.00 0.00 H new ATOM 0 HB2 ASN B 90 -9.350 -23.153 4.218 1.00 0.00 H new ATOM 0 HB3 ASN B 90 -10.377 -24.554 4.449 1.00 0.00 H new ATOM 0 HD21 ASN B 90 -11.371 -23.505 7.102 1.00 0.00 H new ATOM 0 HD22 ASN B 90 -12.477 -22.213 6.624 1.00 0.00 H new ATOM 2313 N LEU B 91 -7.134 -24.329 4.804 1.00 0.00 N ATOM 2314 CA LEU B 91 -6.018 -24.992 4.169 1.00 0.00 C ATOM 2315 C LEU B 91 -4.974 -25.473 5.179 1.00 0.00 C ATOM 2316 O LEU B 91 -4.141 -26.284 4.855 1.00 0.00 O ATOM 2317 CB LEU B 91 -5.369 -24.071 3.158 1.00 0.00 C ATOM 2318 CG LEU B 91 -6.184 -23.682 1.930 1.00 0.00 C ATOM 2319 CD1 LEU B 91 -5.409 -22.672 1.120 1.00 0.00 C ATOM 2320 CD2 LEU B 91 -6.492 -24.903 1.077 1.00 0.00 C ATOM 0 H LEU B 91 -7.183 -23.329 4.610 1.00 0.00 H new ATOM 0 HA LEU B 91 -6.414 -25.873 3.664 1.00 0.00 H new ATOM 0 HB2 LEU B 91 -5.082 -23.155 3.674 1.00 0.00 H new ATOM 0 HB3 LEU B 91 -4.449 -24.545 2.814 1.00 0.00 H new ATOM 0 HG LEU B 91 -7.129 -23.248 2.256 1.00 0.00 H new ATOM 0 HD11 LEU B 91 -5.987 -22.390 0.240 1.00 0.00 H new ATOM 0 HD12 LEU B 91 -5.218 -21.787 1.728 1.00 0.00 H new ATOM 0 HD13 LEU B 91 -4.460 -23.108 0.806 1.00 0.00 H new ATOM 0 HD21 LEU B 91 -7.074 -24.601 0.206 1.00 0.00 H new ATOM 0 HD22 LEU B 91 -5.560 -25.362 0.748 1.00 0.00 H new ATOM 0 HD23 LEU B 91 -7.063 -25.622 1.664 1.00 0.00 H new ATOM 2332 N GLN B 92 -5.008 -24.954 6.379 1.00 0.00 N ATOM 2333 CA GLN B 92 -4.095 -25.368 7.422 1.00 0.00 C ATOM 2334 C GLN B 92 -4.535 -26.621 8.142 1.00 0.00 C ATOM 2335 O GLN B 92 -3.712 -27.499 8.418 1.00 0.00 O ATOM 2336 CB GLN B 92 -3.837 -24.239 8.415 1.00 0.00 C ATOM 2337 CG GLN B 92 -2.750 -23.285 7.987 1.00 0.00 C ATOM 2338 CD GLN B 92 -1.393 -23.906 8.177 1.00 0.00 C ATOM 2339 OE1 GLN B 92 -1.199 -24.735 9.070 1.00 0.00 O ATOM 2340 NE2 GLN B 92 -0.455 -23.515 7.397 1.00 0.00 N ATOM 0 H GLN B 92 -5.669 -24.231 6.665 1.00 0.00 H new ATOM 0 HA GLN B 92 -3.160 -25.612 6.917 1.00 0.00 H new ATOM 0 HB2 GLN B 92 -4.761 -23.679 8.562 1.00 0.00 H new ATOM 0 HB3 GLN B 92 -3.569 -24.671 9.379 1.00 0.00 H new ATOM 0 HG2 GLN B 92 -2.888 -23.014 6.940 1.00 0.00 H new ATOM 0 HG3 GLN B 92 -2.818 -22.364 8.566 1.00 0.00 H new ATOM 0 HE21 GLN B 92 -0.650 -22.828 6.669 1.00 0.00 H new ATOM 0 HE22 GLN B 92 0.487 -23.891 7.504 1.00 0.00 H new ATOM 2349 N ARG B 93 -5.817 -26.769 8.397 1.00 0.00 N ATOM 2350 CA ARG B 93 -6.235 -27.875 9.226 1.00 0.00 C ATOM 2351 C ARG B 93 -6.849 -28.982 8.391 1.00 0.00 C ATOM 2352 O ARG B 93 -7.352 -29.965 8.920 1.00 0.00 O ATOM 2353 CB ARG B 93 -7.191 -27.435 10.350 1.00 0.00 C ATOM 2354 CG ARG B 93 -8.658 -27.359 9.969 1.00 0.00 C ATOM 2355 CD ARG B 93 -9.030 -26.248 9.048 1.00 0.00 C ATOM 2356 NE ARG B 93 -10.487 -26.165 8.913 1.00 0.00 N ATOM 2357 CZ ARG B 93 -11.201 -26.527 7.837 1.00 0.00 C ATOM 2358 NH1 ARG B 93 -10.595 -26.896 6.716 1.00 0.00 N ATOM 2359 NH2 ARG B 93 -12.525 -26.509 7.894 1.00 0.00 N ATOM 0 H ARG B 93 -6.563 -26.162 8.057 1.00 0.00 H new ATOM 0 HA ARG B 93 -5.339 -28.267 9.707 1.00 0.00 H new ATOM 0 HB2 ARG B 93 -7.086 -28.128 11.184 1.00 0.00 H new ATOM 0 HB3 ARG B 93 -6.876 -26.455 10.708 1.00 0.00 H new ATOM 0 HG2 ARG B 93 -8.943 -28.303 9.504 1.00 0.00 H new ATOM 0 HG3 ARG B 93 -9.247 -27.263 10.881 1.00 0.00 H new ATOM 0 HD2 ARG B 93 -8.639 -25.305 9.429 1.00 0.00 H new ATOM 0 HD3 ARG B 93 -8.576 -26.410 8.070 1.00 0.00 H new ATOM 0 HE ARG B 93 -11.006 -25.798 9.711 1.00 0.00 H new ATOM 0 HH11 ARG B 93 -9.576 -26.906 6.667 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -11.148 -27.169 5.904 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -12.995 -26.221 8.752 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -13.074 -26.783 7.079 1.00 0.00 H new ATOM 2373 N ALA B 94 -6.759 -28.843 7.076 1.00 0.00 N ATOM 2374 CA ALA B 94 -7.292 -29.850 6.158 1.00 0.00 C ATOM 2375 C ALA B 94 -6.401 -31.083 6.168 1.00 0.00 C ATOM 2376 O ALA B 94 -6.700 -32.096 5.555 1.00 0.00 O ATOM 2377 CB ALA B 94 -7.412 -29.283 4.749 1.00 0.00 C ATOM 0 H ALA B 94 -6.322 -28.044 6.617 1.00 0.00 H new ATOM 0 HA ALA B 94 -8.290 -30.136 6.491 1.00 0.00 H new ATOM 0 HB1 ALA B 94 -7.810 -30.048 4.082 1.00 0.00 H new ATOM 0 HB2 ALA B 94 -8.083 -28.424 4.758 1.00 0.00 H new ATOM 0 HB3 ALA B 94 -6.429 -28.971 4.397 1.00 0.00 H new ATOM 2383 N GLN B 95 -5.303 -30.963 6.873 1.00 0.00 N ATOM 2384 CA GLN B 95 -4.360 -32.021 7.029 1.00 0.00 C ATOM 2385 C GLN B 95 -4.297 -32.327 8.494 1.00 0.00 C ATOM 2386 O GLN B 95 -4.866 -33.338 8.930 1.00 0.00 O ATOM 2387 CB GLN B 95 -2.962 -31.639 6.517 1.00 0.00 C ATOM 2388 CG GLN B 95 -2.942 -31.058 5.120 1.00 0.00 C ATOM 2389 CD GLN B 95 -2.822 -29.549 5.114 1.00 0.00 C ATOM 2390 OE1 GLN B 95 -1.720 -29.001 5.060 1.00 0.00 O ATOM 2391 NE2 GLN B 95 -3.925 -28.871 5.219 1.00 0.00 N ATOM 0 H GLN B 95 -5.043 -30.106 7.361 1.00 0.00 H new ATOM 0 HA GLN B 95 -4.678 -32.883 6.442 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -2.523 -30.916 7.204 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -2.327 -32.525 6.538 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -2.107 -31.486 4.565 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -3.854 -31.347 4.598 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -4.821 -29.357 5.261 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -3.896 -27.852 5.259 1.00 0.00 H new TER 2400 GLN B 95