USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 953 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 110 GLN : amide:sc= -0.071 X(o=-0.071,f=-0.22) USER MOD Set 1.2: A 113 LYS NZ :NH3+ -142:sc= 0 (180deg=0) USER MOD Set 2.1: A 14 LYS NZ :NH3+ -159:sc= 0 (180deg=0) USER MOD Set 2.2: A 18 GLN : amide:sc= -0.289 X(o=-0.44,f=-0.14) USER MOD Set 2.3: A 106 GLN : amide:sc= -0.15 X(o=-0.44,f=-0.14) USER MOD Set 3.1: A 85 LYS NZ :NH3+ 142:sc= 0.253 (180deg=-0.411) USER MOD Set 3.2: A 90 TYR OH : rot 180:sc= 0.301 USER MOD Set 4.1: A 48 MET CE :methyl -109:sc= -1.24 (180deg=-3!) USER MOD Set 4.2: A 56 ASN : amide:sc= 0.0949 K(o=-1.2,f=-2.2) USER MOD Set 4.3: A 62 TYR OH : rot 15:sc= -0.014 USER MOD Set 5.1: A 20 GLN : amide:sc= 0 X(o=0,f=0.37) USER MOD Set 5.2: A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 107:sc= 1.03 USER MOD Single : A 22 LYS NZ :NH3+ -156:sc= 0.0696 (180deg=-0.317) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -3.95! C(o=-4!,f=-2.8!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.0889 X(o=-0.089,f=-0.028) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.0298 USER MOD Single : A 53 MET CE :methyl -153:sc= -0.544 (180deg=-1.31) USER MOD Single : A 54 LYS NZ :NH3+ -141:sc= -0.647 (180deg=-1.96) USER MOD Single : A 55 GLN : amide:sc= -0.0507 X(o=-0.051,f=-0.031) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -3! C(o=-3!,f=-14!) USER MOD Single : A 73 ASN : amide:sc= -1.04 K(o=-1,f=-4.8!) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -2.85 X(o=-2.9,f=-3.1!) USER MOD Single : A 79 CYS SG : rot -142:sc= 0.0761 USER MOD Single : A 81 LYS NZ :NH3+ -121:sc= 0.275 (180deg=-0.375) USER MOD Single : A 82 TYR OH : rot 39:sc= -0.506 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 THR OG1 : rot -55:sc= -0.334 USER MOD Single : A 99 GLN : amide:sc= -0.762 K(o=-0.76,f=-6.3!) USER MOD Single : A 114 MET CE :methyl 151:sc= -0.121 (180deg=-1.6!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0.00643 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.124 33.322 -4.951 1.00 0.00 N ATOM 2 CA GLY A 1 -0.274 33.337 -3.508 1.00 0.00 C ATOM 3 C GLY A 1 0.739 32.451 -2.810 1.00 0.00 C ATOM 4 O GLY A 1 1.926 32.776 -2.758 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.839 33.943 -5.381 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.826 33.661 -5.205 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.251 32.352 -5.303 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.168 34.360 -3.146 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.280 33.009 -3.247 1.00 0.00 H new ATOM 8 N SER A 2 0.271 31.330 -2.271 1.00 0.00 N ATOM 9 CA SER A 2 1.144 30.398 -1.568 1.00 0.00 C ATOM 10 C SER A 2 0.801 28.955 -1.930 1.00 0.00 C ATOM 11 O SER A 2 -0.369 28.599 -2.067 1.00 0.00 O ATOM 12 CB SER A 2 1.026 30.598 -0.056 1.00 0.00 C ATOM 13 OG SER A 2 1.221 31.957 0.295 1.00 0.00 O ATOM 0 H SER A 2 -0.708 31.045 -2.308 1.00 0.00 H new ATOM 0 HA SER A 2 2.171 30.598 -1.875 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.043 30.269 0.282 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.763 29.978 0.455 1.00 0.00 H new ATOM 0 HG SER A 2 1.139 32.059 1.266 1.00 0.00 H new ATOM 19 N SER A 3 1.832 28.130 -2.084 1.00 0.00 N ATOM 20 CA SER A 3 1.642 26.728 -2.433 1.00 0.00 C ATOM 21 C SER A 3 1.833 25.832 -1.212 1.00 0.00 C ATOM 22 O SER A 3 2.589 26.162 -0.299 1.00 0.00 O ATOM 23 CB SER A 3 2.618 26.318 -3.538 1.00 0.00 C ATOM 24 OG SER A 3 2.106 26.645 -4.817 1.00 0.00 O ATOM 0 H SER A 3 2.807 28.409 -1.972 1.00 0.00 H new ATOM 0 HA SER A 3 0.621 26.606 -2.795 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.574 26.818 -3.387 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.807 25.246 -3.482 1.00 0.00 H new ATOM 0 HG SER A 3 2.749 26.375 -5.506 1.00 0.00 H new ATOM 30 N GLY A 4 1.143 24.697 -1.204 1.00 0.00 N ATOM 31 CA GLY A 4 1.249 23.771 -0.093 1.00 0.00 C ATOM 32 C GLY A 4 0.042 22.861 0.023 1.00 0.00 C ATOM 33 O GLY A 4 -0.964 23.227 0.630 1.00 0.00 O ATOM 0 H GLY A 4 0.511 24.402 -1.948 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.147 23.165 -0.214 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.367 24.333 0.834 1.00 0.00 H new ATOM 37 N SER A 5 0.141 21.672 -0.563 1.00 0.00 N ATOM 38 CA SER A 5 -0.953 20.709 -0.529 1.00 0.00 C ATOM 39 C SER A 5 -0.711 19.649 0.542 1.00 0.00 C ATOM 40 O SER A 5 -0.917 18.458 0.310 1.00 0.00 O ATOM 41 CB SER A 5 -1.117 20.041 -1.895 1.00 0.00 C ATOM 42 OG SER A 5 -2.430 19.533 -2.061 1.00 0.00 O ATOM 0 H SER A 5 0.968 21.353 -1.067 1.00 0.00 H new ATOM 0 HA SER A 5 -1.869 21.247 -0.284 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.900 20.761 -2.684 1.00 0.00 H new ATOM 0 HB3 SER A 5 -0.395 19.231 -1.996 1.00 0.00 H new ATOM 0 HG SER A 5 -2.509 19.112 -2.943 1.00 0.00 H new ATOM 48 N SER A 6 -0.272 20.092 1.716 1.00 0.00 N ATOM 49 CA SER A 6 0.003 19.184 2.822 1.00 0.00 C ATOM 50 C SER A 6 -1.214 18.316 3.128 1.00 0.00 C ATOM 51 O SER A 6 -1.106 17.098 3.254 1.00 0.00 O ATOM 52 CB SER A 6 0.409 19.971 4.069 1.00 0.00 C ATOM 53 OG SER A 6 1.423 20.914 3.769 1.00 0.00 O ATOM 0 H SER A 6 -0.099 21.075 1.925 1.00 0.00 H new ATOM 0 HA SER A 6 0.827 18.534 2.528 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.461 20.485 4.478 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.763 19.284 4.837 1.00 0.00 H new ATOM 0 HG SER A 6 1.664 21.405 4.582 1.00 0.00 H new ATOM 59 N GLY A 7 -2.374 18.956 3.246 1.00 0.00 N ATOM 60 CA GLY A 7 -3.596 18.229 3.536 1.00 0.00 C ATOM 61 C GLY A 7 -3.619 16.855 2.895 1.00 0.00 C ATOM 62 O GLY A 7 -3.877 15.854 3.564 1.00 0.00 O ATOM 0 H GLY A 7 -2.489 19.965 3.146 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.706 18.125 4.615 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.451 18.806 3.183 1.00 0.00 H new ATOM 66 N PHE A 8 -3.352 16.807 1.595 1.00 0.00 N ATOM 67 CA PHE A 8 -3.347 15.546 0.862 1.00 0.00 C ATOM 68 C PHE A 8 -2.408 14.538 1.520 1.00 0.00 C ATOM 69 O PHE A 8 -2.738 13.359 1.653 1.00 0.00 O ATOM 70 CB PHE A 8 -2.927 15.778 -0.591 1.00 0.00 C ATOM 71 CG PHE A 8 -2.595 14.512 -1.328 1.00 0.00 C ATOM 72 CD1 PHE A 8 -3.602 13.677 -1.786 1.00 0.00 C ATOM 73 CD2 PHE A 8 -1.276 14.158 -1.565 1.00 0.00 C ATOM 74 CE1 PHE A 8 -3.298 12.512 -2.464 1.00 0.00 C ATOM 75 CE2 PHE A 8 -0.967 12.994 -2.242 1.00 0.00 C ATOM 76 CZ PHE A 8 -1.980 12.170 -2.693 1.00 0.00 C ATOM 0 H PHE A 8 -3.136 17.626 1.027 1.00 0.00 H new ATOM 0 HA PHE A 8 -4.358 15.140 0.880 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -3.731 16.294 -1.115 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -2.060 16.438 -0.609 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.635 13.940 -1.611 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -0.480 14.800 -1.216 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -4.091 11.869 -2.815 1.00 0.00 H new ATOM 0 HE2 PHE A 8 0.065 12.729 -2.418 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.741 11.260 -3.224 1.00 0.00 H new ATOM 86 N LEU A 9 -1.235 15.012 1.928 1.00 0.00 N ATOM 87 CA LEU A 9 -0.247 14.153 2.572 1.00 0.00 C ATOM 88 C LEU A 9 -0.848 13.441 3.779 1.00 0.00 C ATOM 89 O LEU A 9 -0.734 12.222 3.913 1.00 0.00 O ATOM 90 CB LEU A 9 0.967 14.976 3.004 1.00 0.00 C ATOM 91 CG LEU A 9 1.530 15.942 1.960 1.00 0.00 C ATOM 92 CD1 LEU A 9 2.661 16.769 2.551 1.00 0.00 C ATOM 93 CD2 LEU A 9 2.009 15.181 0.732 1.00 0.00 C ATOM 0 H LEU A 9 -0.946 15.985 1.824 1.00 0.00 H new ATOM 0 HA LEU A 9 0.069 13.400 1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.695 15.549 3.891 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.760 14.289 3.299 1.00 0.00 H new ATOM 0 HG LEU A 9 0.733 16.620 1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.048 17.450 1.793 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.287 17.344 3.398 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.459 16.107 2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.406 15.884 0.000 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.790 14.478 1.021 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.174 14.635 0.294 1.00 0.00 H new ATOM 105 N ILE A 10 -1.489 14.209 4.654 1.00 0.00 N ATOM 106 CA ILE A 10 -2.111 13.649 5.848 1.00 0.00 C ATOM 107 C ILE A 10 -3.052 12.503 5.493 1.00 0.00 C ATOM 108 O ILE A 10 -3.071 11.471 6.164 1.00 0.00 O ATOM 109 CB ILE A 10 -2.895 14.721 6.628 1.00 0.00 C ATOM 110 CG1 ILE A 10 -1.932 15.694 7.310 1.00 0.00 C ATOM 111 CG2 ILE A 10 -3.810 14.067 7.653 1.00 0.00 C ATOM 112 CD1 ILE A 10 -1.555 16.877 6.445 1.00 0.00 C ATOM 0 H ILE A 10 -1.591 15.219 4.559 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.305 13.270 6.476 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.511 15.282 5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.388 16.058 8.231 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.026 15.158 7.593 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.357 14.837 8.196 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.516 13.411 7.144 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.213 13.484 8.354 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -0.870 17.525 6.993 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -1.070 16.523 5.535 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.453 17.437 6.183 1.00 0.00 H new ATOM 124 N LEU A 11 -3.831 12.692 4.433 1.00 0.00 N ATOM 125 CA LEU A 11 -4.774 11.673 3.986 1.00 0.00 C ATOM 126 C LEU A 11 -4.065 10.344 3.744 1.00 0.00 C ATOM 127 O LEU A 11 -4.602 9.278 4.048 1.00 0.00 O ATOM 128 CB LEU A 11 -5.479 12.129 2.708 1.00 0.00 C ATOM 129 CG LEU A 11 -6.548 11.184 2.158 1.00 0.00 C ATOM 130 CD1 LEU A 11 -7.751 11.138 3.086 1.00 0.00 C ATOM 131 CD2 LEU A 11 -6.968 11.611 0.758 1.00 0.00 C ATOM 0 H LEU A 11 -3.828 13.541 3.868 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.516 11.530 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -5.942 13.098 2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.725 12.282 1.936 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.123 10.182 2.099 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.500 10.460 2.677 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.439 10.784 4.069 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.177 12.137 3.179 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.729 10.927 0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.373 12.622 0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.102 11.589 0.096 1.00 0.00 H new ATOM 143 N LEU A 12 -2.857 10.415 3.196 1.00 0.00 N ATOM 144 CA LEU A 12 -2.074 9.217 2.914 1.00 0.00 C ATOM 145 C LEU A 12 -1.574 8.578 4.205 1.00 0.00 C ATOM 146 O LEU A 12 -1.643 7.361 4.375 1.00 0.00 O ATOM 147 CB LEU A 12 -0.889 9.560 2.009 1.00 0.00 C ATOM 148 CG LEU A 12 -1.194 9.660 0.514 1.00 0.00 C ATOM 149 CD1 LEU A 12 -2.295 10.679 0.260 1.00 0.00 C ATOM 150 CD2 LEU A 12 0.062 10.025 -0.264 1.00 0.00 C ATOM 0 H LEU A 12 -2.399 11.289 2.938 1.00 0.00 H new ATOM 0 HA LEU A 12 -2.719 8.503 2.403 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.469 10.510 2.338 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.117 8.804 2.152 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.541 8.686 0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.498 10.736 -0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.200 10.375 0.786 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.976 11.657 0.622 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.174 10.092 -1.326 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.440 10.986 0.085 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.822 9.259 -0.109 1.00 0.00 H new ATOM 162 N ARG A 13 -1.069 9.408 5.113 1.00 0.00 N ATOM 163 CA ARG A 13 -0.558 8.923 6.390 1.00 0.00 C ATOM 164 C ARG A 13 -1.660 8.239 7.194 1.00 0.00 C ATOM 165 O ARG A 13 -1.475 7.136 7.707 1.00 0.00 O ATOM 166 CB ARG A 13 0.034 10.080 7.199 1.00 0.00 C ATOM 167 CG ARG A 13 1.259 10.708 6.556 1.00 0.00 C ATOM 168 CD ARG A 13 1.451 12.147 7.009 1.00 0.00 C ATOM 169 NE ARG A 13 2.665 12.738 6.456 1.00 0.00 N ATOM 170 CZ ARG A 13 3.871 12.575 6.988 1.00 0.00 C ATOM 171 NH1 ARG A 13 4.022 11.842 8.083 1.00 0.00 N ATOM 172 NH2 ARG A 13 4.930 13.146 6.427 1.00 0.00 N ATOM 0 H ARG A 13 -1.003 10.418 4.988 1.00 0.00 H new ATOM 0 HA ARG A 13 0.225 8.193 6.185 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -0.729 10.847 7.333 1.00 0.00 H new ATOM 0 HB3 ARG A 13 0.300 9.719 8.192 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.144 10.124 6.810 1.00 0.00 H new ATOM 0 HG3 ARG A 13 1.158 10.678 5.471 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.588 12.740 6.706 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.495 12.181 8.098 1.00 0.00 H new ATOM 0 HE ARG A 13 2.583 13.308 5.614 1.00 0.00 H new ATOM 0 HH11 ARG A 13 3.211 11.402 8.518 1.00 0.00 H new ATOM 0 HH12 ARG A 13 4.949 11.718 8.490 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.819 13.711 5.585 1.00 0.00 H new ATOM 0 HH22 ARG A 13 5.855 13.019 6.838 1.00 0.00 H new ATOM 186 N LYS A 14 -2.807 8.902 7.297 1.00 0.00 N ATOM 187 CA LYS A 14 -3.941 8.358 8.037 1.00 0.00 C ATOM 188 C LYS A 14 -4.551 7.170 7.300 1.00 0.00 C ATOM 189 O LYS A 14 -5.002 6.206 7.920 1.00 0.00 O ATOM 190 CB LYS A 14 -5.002 9.439 8.251 1.00 0.00 C ATOM 191 CG LYS A 14 -5.887 9.672 7.038 1.00 0.00 C ATOM 192 CD LYS A 14 -7.107 8.765 7.056 1.00 0.00 C ATOM 193 CE LYS A 14 -8.255 9.392 7.833 1.00 0.00 C ATOM 194 NZ LYS A 14 -9.580 8.937 7.327 1.00 0.00 N ATOM 0 H LYS A 14 -2.976 9.816 6.878 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.580 8.015 9.007 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -5.628 9.159 9.098 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -4.508 10.374 8.515 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.207 10.714 7.015 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -5.313 9.494 6.128 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.426 8.562 6.034 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -6.843 7.807 7.504 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.162 9.136 8.888 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.192 10.478 7.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.313 9.618 7.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.552 8.872 6.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.802 8.003 7.727 1.00 0.00 H new ATOM 208 N THR A 15 -4.563 7.245 5.972 1.00 0.00 N ATOM 209 CA THR A 15 -5.118 6.175 5.152 1.00 0.00 C ATOM 210 C THR A 15 -4.245 4.927 5.211 1.00 0.00 C ATOM 211 O THR A 15 -4.751 3.805 5.254 1.00 0.00 O ATOM 212 CB THR A 15 -5.267 6.615 3.683 1.00 0.00 C ATOM 213 OG1 THR A 15 -6.311 7.588 3.565 1.00 0.00 O ATOM 214 CG2 THR A 15 -5.575 5.423 2.790 1.00 0.00 C ATOM 0 H THR A 15 -4.195 8.035 5.442 1.00 0.00 H new ATOM 0 HA THR A 15 -6.103 5.944 5.557 1.00 0.00 H new ATOM 0 HB THR A 15 -4.323 7.056 3.362 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.918 8.473 3.414 1.00 0.00 H new ATOM 0 HG21 THR A 15 -5.676 5.758 1.758 1.00 0.00 H new ATOM 0 HG22 THR A 15 -4.764 4.698 2.859 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.506 4.957 3.113 1.00 0.00 H new ATOM 222 N LEU A 16 -2.932 5.128 5.215 1.00 0.00 N ATOM 223 CA LEU A 16 -1.988 4.018 5.270 1.00 0.00 C ATOM 224 C LEU A 16 -2.267 3.126 6.475 1.00 0.00 C ATOM 225 O LEU A 16 -2.183 1.902 6.385 1.00 0.00 O ATOM 226 CB LEU A 16 -0.553 4.545 5.332 1.00 0.00 C ATOM 227 CG LEU A 16 0.520 3.525 5.712 1.00 0.00 C ATOM 228 CD1 LEU A 16 0.614 2.431 4.660 1.00 0.00 C ATOM 229 CD2 LEU A 16 1.867 4.211 5.893 1.00 0.00 C ATOM 0 H LEU A 16 -2.497 6.050 5.181 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.111 3.423 4.365 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.299 4.964 4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.519 5.364 6.051 1.00 0.00 H new ATOM 0 HG LEU A 16 0.238 3.065 6.659 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.383 1.714 4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.346 1.920 4.579 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.872 2.873 3.698 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.619 3.470 6.163 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.155 4.698 4.961 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.792 4.957 6.684 1.00 0.00 H new ATOM 241 N GLU A 17 -2.600 3.749 7.602 1.00 0.00 N ATOM 242 CA GLU A 17 -2.892 3.010 8.824 1.00 0.00 C ATOM 243 C GLU A 17 -4.191 2.221 8.686 1.00 0.00 C ATOM 244 O GLU A 17 -4.241 1.029 8.986 1.00 0.00 O ATOM 245 CB GLU A 17 -2.988 3.967 10.014 1.00 0.00 C ATOM 246 CG GLU A 17 -1.684 4.685 10.324 1.00 0.00 C ATOM 247 CD GLU A 17 -1.592 5.128 11.771 1.00 0.00 C ATOM 248 OE1 GLU A 17 -2.632 5.520 12.339 1.00 0.00 O ATOM 249 OE2 GLU A 17 -0.478 5.083 12.335 1.00 0.00 O ATOM 0 H GLU A 17 -2.674 4.762 7.693 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.077 2.307 8.997 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.762 4.708 9.812 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.304 3.408 10.895 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.847 4.025 10.096 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.590 5.555 9.675 1.00 0.00 H new ATOM 256 N GLN A 18 -5.242 2.898 8.230 1.00 0.00 N ATOM 257 CA GLN A 18 -6.542 2.261 8.054 1.00 0.00 C ATOM 258 C GLN A 18 -6.393 0.895 7.394 1.00 0.00 C ATOM 259 O GLN A 18 -7.050 -0.070 7.785 1.00 0.00 O ATOM 260 CB GLN A 18 -7.458 3.151 7.214 1.00 0.00 C ATOM 261 CG GLN A 18 -7.782 4.483 7.869 1.00 0.00 C ATOM 262 CD GLN A 18 -9.081 5.082 7.364 1.00 0.00 C ATOM 263 OE1 GLN A 18 -10.163 4.736 7.838 1.00 0.00 O ATOM 264 NE2 GLN A 18 -8.979 5.987 6.398 1.00 0.00 N ATOM 0 H GLN A 18 -5.218 3.886 7.976 1.00 0.00 H new ATOM 0 HA GLN A 18 -6.988 2.121 9.039 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -6.986 3.336 6.249 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -8.388 2.617 7.017 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -7.845 4.347 8.949 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -6.967 5.183 7.683 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -8.061 6.244 6.035 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -9.818 6.425 6.019 1.00 0.00 H new ATOM 273 N LEU A 19 -5.527 0.820 6.389 1.00 0.00 N ATOM 274 CA LEU A 19 -5.292 -0.429 5.673 1.00 0.00 C ATOM 275 C LEU A 19 -4.660 -1.472 6.589 1.00 0.00 C ATOM 276 O LEU A 19 -5.130 -2.607 6.671 1.00 0.00 O ATOM 277 CB LEU A 19 -4.390 -0.184 4.463 1.00 0.00 C ATOM 278 CG LEU A 19 -4.882 0.859 3.459 1.00 0.00 C ATOM 279 CD1 LEU A 19 -3.774 1.228 2.485 1.00 0.00 C ATOM 280 CD2 LEU A 19 -6.103 0.344 2.710 1.00 0.00 C ATOM 0 H LEU A 19 -4.976 1.609 6.052 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.255 -0.809 5.331 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.408 0.123 4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.256 -1.130 3.938 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.168 1.756 4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.143 1.971 1.778 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.928 1.639 3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.456 0.338 1.942 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.440 1.099 2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.843 -0.568 2.173 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.902 0.132 3.420 1.00 0.00 H new ATOM 292 N GLN A 20 -3.593 -1.078 7.278 1.00 0.00 N ATOM 293 CA GLN A 20 -2.898 -1.980 8.190 1.00 0.00 C ATOM 294 C GLN A 20 -3.890 -2.745 9.060 1.00 0.00 C ATOM 295 O GLN A 20 -3.716 -3.937 9.313 1.00 0.00 O ATOM 296 CB GLN A 20 -1.926 -1.195 9.073 1.00 0.00 C ATOM 297 CG GLN A 20 -0.814 -0.511 8.294 1.00 0.00 C ATOM 298 CD GLN A 20 0.462 -0.370 9.102 1.00 0.00 C ATOM 299 OE1 GLN A 20 0.685 0.647 9.759 1.00 0.00 O ATOM 300 NE2 GLN A 20 1.307 -1.393 9.057 1.00 0.00 N ATOM 0 H GLN A 20 -3.192 -0.142 7.222 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.337 -2.699 7.593 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.482 -0.443 9.632 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.483 -1.872 9.803 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.605 -1.081 7.389 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -1.151 0.476 7.978 1.00 0.00 H new ATOM 0 HE21 GLN A 20 1.081 -2.217 8.499 1.00 0.00 H new ATOM 0 HE22 GLN A 20 2.182 -1.355 9.580 1.00 0.00 H new ATOM 309 N GLU A 21 -4.929 -2.051 9.515 1.00 0.00 N ATOM 310 CA GLU A 21 -5.948 -2.666 10.359 1.00 0.00 C ATOM 311 C GLU A 21 -6.418 -3.990 9.765 1.00 0.00 C ATOM 312 O GLU A 21 -6.554 -4.989 10.473 1.00 0.00 O ATOM 313 CB GLU A 21 -7.137 -1.721 10.531 1.00 0.00 C ATOM 314 CG GLU A 21 -6.811 -0.470 11.330 1.00 0.00 C ATOM 315 CD GLU A 21 -7.877 0.600 11.202 1.00 0.00 C ATOM 316 OE1 GLU A 21 -9.063 0.240 11.039 1.00 0.00 O ATOM 317 OE2 GLU A 21 -7.526 1.797 11.262 1.00 0.00 O ATOM 0 H GLU A 21 -5.087 -1.064 9.314 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.505 -2.862 11.336 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.503 -1.428 9.547 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.947 -2.257 11.026 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.693 -0.735 12.381 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.856 -0.067 10.993 1.00 0.00 H new ATOM 324 N LYS A 22 -6.665 -3.992 8.459 1.00 0.00 N ATOM 325 CA LYS A 22 -7.121 -5.193 7.768 1.00 0.00 C ATOM 326 C LYS A 22 -6.096 -6.316 7.896 1.00 0.00 C ATOM 327 O LYS A 22 -6.456 -7.483 8.047 1.00 0.00 O ATOM 328 CB LYS A 22 -7.376 -4.889 6.289 1.00 0.00 C ATOM 329 CG LYS A 22 -8.223 -3.648 6.062 1.00 0.00 C ATOM 330 CD LYS A 22 -9.576 -3.764 6.743 1.00 0.00 C ATOM 331 CE LYS A 22 -10.263 -2.411 6.853 1.00 0.00 C ATOM 332 NZ LYS A 22 -9.896 -1.704 8.112 1.00 0.00 N ATOM 0 H LYS A 22 -6.557 -3.175 7.858 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.052 -5.518 8.233 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.419 -4.764 5.782 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.870 -5.745 5.830 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.697 -2.773 6.443 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -8.365 -3.494 4.992 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.210 -4.450 6.181 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.448 -4.190 7.738 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.990 -1.794 5.997 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.344 -2.548 6.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.643 -1.023 8.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.791 -2.396 8.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.997 -1.198 7.977 1.00 0.00 H new ATOM 346 N ASP A 23 -4.819 -5.955 7.838 1.00 0.00 N ATOM 347 CA ASP A 23 -3.743 -6.932 7.950 1.00 0.00 C ATOM 348 C ASP A 23 -3.605 -7.426 9.386 1.00 0.00 C ATOM 349 O ASP A 23 -2.726 -6.982 10.127 1.00 0.00 O ATOM 350 CB ASP A 23 -2.421 -6.323 7.478 1.00 0.00 C ATOM 351 CG ASP A 23 -1.346 -7.370 7.261 1.00 0.00 C ATOM 352 OD1 ASP A 23 -1.689 -8.569 7.205 1.00 0.00 O ATOM 353 OD2 ASP A 23 -0.161 -6.991 7.148 1.00 0.00 O ATOM 0 H ASP A 23 -4.504 -4.993 7.714 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.990 -7.782 7.314 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.587 -5.778 6.548 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.075 -5.598 8.215 1.00 0.00 H new ATOM 358 N THR A 24 -4.480 -8.348 9.777 1.00 0.00 N ATOM 359 CA THR A 24 -4.459 -8.901 11.125 1.00 0.00 C ATOM 360 C THR A 24 -3.171 -9.677 11.381 1.00 0.00 C ATOM 361 O THR A 24 -2.611 -9.626 12.475 1.00 0.00 O ATOM 362 CB THR A 24 -5.662 -9.830 11.370 1.00 0.00 C ATOM 363 OG1 THR A 24 -5.611 -10.945 10.473 1.00 0.00 O ATOM 364 CG2 THR A 24 -6.971 -9.080 11.182 1.00 0.00 C ATOM 0 H THR A 24 -5.213 -8.728 9.178 1.00 0.00 H new ATOM 0 HA THR A 24 -4.515 -8.058 11.813 1.00 0.00 H new ATOM 0 HB THR A 24 -5.612 -10.190 12.398 1.00 0.00 H new ATOM 0 HG1 THR A 24 -6.379 -11.532 10.637 1.00 0.00 H new ATOM 0 HG21 THR A 24 -7.807 -9.757 11.360 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.019 -8.250 11.887 1.00 0.00 H new ATOM 0 HG23 THR A 24 -7.027 -8.695 10.164 1.00 0.00 H new ATOM 372 N GLY A 25 -2.706 -10.394 10.362 1.00 0.00 N ATOM 373 CA GLY A 25 -1.487 -11.170 10.497 1.00 0.00 C ATOM 374 C GLY A 25 -0.241 -10.309 10.425 1.00 0.00 C ATOM 375 O GLY A 25 0.865 -10.784 10.683 1.00 0.00 O ATOM 0 H GLY A 25 -3.151 -10.451 9.446 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.502 -11.703 11.448 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -1.450 -11.923 9.710 1.00 0.00 H new ATOM 379 N ASN A 26 -0.420 -9.042 10.071 1.00 0.00 N ATOM 380 CA ASN A 26 0.701 -8.113 9.963 1.00 0.00 C ATOM 381 C ASN A 26 1.865 -8.752 9.214 1.00 0.00 C ATOM 382 O ASN A 26 3.030 -8.482 9.511 1.00 0.00 O ATOM 383 CB ASN A 26 1.157 -7.668 11.355 1.00 0.00 C ATOM 384 CG ASN A 26 1.821 -8.788 12.131 1.00 0.00 C ATOM 385 OD1 ASN A 26 2.995 -9.092 11.920 1.00 0.00 O ATOM 386 ND2 ASN A 26 1.071 -9.407 13.035 1.00 0.00 N ATOM 0 H ASN A 26 -1.329 -8.634 9.854 1.00 0.00 H new ATOM 0 HA ASN A 26 0.366 -7.241 9.402 1.00 0.00 H new ATOM 0 HB2 ASN A 26 1.853 -6.835 11.257 1.00 0.00 H new ATOM 0 HB3 ASN A 26 0.297 -7.301 11.916 1.00 0.00 H new ATOM 0 HD21 ASN A 26 1.464 -10.168 13.588 1.00 0.00 H new ATOM 0 HD22 ASN A 26 0.102 -9.121 13.176 1.00 0.00 H new ATOM 393 N ILE A 27 1.544 -9.597 8.241 1.00 0.00 N ATOM 394 CA ILE A 27 2.564 -10.273 7.448 1.00 0.00 C ATOM 395 C ILE A 27 3.282 -9.292 6.526 1.00 0.00 C ATOM 396 O ILE A 27 4.487 -9.405 6.300 1.00 0.00 O ATOM 397 CB ILE A 27 1.959 -11.407 6.601 1.00 0.00 C ATOM 398 CG1 ILE A 27 1.279 -12.439 7.503 1.00 0.00 C ATOM 399 CG2 ILE A 27 3.035 -12.066 5.751 1.00 0.00 C ATOM 400 CD1 ILE A 27 0.424 -13.433 6.747 1.00 0.00 C ATOM 0 H ILE A 27 0.585 -9.830 7.982 1.00 0.00 H new ATOM 0 HA ILE A 27 3.280 -10.699 8.151 1.00 0.00 H new ATOM 0 HB ILE A 27 1.208 -10.982 5.935 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.042 -12.980 8.062 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.658 -11.919 8.233 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.591 -12.866 5.158 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.478 -11.325 5.086 1.00 0.00 H new ATOM 0 HG23 ILE A 27 3.807 -12.481 6.399 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.027 -14.134 7.450 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.362 -12.902 6.210 1.00 0.00 H new ATOM 0 HD13 ILE A 27 1.044 -13.980 6.036 1.00 0.00 H new ATOM 412 N PHE A 28 2.534 -8.330 5.998 1.00 0.00 N ATOM 413 CA PHE A 28 3.099 -7.328 5.101 1.00 0.00 C ATOM 414 C PHE A 28 3.492 -6.070 5.870 1.00 0.00 C ATOM 415 O PHE A 28 4.076 -5.143 5.307 1.00 0.00 O ATOM 416 CB PHE A 28 2.096 -6.975 4.000 1.00 0.00 C ATOM 417 CG PHE A 28 1.279 -8.146 3.535 1.00 0.00 C ATOM 418 CD1 PHE A 28 0.161 -8.554 4.247 1.00 0.00 C ATOM 419 CD2 PHE A 28 1.627 -8.838 2.387 1.00 0.00 C ATOM 420 CE1 PHE A 28 -0.592 -9.632 3.822 1.00 0.00 C ATOM 421 CE2 PHE A 28 0.877 -9.917 1.957 1.00 0.00 C ATOM 422 CZ PHE A 28 -0.235 -10.313 2.675 1.00 0.00 C ATOM 0 H PHE A 28 1.535 -8.222 6.175 1.00 0.00 H new ATOM 0 HA PHE A 28 3.995 -7.748 4.645 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.426 -6.197 4.366 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.635 -6.557 3.149 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -0.124 -8.023 5.143 1.00 0.00 H new ATOM 0 HD2 PHE A 28 2.494 -8.531 1.821 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.459 -9.942 4.387 1.00 0.00 H new ATOM 0 HE2 PHE A 28 1.160 -10.450 1.061 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.824 -11.154 2.340 1.00 0.00 H new ATOM 432 N SER A 29 3.168 -6.044 7.159 1.00 0.00 N ATOM 433 CA SER A 29 3.483 -4.900 8.003 1.00 0.00 C ATOM 434 C SER A 29 4.985 -4.634 8.021 1.00 0.00 C ATOM 435 O SER A 29 5.435 -3.583 8.476 1.00 0.00 O ATOM 436 CB SER A 29 2.980 -5.138 9.429 1.00 0.00 C ATOM 437 OG SER A 29 2.659 -3.913 10.067 1.00 0.00 O ATOM 0 H SER A 29 2.687 -6.804 7.641 1.00 0.00 H new ATOM 0 HA SER A 29 2.982 -4.026 7.588 1.00 0.00 H new ATOM 0 HB2 SER A 29 2.100 -5.781 9.405 1.00 0.00 H new ATOM 0 HB3 SER A 29 3.743 -5.663 10.004 1.00 0.00 H new ATOM 0 HG SER A 29 2.339 -4.092 10.976 1.00 0.00 H new ATOM 443 N GLU A 30 5.755 -5.595 7.520 1.00 0.00 N ATOM 444 CA GLU A 30 7.207 -5.465 7.478 1.00 0.00 C ATOM 445 C GLU A 30 7.762 -5.977 6.151 1.00 0.00 C ATOM 446 O GLU A 30 7.181 -6.846 5.501 1.00 0.00 O ATOM 447 CB GLU A 30 7.844 -6.232 8.639 1.00 0.00 C ATOM 448 CG GLU A 30 7.201 -5.944 9.984 1.00 0.00 C ATOM 449 CD GLU A 30 8.092 -6.322 11.151 1.00 0.00 C ATOM 450 OE1 GLU A 30 9.030 -5.556 11.454 1.00 0.00 O ATOM 451 OE2 GLU A 30 7.851 -7.385 11.761 1.00 0.00 O ATOM 0 H GLU A 30 5.398 -6.471 7.138 1.00 0.00 H new ATOM 0 HA GLU A 30 7.454 -4.407 7.571 1.00 0.00 H new ATOM 0 HB2 GLU A 30 7.779 -7.301 8.436 1.00 0.00 H new ATOM 0 HB3 GLU A 30 8.903 -5.981 8.691 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.958 -4.883 10.046 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.261 -6.491 10.058 1.00 0.00 H new ATOM 458 N PRO A 31 8.912 -5.424 5.739 1.00 0.00 N ATOM 459 CA PRO A 31 9.571 -5.809 4.486 1.00 0.00 C ATOM 460 C PRO A 31 10.154 -7.216 4.547 1.00 0.00 C ATOM 461 O PRO A 31 10.792 -7.593 5.529 1.00 0.00 O ATOM 462 CB PRO A 31 10.688 -4.773 4.341 1.00 0.00 C ATOM 463 CG PRO A 31 10.973 -4.325 5.732 1.00 0.00 C ATOM 464 CD PRO A 31 9.660 -4.383 6.464 1.00 0.00 C ATOM 0 HA PRO A 31 8.875 -5.826 3.647 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.573 -5.208 3.876 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.375 -3.939 3.713 1.00 0.00 H new ATOM 0 HG2 PRO A 31 11.713 -4.970 6.206 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.380 -3.314 5.741 1.00 0.00 H new ATOM 0 HD2 PRO A 31 9.796 -4.643 7.514 1.00 0.00 H new ATOM 0 HD3 PRO A 31 9.142 -3.424 6.438 1.00 0.00 H new ATOM 472 N VAL A 32 9.929 -7.990 3.489 1.00 0.00 N ATOM 473 CA VAL A 32 10.434 -9.357 3.421 1.00 0.00 C ATOM 474 C VAL A 32 11.957 -9.383 3.483 1.00 0.00 C ATOM 475 O VAL A 32 12.647 -8.756 2.678 1.00 0.00 O ATOM 476 CB VAL A 32 9.971 -10.062 2.133 1.00 0.00 C ATOM 477 CG1 VAL A 32 10.614 -11.436 2.015 1.00 0.00 C ATOM 478 CG2 VAL A 32 8.454 -10.170 2.100 1.00 0.00 C ATOM 0 H VAL A 32 9.401 -7.694 2.668 1.00 0.00 H new ATOM 0 HA VAL A 32 10.029 -9.888 4.282 1.00 0.00 H new ATOM 0 HB VAL A 32 10.288 -9.464 1.279 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.275 -11.919 1.099 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.698 -11.329 1.989 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.330 -12.046 2.873 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.145 -10.671 1.183 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.111 -10.745 2.960 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.017 -9.172 2.133 1.00 0.00 H new ATOM 488 N PRO A 33 12.497 -10.128 4.460 1.00 0.00 N ATOM 489 CA PRO A 33 13.945 -10.255 4.649 1.00 0.00 C ATOM 490 C PRO A 33 14.606 -11.061 3.536 1.00 0.00 C ATOM 491 O PRO A 33 14.098 -12.106 3.126 1.00 0.00 O ATOM 492 CB PRO A 33 14.064 -10.992 5.986 1.00 0.00 C ATOM 493 CG PRO A 33 12.786 -11.748 6.116 1.00 0.00 C ATOM 494 CD PRO A 33 11.735 -10.902 5.454 1.00 0.00 C ATOM 0 HA PRO A 33 14.445 -9.287 4.634 1.00 0.00 H new ATOM 0 HB2 PRO A 33 14.923 -11.663 5.993 1.00 0.00 H new ATOM 0 HB3 PRO A 33 14.197 -10.294 6.813 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.860 -12.724 5.637 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.542 -11.925 7.164 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.965 -11.513 4.983 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.232 -10.252 6.170 1.00 0.00 H new ATOM 502 N LEU A 34 15.742 -10.570 3.053 1.00 0.00 N ATOM 503 CA LEU A 34 16.474 -11.245 1.986 1.00 0.00 C ATOM 504 C LEU A 34 17.116 -12.531 2.497 1.00 0.00 C ATOM 505 O LEU A 34 17.325 -13.476 1.736 1.00 0.00 O ATOM 506 CB LEU A 34 17.547 -10.320 1.412 1.00 0.00 C ATOM 507 CG LEU A 34 17.040 -9.085 0.665 1.00 0.00 C ATOM 508 CD1 LEU A 34 18.202 -8.303 0.074 1.00 0.00 C ATOM 509 CD2 LEU A 34 16.057 -9.487 -0.424 1.00 0.00 C ATOM 0 H LEU A 34 16.176 -9.708 3.383 1.00 0.00 H new ATOM 0 HA LEU A 34 15.765 -11.501 1.198 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.187 -9.988 2.229 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.172 -10.899 0.733 1.00 0.00 H new ATOM 0 HG LEU A 34 16.521 -8.442 1.376 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.821 -7.428 -0.453 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.869 -7.982 0.874 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.750 -8.937 -0.623 1.00 0.00 H new ATOM 0 HD21 LEU A 34 15.707 -8.596 -0.945 1.00 0.00 H new ATOM 0 HD22 LEU A 34 16.551 -10.151 -1.133 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.208 -10.002 0.025 1.00 0.00 H new ATOM 521 N SER A 35 17.424 -12.561 3.789 1.00 0.00 N ATOM 522 CA SER A 35 18.044 -13.731 4.402 1.00 0.00 C ATOM 523 C SER A 35 17.349 -15.012 3.950 1.00 0.00 C ATOM 524 O SER A 35 18.002 -15.993 3.599 1.00 0.00 O ATOM 525 CB SER A 35 17.995 -13.620 5.926 1.00 0.00 C ATOM 526 OG SER A 35 18.836 -14.586 6.535 1.00 0.00 O ATOM 0 H SER A 35 17.254 -11.788 4.433 1.00 0.00 H new ATOM 0 HA SER A 35 19.085 -13.771 4.082 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.304 -12.620 6.231 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.970 -13.756 6.271 1.00 0.00 H new ATOM 0 HG SER A 35 18.788 -14.493 7.509 1.00 0.00 H new ATOM 532 N GLU A 36 16.020 -14.992 3.964 1.00 0.00 N ATOM 533 CA GLU A 36 15.236 -16.153 3.558 1.00 0.00 C ATOM 534 C GLU A 36 14.949 -16.118 2.059 1.00 0.00 C ATOM 535 O GLU A 36 14.841 -17.161 1.412 1.00 0.00 O ATOM 536 CB GLU A 36 13.921 -16.207 4.339 1.00 0.00 C ATOM 537 CG GLU A 36 13.380 -17.614 4.522 1.00 0.00 C ATOM 538 CD GLU A 36 14.117 -18.388 5.597 1.00 0.00 C ATOM 539 OE1 GLU A 36 15.232 -18.876 5.316 1.00 0.00 O ATOM 540 OE2 GLU A 36 13.581 -18.507 6.718 1.00 0.00 O ATOM 0 H GLU A 36 15.464 -14.186 4.251 1.00 0.00 H new ATOM 0 HA GLU A 36 15.818 -17.048 3.779 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.071 -15.754 5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 36 13.175 -15.605 3.821 1.00 0.00 H new ATOM 0 HG2 GLU A 36 12.322 -17.562 4.778 1.00 0.00 H new ATOM 0 HG3 GLU A 36 13.453 -18.153 3.577 1.00 0.00 H new ATOM 547 N VAL A 37 14.826 -14.912 1.514 1.00 0.00 N ATOM 548 CA VAL A 37 14.553 -14.740 0.093 1.00 0.00 C ATOM 549 C VAL A 37 15.725 -14.069 -0.615 1.00 0.00 C ATOM 550 O VAL A 37 15.766 -12.850 -0.781 1.00 0.00 O ATOM 551 CB VAL A 37 13.280 -13.902 -0.137 1.00 0.00 C ATOM 552 CG1 VAL A 37 12.719 -14.154 -1.528 1.00 0.00 C ATOM 553 CG2 VAL A 37 12.242 -14.209 0.931 1.00 0.00 C ATOM 0 H VAL A 37 14.911 -14.040 2.036 1.00 0.00 H new ATOM 0 HA VAL A 37 14.403 -15.736 -0.323 1.00 0.00 H new ATOM 0 HB VAL A 37 13.541 -12.846 -0.064 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.821 -13.554 -1.672 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.463 -13.879 -2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.471 -15.210 -1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.349 -13.609 0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.982 -15.267 0.892 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.650 -13.972 1.914 1.00 0.00 H new ATOM 563 N PRO A 38 16.701 -14.882 -1.044 1.00 0.00 N ATOM 564 CA PRO A 38 17.892 -14.390 -1.743 1.00 0.00 C ATOM 565 C PRO A 38 17.571 -13.875 -3.142 1.00 0.00 C ATOM 566 O PRO A 38 18.347 -13.120 -3.728 1.00 0.00 O ATOM 567 CB PRO A 38 18.793 -15.624 -1.821 1.00 0.00 C ATOM 568 CG PRO A 38 17.857 -16.782 -1.759 1.00 0.00 C ATOM 569 CD PRO A 38 16.717 -16.346 -0.881 1.00 0.00 C ATOM 0 HA PRO A 38 18.348 -13.545 -1.227 1.00 0.00 H new ATOM 0 HB2 PRO A 38 19.373 -15.633 -2.744 1.00 0.00 H new ATOM 0 HB3 PRO A 38 19.506 -15.647 -0.996 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.503 -17.051 -2.754 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.352 -17.662 -1.348 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.774 -16.795 -1.194 1.00 0.00 H new ATOM 0 HD3 PRO A 38 16.878 -16.633 0.158 1.00 0.00 H new ATOM 577 N ASP A 39 16.425 -14.288 -3.671 1.00 0.00 N ATOM 578 CA ASP A 39 16.001 -13.867 -5.002 1.00 0.00 C ATOM 579 C ASP A 39 14.707 -13.062 -4.931 1.00 0.00 C ATOM 580 O ASP A 39 13.874 -13.126 -5.834 1.00 0.00 O ATOM 581 CB ASP A 39 15.810 -15.083 -5.909 1.00 0.00 C ATOM 582 CG ASP A 39 17.103 -15.840 -6.141 1.00 0.00 C ATOM 583 OD1 ASP A 39 17.762 -16.211 -5.147 1.00 0.00 O ATOM 584 OD2 ASP A 39 17.456 -16.062 -7.318 1.00 0.00 O ATOM 0 H ASP A 39 15.772 -14.914 -3.199 1.00 0.00 H new ATOM 0 HA ASP A 39 16.781 -13.231 -5.420 1.00 0.00 H new ATOM 0 HB2 ASP A 39 15.075 -15.753 -5.464 1.00 0.00 H new ATOM 0 HB3 ASP A 39 15.406 -14.758 -6.868 1.00 0.00 H new ATOM 589 N TYR A 40 14.546 -12.305 -3.851 1.00 0.00 N ATOM 590 CA TYR A 40 13.352 -11.490 -3.660 1.00 0.00 C ATOM 591 C TYR A 40 13.200 -10.474 -4.787 1.00 0.00 C ATOM 592 O TYR A 40 12.182 -10.444 -5.480 1.00 0.00 O ATOM 593 CB TYR A 40 13.412 -10.769 -2.312 1.00 0.00 C ATOM 594 CG TYR A 40 12.172 -9.961 -2.004 1.00 0.00 C ATOM 595 CD1 TYR A 40 10.911 -10.544 -2.037 1.00 0.00 C ATOM 596 CD2 TYR A 40 12.261 -8.613 -1.676 1.00 0.00 C ATOM 597 CE1 TYR A 40 9.776 -9.809 -1.757 1.00 0.00 C ATOM 598 CE2 TYR A 40 11.131 -7.870 -1.392 1.00 0.00 C ATOM 599 CZ TYR A 40 9.891 -8.473 -1.434 1.00 0.00 C ATOM 600 OH TYR A 40 8.762 -7.737 -1.152 1.00 0.00 O ATOM 0 H TYR A 40 15.227 -12.239 -3.095 1.00 0.00 H new ATOM 0 HA TYR A 40 12.485 -12.151 -3.673 1.00 0.00 H new ATOM 0 HB2 TYR A 40 13.562 -11.505 -1.522 1.00 0.00 H new ATOM 0 HB3 TYR A 40 14.279 -10.108 -2.301 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.817 -11.591 -2.286 1.00 0.00 H new ATOM 0 HD2 TYR A 40 13.230 -8.138 -1.643 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.804 -10.278 -1.791 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.218 -6.824 -1.139 1.00 0.00 H new ATOM 0 HH TYR A 40 9.017 -6.814 -0.943 1.00 0.00 H new ATOM 610 N LEU A 41 14.220 -9.642 -4.966 1.00 0.00 N ATOM 611 CA LEU A 41 14.203 -8.624 -6.011 1.00 0.00 C ATOM 612 C LEU A 41 14.191 -9.262 -7.395 1.00 0.00 C ATOM 613 O LEU A 41 13.483 -8.808 -8.294 1.00 0.00 O ATOM 614 CB LEU A 41 15.416 -7.703 -5.872 1.00 0.00 C ATOM 615 CG LEU A 41 15.687 -7.154 -4.470 1.00 0.00 C ATOM 616 CD1 LEU A 41 17.026 -6.436 -4.428 1.00 0.00 C ATOM 617 CD2 LEU A 41 14.565 -6.222 -4.037 1.00 0.00 C ATOM 0 H LEU A 41 15.069 -9.652 -4.401 1.00 0.00 H new ATOM 0 HA LEU A 41 13.292 -8.036 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU A 41 16.300 -8.247 -6.204 1.00 0.00 H new ATOM 0 HB3 LEU A 41 15.287 -6.860 -6.551 1.00 0.00 H new ATOM 0 HG LEU A 41 15.726 -7.991 -3.773 1.00 0.00 H new ATOM 0 HD11 LEU A 41 17.202 -6.052 -3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.821 -7.133 -4.695 1.00 0.00 H new ATOM 0 HD13 LEU A 41 17.017 -5.608 -5.136 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.774 -5.841 -3.038 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.494 -5.389 -4.736 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.622 -6.768 -4.027 1.00 0.00 H new ATOM 629 N ASP A 42 14.978 -10.320 -7.559 1.00 0.00 N ATOM 630 CA ASP A 42 15.056 -11.025 -8.835 1.00 0.00 C ATOM 631 C ASP A 42 13.678 -11.131 -9.481 1.00 0.00 C ATOM 632 O ASP A 42 13.527 -10.913 -10.684 1.00 0.00 O ATOM 633 CB ASP A 42 15.648 -12.421 -8.634 1.00 0.00 C ATOM 634 CG ASP A 42 17.159 -12.397 -8.515 1.00 0.00 C ATOM 635 OD1 ASP A 42 17.830 -12.132 -9.533 1.00 0.00 O ATOM 636 OD2 ASP A 42 17.670 -12.645 -7.403 1.00 0.00 O ATOM 0 H ASP A 42 15.571 -10.709 -6.825 1.00 0.00 H new ATOM 0 HA ASP A 42 15.706 -10.455 -9.499 1.00 0.00 H new ATOM 0 HB2 ASP A 42 15.223 -12.867 -7.735 1.00 0.00 H new ATOM 0 HB3 ASP A 42 15.362 -13.058 -9.471 1.00 0.00 H new ATOM 641 N HIS A 43 12.676 -11.467 -8.676 1.00 0.00 N ATOM 642 CA HIS A 43 11.310 -11.603 -9.170 1.00 0.00 C ATOM 643 C HIS A 43 10.510 -10.330 -8.912 1.00 0.00 C ATOM 644 O HIS A 43 9.691 -9.923 -9.737 1.00 0.00 O ATOM 645 CB HIS A 43 10.621 -12.796 -8.506 1.00 0.00 C ATOM 646 CG HIS A 43 11.149 -14.122 -8.961 1.00 0.00 C ATOM 647 ND1 HIS A 43 10.512 -14.903 -9.902 1.00 0.00 N ATOM 648 CD2 HIS A 43 12.262 -14.803 -8.600 1.00 0.00 C ATOM 649 CE1 HIS A 43 11.210 -16.009 -10.098 1.00 0.00 C ATOM 650 NE2 HIS A 43 12.276 -15.972 -9.320 1.00 0.00 N ATOM 0 H HIS A 43 12.784 -11.650 -7.678 1.00 0.00 H new ATOM 0 HA HIS A 43 11.354 -11.772 -10.246 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.740 -12.718 -7.425 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.552 -12.749 -8.713 1.00 0.00 H new ATOM 0 HD2 HIS A 43 13.001 -14.486 -7.880 1.00 0.00 H new ATOM 0 HE1 HIS A 43 10.952 -16.807 -10.779 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.994 -16.695 -9.263 1.00 0.00 H new ATOM 659 N ILE A 44 10.752 -9.708 -7.763 1.00 0.00 N ATOM 660 CA ILE A 44 10.054 -8.482 -7.397 1.00 0.00 C ATOM 661 C ILE A 44 10.886 -7.252 -7.744 1.00 0.00 C ATOM 662 O ILE A 44 11.800 -6.879 -7.007 1.00 0.00 O ATOM 663 CB ILE A 44 9.716 -8.453 -5.895 1.00 0.00 C ATOM 664 CG1 ILE A 44 8.786 -9.614 -5.537 1.00 0.00 C ATOM 665 CG2 ILE A 44 9.080 -7.123 -5.521 1.00 0.00 C ATOM 666 CD1 ILE A 44 7.711 -9.868 -6.571 1.00 0.00 C ATOM 0 H ILE A 44 11.426 -10.033 -7.070 1.00 0.00 H new ATOM 0 HA ILE A 44 9.127 -8.464 -7.969 1.00 0.00 H new ATOM 0 HB ILE A 44 10.640 -8.564 -5.327 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.380 -10.519 -5.412 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.314 -9.408 -4.577 1.00 0.00 H new ATOM 0 HG21 ILE A 44 8.847 -7.118 -4.456 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.774 -6.312 -5.744 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.163 -6.984 -6.094 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.089 -10.704 -6.252 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.093 -8.977 -6.679 1.00 0.00 H new ATOM 0 HD13 ILE A 44 8.176 -10.106 -7.528 1.00 0.00 H new ATOM 678 N LYS A 45 10.562 -6.623 -8.868 1.00 0.00 N ATOM 679 CA LYS A 45 11.277 -5.432 -9.312 1.00 0.00 C ATOM 680 C LYS A 45 11.159 -4.311 -8.284 1.00 0.00 C ATOM 681 O LYS A 45 12.161 -3.743 -7.851 1.00 0.00 O ATOM 682 CB LYS A 45 10.734 -4.960 -10.662 1.00 0.00 C ATOM 683 CG LYS A 45 11.411 -5.615 -11.853 1.00 0.00 C ATOM 684 CD LYS A 45 12.827 -5.098 -12.044 1.00 0.00 C ATOM 685 CE LYS A 45 13.308 -5.302 -13.473 1.00 0.00 C ATOM 686 NZ LYS A 45 14.677 -4.754 -13.681 1.00 0.00 N ATOM 0 H LYS A 45 9.808 -6.918 -9.489 1.00 0.00 H new ATOM 0 HA LYS A 45 12.330 -5.691 -9.421 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.664 -5.164 -10.705 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.855 -3.879 -10.735 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.433 -6.695 -11.711 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.828 -5.424 -12.754 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.865 -4.038 -11.794 1.00 0.00 H new ATOM 0 HD3 LYS A 45 13.499 -5.612 -11.356 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.303 -6.366 -13.709 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.615 -4.819 -14.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 14.968 -4.913 -14.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 14.677 -3.734 -13.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 15.343 -5.233 -13.042 1.00 0.00 H new ATOM 700 N LYS A 46 9.926 -3.999 -7.897 1.00 0.00 N ATOM 701 CA LYS A 46 9.676 -2.948 -6.917 1.00 0.00 C ATOM 702 C LYS A 46 9.006 -3.516 -5.670 1.00 0.00 C ATOM 703 O LYS A 46 7.781 -3.545 -5.552 1.00 0.00 O ATOM 704 CB LYS A 46 8.797 -1.853 -7.527 1.00 0.00 C ATOM 705 CG LYS A 46 8.563 -0.674 -6.599 1.00 0.00 C ATOM 706 CD LYS A 46 7.815 0.447 -7.300 1.00 0.00 C ATOM 707 CE LYS A 46 7.006 1.279 -6.316 1.00 0.00 C ATOM 708 NZ LYS A 46 6.697 2.632 -6.855 1.00 0.00 N ATOM 0 H LYS A 46 9.085 -4.459 -8.247 1.00 0.00 H new ATOM 0 HA LYS A 46 10.635 -2.518 -6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.262 -1.495 -8.445 1.00 0.00 H new ATOM 0 HB3 LYS A 46 7.835 -2.283 -7.804 1.00 0.00 H new ATOM 0 HG2 LYS A 46 7.996 -1.002 -5.728 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.520 -0.301 -6.234 1.00 0.00 H new ATOM 0 HD2 LYS A 46 8.525 1.088 -7.823 1.00 0.00 H new ATOM 0 HD3 LYS A 46 7.150 0.026 -8.054 1.00 0.00 H new ATOM 0 HE2 LYS A 46 6.076 0.761 -6.081 1.00 0.00 H new ATOM 0 HE3 LYS A 46 7.560 1.378 -5.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 6.145 3.167 -6.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 7.584 3.137 -7.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 6.146 2.539 -7.732 1.00 0.00 H new ATOM 722 N PRO A 47 9.827 -3.977 -4.714 1.00 0.00 N ATOM 723 CA PRO A 47 9.336 -4.551 -3.458 1.00 0.00 C ATOM 724 C PRO A 47 8.708 -3.499 -2.548 1.00 0.00 C ATOM 725 O PRO A 47 9.412 -2.746 -1.877 1.00 0.00 O ATOM 726 CB PRO A 47 10.599 -5.129 -2.815 1.00 0.00 C ATOM 727 CG PRO A 47 11.716 -4.328 -3.387 1.00 0.00 C ATOM 728 CD PRO A 47 11.297 -3.974 -4.788 1.00 0.00 C ATOM 0 HA PRO A 47 8.551 -5.288 -3.625 1.00 0.00 H new ATOM 0 HB2 PRO A 47 10.565 -5.042 -1.729 1.00 0.00 H new ATOM 0 HB3 PRO A 47 10.712 -6.188 -3.047 1.00 0.00 H new ATOM 0 HG2 PRO A 47 11.896 -3.431 -2.795 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.644 -4.899 -3.390 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.682 -3.000 -5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 47 11.665 -4.700 -5.513 1.00 0.00 H new ATOM 736 N MET A 48 7.380 -3.456 -2.531 1.00 0.00 N ATOM 737 CA MET A 48 6.658 -2.499 -1.701 1.00 0.00 C ATOM 738 C MET A 48 6.194 -3.147 -0.400 1.00 0.00 C ATOM 739 O MET A 48 6.015 -4.363 -0.332 1.00 0.00 O ATOM 740 CB MET A 48 5.454 -1.939 -2.462 1.00 0.00 C ATOM 741 CG MET A 48 4.753 -0.801 -1.737 1.00 0.00 C ATOM 742 SD MET A 48 5.898 0.474 -1.173 1.00 0.00 S ATOM 743 CE MET A 48 6.390 1.201 -2.733 1.00 0.00 C ATOM 0 H MET A 48 6.782 -4.072 -3.082 1.00 0.00 H new ATOM 0 HA MET A 48 7.338 -1.683 -1.457 1.00 0.00 H new ATOM 0 HB2 MET A 48 5.784 -1.588 -3.440 1.00 0.00 H new ATOM 0 HB3 MET A 48 4.739 -2.743 -2.637 1.00 0.00 H new ATOM 0 HG2 MET A 48 4.015 -0.352 -2.401 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.210 -1.201 -0.881 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.423 0.931 -2.950 1.00 0.00 H new ATOM 0 HE2 MET A 48 5.743 0.829 -3.528 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.303 2.286 -2.672 1.00 0.00 H new ATOM 753 N ASP A 49 6.003 -2.328 0.628 1.00 0.00 N ATOM 754 CA ASP A 49 5.560 -2.822 1.926 1.00 0.00 C ATOM 755 C ASP A 49 4.842 -1.727 2.709 1.00 0.00 C ATOM 756 O ASP A 49 4.936 -0.546 2.371 1.00 0.00 O ATOM 757 CB ASP A 49 6.752 -3.343 2.731 1.00 0.00 C ATOM 758 CG ASP A 49 7.498 -4.450 2.011 1.00 0.00 C ATOM 759 OD1 ASP A 49 7.078 -5.620 2.126 1.00 0.00 O ATOM 760 OD2 ASP A 49 8.501 -4.144 1.332 1.00 0.00 O ATOM 0 H ASP A 49 6.148 -1.319 0.588 1.00 0.00 H new ATOM 0 HA ASP A 49 4.860 -3.640 1.756 1.00 0.00 H new ATOM 0 HB2 ASP A 49 7.437 -2.520 2.934 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.402 -3.712 3.695 1.00 0.00 H new ATOM 765 N PHE A 50 4.126 -2.125 3.754 1.00 0.00 N ATOM 766 CA PHE A 50 3.390 -1.178 4.584 1.00 0.00 C ATOM 767 C PHE A 50 4.334 -0.149 5.201 1.00 0.00 C ATOM 768 O PHE A 50 3.982 1.022 5.348 1.00 0.00 O ATOM 769 CB PHE A 50 2.631 -1.917 5.687 1.00 0.00 C ATOM 770 CG PHE A 50 1.244 -2.332 5.285 1.00 0.00 C ATOM 771 CD1 PHE A 50 0.315 -1.388 4.878 1.00 0.00 C ATOM 772 CD2 PHE A 50 0.871 -3.665 5.317 1.00 0.00 C ATOM 773 CE1 PHE A 50 -0.962 -1.767 4.507 1.00 0.00 C ATOM 774 CE2 PHE A 50 -0.405 -4.050 4.947 1.00 0.00 C ATOM 775 CZ PHE A 50 -1.322 -3.099 4.542 1.00 0.00 C ATOM 0 H PHE A 50 4.039 -3.098 4.047 1.00 0.00 H new ATOM 0 HA PHE A 50 2.675 -0.655 3.949 1.00 0.00 H new ATOM 0 HB2 PHE A 50 3.197 -2.802 5.976 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.569 -1.276 6.567 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.591 -0.344 4.850 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.584 -4.412 5.634 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.677 -1.022 4.190 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.684 -5.093 4.975 1.00 0.00 H new ATOM 0 HZ PHE A 50 -2.319 -3.398 4.253 1.00 0.00 H new ATOM 785 N PHE A 51 5.533 -0.595 5.560 1.00 0.00 N ATOM 786 CA PHE A 51 6.527 0.286 6.163 1.00 0.00 C ATOM 787 C PHE A 51 7.329 1.015 5.090 1.00 0.00 C ATOM 788 O PHE A 51 7.689 2.181 5.251 1.00 0.00 O ATOM 789 CB PHE A 51 7.469 -0.515 7.064 1.00 0.00 C ATOM 790 CG PHE A 51 8.791 0.157 7.296 1.00 0.00 C ATOM 791 CD1 PHE A 51 8.928 1.127 8.278 1.00 0.00 C ATOM 792 CD2 PHE A 51 9.898 -0.180 6.535 1.00 0.00 C ATOM 793 CE1 PHE A 51 10.144 1.747 8.494 1.00 0.00 C ATOM 794 CE2 PHE A 51 11.117 0.437 6.747 1.00 0.00 C ATOM 795 CZ PHE A 51 11.239 1.403 7.728 1.00 0.00 C ATOM 0 H PHE A 51 5.840 -1.561 5.444 1.00 0.00 H new ATOM 0 HA PHE A 51 6.002 1.027 6.766 1.00 0.00 H new ATOM 0 HB2 PHE A 51 6.983 -0.685 8.025 1.00 0.00 H new ATOM 0 HB3 PHE A 51 7.642 -1.494 6.617 1.00 0.00 H new ATOM 0 HD1 PHE A 51 8.075 1.401 8.881 1.00 0.00 H new ATOM 0 HD2 PHE A 51 9.808 -0.934 5.767 1.00 0.00 H new ATOM 0 HE1 PHE A 51 10.237 2.501 9.262 1.00 0.00 H new ATOM 0 HE2 PHE A 51 11.973 0.165 6.147 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.190 1.888 7.895 1.00 0.00 H new ATOM 805 N THR A 52 7.608 0.319 3.991 1.00 0.00 N ATOM 806 CA THR A 52 8.369 0.898 2.892 1.00 0.00 C ATOM 807 C THR A 52 7.633 2.083 2.278 1.00 0.00 C ATOM 808 O THR A 52 8.233 3.120 1.996 1.00 0.00 O ATOM 809 CB THR A 52 8.649 -0.144 1.792 1.00 0.00 C ATOM 810 OG1 THR A 52 9.476 -1.192 2.309 1.00 0.00 O ATOM 811 CG2 THR A 52 9.328 0.503 0.595 1.00 0.00 C ATOM 0 H THR A 52 7.318 -0.647 3.840 1.00 0.00 H new ATOM 0 HA THR A 52 9.317 1.239 3.309 1.00 0.00 H new ATOM 0 HB THR A 52 7.696 -0.562 1.466 1.00 0.00 H new ATOM 0 HG1 THR A 52 9.648 -1.851 1.604 1.00 0.00 H new ATOM 0 HG21 THR A 52 9.516 -0.252 -0.169 1.00 0.00 H new ATOM 0 HG22 THR A 52 8.682 1.280 0.186 1.00 0.00 H new ATOM 0 HG23 THR A 52 10.274 0.945 0.908 1.00 0.00 H new ATOM 819 N MET A 53 6.330 1.923 2.073 1.00 0.00 N ATOM 820 CA MET A 53 5.511 2.982 1.494 1.00 0.00 C ATOM 821 C MET A 53 5.497 4.213 2.395 1.00 0.00 C ATOM 822 O MET A 53 5.544 5.346 1.916 1.00 0.00 O ATOM 823 CB MET A 53 4.082 2.485 1.267 1.00 0.00 C ATOM 824 CG MET A 53 3.375 2.066 2.545 1.00 0.00 C ATOM 825 SD MET A 53 1.846 1.163 2.229 1.00 0.00 S ATOM 826 CE MET A 53 0.980 2.322 1.174 1.00 0.00 C ATOM 0 H MET A 53 5.818 1.070 2.299 1.00 0.00 H new ATOM 0 HA MET A 53 5.947 3.261 0.535 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.504 3.273 0.783 1.00 0.00 H new ATOM 0 HB3 MET A 53 4.105 1.639 0.580 1.00 0.00 H new ATOM 0 HG2 MET A 53 4.044 1.443 3.138 1.00 0.00 H new ATOM 0 HG3 MET A 53 3.153 2.952 3.140 1.00 0.00 H new ATOM 0 HE1 MET A 53 -0.095 2.174 1.276 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.235 3.341 1.466 1.00 0.00 H new ATOM 0 HE3 MET A 53 1.272 2.158 0.137 1.00 0.00 H new ATOM 836 N LYS A 54 5.432 3.983 3.703 1.00 0.00 N ATOM 837 CA LYS A 54 5.413 5.072 4.671 1.00 0.00 C ATOM 838 C LYS A 54 6.668 5.931 4.550 1.00 0.00 C ATOM 839 O LYS A 54 6.590 7.159 4.533 1.00 0.00 O ATOM 840 CB LYS A 54 5.299 4.516 6.093 1.00 0.00 C ATOM 841 CG LYS A 54 5.259 5.591 7.165 1.00 0.00 C ATOM 842 CD LYS A 54 3.838 6.044 7.449 1.00 0.00 C ATOM 843 CE LYS A 54 3.787 7.028 8.607 1.00 0.00 C ATOM 844 NZ LYS A 54 3.994 8.432 8.152 1.00 0.00 N ATOM 0 H LYS A 54 5.392 3.051 4.116 1.00 0.00 H new ATOM 0 HA LYS A 54 4.545 5.696 4.460 1.00 0.00 H new ATOM 0 HB2 LYS A 54 4.397 3.909 6.165 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.144 3.855 6.285 1.00 0.00 H new ATOM 0 HG2 LYS A 54 5.710 5.209 8.081 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.857 6.445 6.847 1.00 0.00 H new ATOM 0 HD2 LYS A 54 3.418 6.509 6.557 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.218 5.178 7.679 1.00 0.00 H new ATOM 0 HE2 LYS A 54 2.823 6.948 9.110 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.551 6.767 9.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 4.581 8.939 8.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 4.473 8.431 7.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 3.073 8.908 8.064 1.00 0.00 H new ATOM 858 N GLN A 55 7.822 5.276 4.464 1.00 0.00 N ATOM 859 CA GLN A 55 9.092 5.981 4.344 1.00 0.00 C ATOM 860 C GLN A 55 9.060 6.965 3.180 1.00 0.00 C ATOM 861 O GLN A 55 9.403 8.136 3.335 1.00 0.00 O ATOM 862 CB GLN A 55 10.236 4.983 4.152 1.00 0.00 C ATOM 863 CG GLN A 55 10.380 3.995 5.298 1.00 0.00 C ATOM 864 CD GLN A 55 11.174 4.559 6.460 1.00 0.00 C ATOM 865 OE1 GLN A 55 12.390 4.730 6.371 1.00 0.00 O ATOM 866 NE2 GLN A 55 10.488 4.852 7.559 1.00 0.00 N ATOM 0 H GLN A 55 7.903 4.259 4.475 1.00 0.00 H new ATOM 0 HA GLN A 55 9.257 6.541 5.265 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.074 4.431 3.226 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.171 5.532 4.037 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.390 3.703 5.647 1.00 0.00 H new ATOM 0 HG3 GLN A 55 10.869 3.091 4.934 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.481 4.694 7.589 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.968 5.235 8.373 1.00 0.00 H new ATOM 875 N ASN A 56 8.646 6.481 2.013 1.00 0.00 N ATOM 876 CA ASN A 56 8.570 7.319 0.823 1.00 0.00 C ATOM 877 C ASN A 56 7.564 8.451 1.016 1.00 0.00 C ATOM 878 O ASN A 56 7.765 9.564 0.529 1.00 0.00 O ATOM 879 CB ASN A 56 8.179 6.478 -0.394 1.00 0.00 C ATOM 880 CG ASN A 56 9.235 5.448 -0.747 1.00 0.00 C ATOM 881 OD1 ASN A 56 10.424 5.651 -0.501 1.00 0.00 O ATOM 882 ND2 ASN A 56 8.803 4.334 -1.329 1.00 0.00 N ATOM 0 H ASN A 56 8.358 5.513 1.867 1.00 0.00 H new ATOM 0 HA ASN A 56 9.554 7.756 0.655 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.234 5.972 -0.195 1.00 0.00 H new ATOM 0 HB3 ASN A 56 8.015 7.134 -1.249 1.00 0.00 H new ATOM 0 HD21 ASN A 56 9.467 3.605 -1.591 1.00 0.00 H new ATOM 0 HD22 ASN A 56 7.808 4.208 -1.514 1.00 0.00 H new ATOM 889 N LEU A 57 6.483 8.157 1.729 1.00 0.00 N ATOM 890 CA LEU A 57 5.446 9.150 1.989 1.00 0.00 C ATOM 891 C LEU A 57 5.981 10.282 2.861 1.00 0.00 C ATOM 892 O LEU A 57 5.741 11.456 2.585 1.00 0.00 O ATOM 893 CB LEU A 57 4.242 8.493 2.668 1.00 0.00 C ATOM 894 CG LEU A 57 3.335 9.423 3.473 1.00 0.00 C ATOM 895 CD1 LEU A 57 1.902 8.913 3.464 1.00 0.00 C ATOM 896 CD2 LEU A 57 3.845 9.560 4.900 1.00 0.00 C ATOM 0 H LEU A 57 6.301 7.240 2.137 1.00 0.00 H new ATOM 0 HA LEU A 57 5.132 9.570 1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.640 8.005 1.902 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.608 7.710 3.333 1.00 0.00 H new ATOM 0 HG LEU A 57 3.350 10.408 3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.272 9.589 4.042 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.539 8.867 2.437 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.867 7.917 3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.187 10.226 5.459 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.860 8.580 5.377 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.854 9.973 4.888 1.00 0.00 H new ATOM 908 N GLU A 58 6.707 9.918 3.913 1.00 0.00 N ATOM 909 CA GLU A 58 7.277 10.904 4.825 1.00 0.00 C ATOM 910 C GLU A 58 8.349 11.734 4.126 1.00 0.00 C ATOM 911 O GLU A 58 8.772 12.773 4.631 1.00 0.00 O ATOM 912 CB GLU A 58 7.870 10.212 6.053 1.00 0.00 C ATOM 913 CG GLU A 58 6.825 9.615 6.980 1.00 0.00 C ATOM 914 CD GLU A 58 7.282 9.573 8.426 1.00 0.00 C ATOM 915 OE1 GLU A 58 7.956 8.594 8.808 1.00 0.00 O ATOM 916 OE2 GLU A 58 6.967 10.523 9.174 1.00 0.00 O ATOM 0 H GLU A 58 6.914 8.949 4.155 1.00 0.00 H new ATOM 0 HA GLU A 58 6.477 11.572 5.145 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.545 9.422 5.724 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.470 10.931 6.611 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.907 10.199 6.910 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.586 8.604 6.649 1.00 0.00 H new ATOM 923 N ALA A 59 8.786 11.267 2.961 1.00 0.00 N ATOM 924 CA ALA A 59 9.808 11.965 2.192 1.00 0.00 C ATOM 925 C ALA A 59 9.181 12.824 1.099 1.00 0.00 C ATOM 926 O ALA A 59 9.881 13.364 0.242 1.00 0.00 O ATOM 927 CB ALA A 59 10.786 10.969 1.587 1.00 0.00 C ATOM 0 H ALA A 59 8.447 10.407 2.529 1.00 0.00 H new ATOM 0 HA ALA A 59 10.351 12.624 2.870 1.00 0.00 H new ATOM 0 HB1 ALA A 59 11.544 11.505 1.015 1.00 0.00 H new ATOM 0 HB2 ALA A 59 11.266 10.401 2.384 1.00 0.00 H new ATOM 0 HB3 ALA A 59 10.249 10.287 0.928 1.00 0.00 H new ATOM 933 N TYR A 60 7.859 12.947 1.134 1.00 0.00 N ATOM 934 CA TYR A 60 7.137 13.739 0.144 1.00 0.00 C ATOM 935 C TYR A 60 7.327 13.163 -1.255 1.00 0.00 C ATOM 936 O TYR A 60 7.562 13.899 -2.215 1.00 0.00 O ATOM 937 CB TYR A 60 7.612 15.192 0.179 1.00 0.00 C ATOM 938 CG TYR A 60 7.018 15.995 1.315 1.00 0.00 C ATOM 939 CD1 TYR A 60 7.406 15.769 2.629 1.00 0.00 C ATOM 940 CD2 TYR A 60 6.069 16.981 1.072 1.00 0.00 C ATOM 941 CE1 TYR A 60 6.867 16.499 3.670 1.00 0.00 C ATOM 942 CE2 TYR A 60 5.525 17.717 2.106 1.00 0.00 C ATOM 943 CZ TYR A 60 5.926 17.473 3.403 1.00 0.00 C ATOM 944 OH TYR A 60 5.386 18.204 4.436 1.00 0.00 O ATOM 0 H TYR A 60 7.265 12.508 1.837 1.00 0.00 H new ATOM 0 HA TYR A 60 6.076 13.705 0.390 1.00 0.00 H new ATOM 0 HB2 TYR A 60 8.699 15.209 0.263 1.00 0.00 H new ATOM 0 HB3 TYR A 60 7.358 15.672 -0.766 1.00 0.00 H new ATOM 0 HD1 TYR A 60 8.143 15.008 2.841 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.752 17.175 0.058 1.00 0.00 H new ATOM 0 HE1 TYR A 60 7.180 16.309 4.686 1.00 0.00 H new ATOM 0 HE2 TYR A 60 4.789 18.480 1.900 1.00 0.00 H new ATOM 0 HH TYR A 60 4.740 18.849 4.078 1.00 0.00 H new ATOM 954 N ARG A 61 7.223 11.842 -1.365 1.00 0.00 N ATOM 955 CA ARG A 61 7.383 11.167 -2.647 1.00 0.00 C ATOM 956 C ARG A 61 6.030 10.938 -3.314 1.00 0.00 C ATOM 957 O ARG A 61 5.941 10.814 -4.535 1.00 0.00 O ATOM 958 CB ARG A 61 8.104 9.831 -2.457 1.00 0.00 C ATOM 959 CG ARG A 61 9.575 9.976 -2.106 1.00 0.00 C ATOM 960 CD ARG A 61 10.370 8.746 -2.515 1.00 0.00 C ATOM 961 NE ARG A 61 11.800 9.025 -2.612 1.00 0.00 N ATOM 962 CZ ARG A 61 12.379 9.530 -3.695 1.00 0.00 C ATOM 963 NH1 ARG A 61 11.654 9.811 -4.768 1.00 0.00 N ATOM 964 NH2 ARG A 61 13.687 9.756 -3.705 1.00 0.00 N ATOM 0 H ARG A 61 7.029 11.219 -0.581 1.00 0.00 H new ATOM 0 HA ARG A 61 7.983 11.807 -3.294 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.605 9.268 -1.668 1.00 0.00 H new ATOM 0 HB3 ARG A 61 8.014 9.246 -3.372 1.00 0.00 H new ATOM 0 HG2 ARG A 61 9.983 10.856 -2.603 1.00 0.00 H new ATOM 0 HG3 ARG A 61 9.680 10.138 -1.033 1.00 0.00 H new ATOM 0 HD2 ARG A 61 10.205 7.950 -1.789 1.00 0.00 H new ATOM 0 HD3 ARG A 61 10.006 8.382 -3.476 1.00 0.00 H new ATOM 0 HE ARG A 61 12.387 8.821 -1.803 1.00 0.00 H new ATOM 0 HH11 ARG A 61 10.649 9.639 -4.763 1.00 0.00 H new ATOM 0 HH12 ARG A 61 12.101 10.199 -5.599 1.00 0.00 H new ATOM 0 HH21 ARG A 61 14.248 9.542 -2.880 1.00 0.00 H new ATOM 0 HH22 ARG A 61 14.131 10.144 -4.537 1.00 0.00 H new ATOM 978 N TYR A 62 4.980 10.882 -2.503 1.00 0.00 N ATOM 979 CA TYR A 62 3.631 10.665 -3.013 1.00 0.00 C ATOM 980 C TYR A 62 2.818 11.955 -2.972 1.00 0.00 C ATOM 981 O TYR A 62 2.357 12.378 -1.910 1.00 0.00 O ATOM 982 CB TYR A 62 2.925 9.578 -2.201 1.00 0.00 C ATOM 983 CG TYR A 62 3.665 8.260 -2.182 1.00 0.00 C ATOM 984 CD1 TYR A 62 4.231 7.741 -3.341 1.00 0.00 C ATOM 985 CD2 TYR A 62 3.800 7.533 -1.005 1.00 0.00 C ATOM 986 CE1 TYR A 62 4.908 6.537 -3.328 1.00 0.00 C ATOM 987 CE2 TYR A 62 4.476 6.329 -0.983 1.00 0.00 C ATOM 988 CZ TYR A 62 5.027 5.834 -2.146 1.00 0.00 C ATOM 989 OH TYR A 62 5.702 4.636 -2.129 1.00 0.00 O ATOM 0 H TYR A 62 5.037 10.984 -1.490 1.00 0.00 H new ATOM 0 HA TYR A 62 3.711 10.341 -4.051 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.796 9.927 -1.177 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.928 9.419 -2.612 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.140 8.289 -4.267 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.369 7.916 -0.092 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.342 6.148 -4.237 1.00 0.00 H new ATOM 0 HE2 TYR A 62 4.573 5.778 -0.059 1.00 0.00 H new ATOM 0 HH TYR A 62 6.228 4.545 -2.951 1.00 0.00 H new ATOM 999 N LEU A 63 2.646 12.576 -4.133 1.00 0.00 N ATOM 1000 CA LEU A 63 1.888 13.819 -4.232 1.00 0.00 C ATOM 1001 C LEU A 63 0.479 13.557 -4.757 1.00 0.00 C ATOM 1002 O LEU A 63 -0.456 14.295 -4.448 1.00 0.00 O ATOM 1003 CB LEU A 63 2.610 14.808 -5.147 1.00 0.00 C ATOM 1004 CG LEU A 63 4.040 15.172 -4.748 1.00 0.00 C ATOM 1005 CD1 LEU A 63 4.862 15.533 -5.976 1.00 0.00 C ATOM 1006 CD2 LEU A 63 4.040 16.318 -3.748 1.00 0.00 C ATOM 0 H LEU A 63 3.021 12.239 -5.020 1.00 0.00 H new ATOM 0 HA LEU A 63 1.810 14.249 -3.233 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.630 14.392 -6.154 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.023 15.725 -5.193 1.00 0.00 H new ATOM 0 HG LEU A 63 4.496 14.303 -4.274 1.00 0.00 H new ATOM 0 HD11 LEU A 63 5.877 15.789 -5.672 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.891 14.683 -6.657 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.408 16.386 -6.480 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.067 16.563 -3.476 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.565 17.191 -4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.489 16.022 -2.856 1.00 0.00 H new ATOM 1018 N ASN A 64 0.336 12.500 -5.550 1.00 0.00 N ATOM 1019 CA ASN A 64 -0.960 12.139 -6.116 1.00 0.00 C ATOM 1020 C ASN A 64 -1.432 10.792 -5.579 1.00 0.00 C ATOM 1021 O ASN A 64 -0.625 9.903 -5.306 1.00 0.00 O ATOM 1022 CB ASN A 64 -0.876 12.092 -7.643 1.00 0.00 C ATOM 1023 CG ASN A 64 0.299 11.266 -8.133 1.00 0.00 C ATOM 1024 OD1 ASN A 64 0.271 10.037 -8.081 1.00 0.00 O ATOM 1025 ND2 ASN A 64 1.338 11.940 -8.611 1.00 0.00 N ATOM 0 H ASN A 64 1.100 11.879 -5.815 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.683 12.900 -5.821 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.801 11.676 -8.042 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.790 13.107 -8.031 1.00 0.00 H new ATOM 0 HD21 ASN A 64 2.157 11.438 -8.954 1.00 0.00 H new ATOM 0 HD22 ASN A 64 1.317 12.960 -8.635 1.00 0.00 H new ATOM 1032 N PHE A 65 -2.744 10.648 -5.431 1.00 0.00 N ATOM 1033 CA PHE A 65 -3.325 9.409 -4.927 1.00 0.00 C ATOM 1034 C PHE A 65 -2.876 8.217 -5.766 1.00 0.00 C ATOM 1035 O PHE A 65 -2.406 7.210 -5.234 1.00 0.00 O ATOM 1036 CB PHE A 65 -4.853 9.500 -4.926 1.00 0.00 C ATOM 1037 CG PHE A 65 -5.508 8.566 -3.949 1.00 0.00 C ATOM 1038 CD1 PHE A 65 -5.422 8.797 -2.586 1.00 0.00 C ATOM 1039 CD2 PHE A 65 -6.212 7.459 -4.395 1.00 0.00 C ATOM 1040 CE1 PHE A 65 -6.023 7.939 -1.685 1.00 0.00 C ATOM 1041 CE2 PHE A 65 -6.816 6.597 -3.498 1.00 0.00 C ATOM 1042 CZ PHE A 65 -6.723 6.839 -2.141 1.00 0.00 C ATOM 0 H PHE A 65 -3.426 11.374 -5.653 1.00 0.00 H new ATOM 0 HA PHE A 65 -2.976 9.263 -3.905 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -5.148 10.523 -4.692 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -5.223 9.283 -5.928 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -4.879 9.657 -2.223 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -6.290 7.267 -5.455 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -5.945 8.128 -0.625 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -7.360 5.736 -3.858 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.197 6.170 -1.438 1.00 0.00 H new ATOM 1052 N ASP A 66 -3.024 8.337 -7.081 1.00 0.00 N ATOM 1053 CA ASP A 66 -2.635 7.270 -7.995 1.00 0.00 C ATOM 1054 C ASP A 66 -1.287 6.677 -7.595 1.00 0.00 C ATOM 1055 O ASP A 66 -1.060 5.475 -7.737 1.00 0.00 O ATOM 1056 CB ASP A 66 -2.568 7.797 -9.429 1.00 0.00 C ATOM 1057 CG ASP A 66 -2.303 6.697 -10.438 1.00 0.00 C ATOM 1058 OD1 ASP A 66 -1.608 5.722 -10.084 1.00 0.00 O ATOM 1059 OD2 ASP A 66 -2.790 6.812 -11.584 1.00 0.00 O ATOM 0 H ASP A 66 -3.411 9.163 -7.538 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.389 6.485 -7.939 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.507 8.293 -9.675 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -1.782 8.549 -9.500 1.00 0.00 H new ATOM 1064 N ASP A 67 -0.398 7.528 -7.095 1.00 0.00 N ATOM 1065 CA ASP A 67 0.928 7.088 -6.674 1.00 0.00 C ATOM 1066 C ASP A 67 0.849 6.295 -5.373 1.00 0.00 C ATOM 1067 O ASP A 67 1.274 5.140 -5.311 1.00 0.00 O ATOM 1068 CB ASP A 67 1.855 8.291 -6.497 1.00 0.00 C ATOM 1069 CG ASP A 67 2.528 8.699 -7.792 1.00 0.00 C ATOM 1070 OD1 ASP A 67 2.687 7.832 -8.677 1.00 0.00 O ATOM 1071 OD2 ASP A 67 2.896 9.886 -7.923 1.00 0.00 O ATOM 0 H ASP A 67 -0.571 8.526 -6.971 1.00 0.00 H new ATOM 0 HA ASP A 67 1.333 6.439 -7.450 1.00 0.00 H new ATOM 0 HB2 ASP A 67 1.282 9.133 -6.108 1.00 0.00 H new ATOM 0 HB3 ASP A 67 2.617 8.053 -5.755 1.00 0.00 H new ATOM 1076 N PHE A 68 0.305 6.921 -4.336 1.00 0.00 N ATOM 1077 CA PHE A 68 0.173 6.275 -3.035 1.00 0.00 C ATOM 1078 C PHE A 68 -0.537 4.930 -3.166 1.00 0.00 C ATOM 1079 O PHE A 68 -0.232 3.984 -2.441 1.00 0.00 O ATOM 1080 CB PHE A 68 -0.595 7.178 -2.068 1.00 0.00 C ATOM 1081 CG PHE A 68 -0.840 6.549 -0.726 1.00 0.00 C ATOM 1082 CD1 PHE A 68 0.077 6.700 0.302 1.00 0.00 C ATOM 1083 CD2 PHE A 68 -1.988 5.808 -0.493 1.00 0.00 C ATOM 1084 CE1 PHE A 68 -0.146 6.121 1.537 1.00 0.00 C ATOM 1085 CE2 PHE A 68 -2.215 5.228 0.740 1.00 0.00 C ATOM 1086 CZ PHE A 68 -1.294 5.385 1.757 1.00 0.00 C ATOM 0 H PHE A 68 -0.052 7.876 -4.371 1.00 0.00 H new ATOM 0 HA PHE A 68 1.174 6.101 -2.640 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.039 8.105 -1.930 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.552 7.445 -2.515 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.975 7.276 0.136 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.713 5.683 -1.284 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.577 6.244 2.330 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.113 4.652 0.909 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.471 4.933 2.722 1.00 0.00 H new ATOM 1096 N GLU A 69 -1.484 4.856 -4.095 1.00 0.00 N ATOM 1097 CA GLU A 69 -2.238 3.628 -4.319 1.00 0.00 C ATOM 1098 C GLU A 69 -1.375 2.580 -5.016 1.00 0.00 C ATOM 1099 O GLU A 69 -1.294 1.435 -4.573 1.00 0.00 O ATOM 1100 CB GLU A 69 -3.487 3.916 -5.156 1.00 0.00 C ATOM 1101 CG GLU A 69 -4.258 2.667 -5.547 1.00 0.00 C ATOM 1102 CD GLU A 69 -5.645 2.979 -6.073 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -5.746 3.526 -7.191 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -6.630 2.677 -5.367 1.00 0.00 O ATOM 0 H GLU A 69 -1.747 5.631 -4.704 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.542 3.236 -3.349 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.146 4.579 -4.595 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.193 4.450 -6.060 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.699 2.123 -6.308 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.341 2.010 -4.681 1.00 0.00 H new ATOM 1111 N GLU A 70 -0.735 2.981 -6.110 1.00 0.00 N ATOM 1112 CA GLU A 70 0.120 2.076 -6.868 1.00 0.00 C ATOM 1113 C GLU A 70 0.946 1.196 -5.935 1.00 0.00 C ATOM 1114 O GLU A 70 0.968 -0.027 -6.075 1.00 0.00 O ATOM 1115 CB GLU A 70 1.047 2.869 -7.793 1.00 0.00 C ATOM 1116 CG GLU A 70 1.940 1.994 -8.657 1.00 0.00 C ATOM 1117 CD GLU A 70 1.155 0.970 -9.455 1.00 0.00 C ATOM 1118 OE1 GLU A 70 0.673 1.318 -10.554 1.00 0.00 O ATOM 1119 OE2 GLU A 70 1.024 -0.178 -8.982 1.00 0.00 O ATOM 0 H GLU A 70 -0.793 3.926 -6.491 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.521 1.433 -7.471 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.443 3.507 -8.439 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.672 3.527 -7.190 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.508 2.624 -9.341 1.00 0.00 H new ATOM 0 HG3 GLU A 70 2.662 1.480 -8.023 1.00 0.00 H new ATOM 1126 N ASP A 71 1.624 1.827 -4.983 1.00 0.00 N ATOM 1127 CA ASP A 71 2.451 1.102 -4.024 1.00 0.00 C ATOM 1128 C ASP A 71 1.649 0.000 -3.339 1.00 0.00 C ATOM 1129 O ASP A 71 1.997 -1.177 -3.422 1.00 0.00 O ATOM 1130 CB ASP A 71 3.018 2.064 -2.979 1.00 0.00 C ATOM 1131 CG ASP A 71 3.310 3.437 -3.553 1.00 0.00 C ATOM 1132 OD1 ASP A 71 4.101 3.522 -4.515 1.00 0.00 O ATOM 1133 OD2 ASP A 71 2.747 4.427 -3.039 1.00 0.00 O ATOM 0 H ASP A 71 1.618 2.839 -4.854 1.00 0.00 H new ATOM 0 HA ASP A 71 3.276 0.641 -4.567 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.310 2.161 -2.156 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.934 1.645 -2.563 1.00 0.00 H new ATOM 1138 N PHE A 72 0.576 0.392 -2.660 1.00 0.00 N ATOM 1139 CA PHE A 72 -0.274 -0.562 -1.958 1.00 0.00 C ATOM 1140 C PHE A 72 -0.583 -1.768 -2.840 1.00 0.00 C ATOM 1141 O PHE A 72 -0.512 -2.912 -2.393 1.00 0.00 O ATOM 1142 CB PHE A 72 -1.577 0.110 -1.519 1.00 0.00 C ATOM 1143 CG PHE A 72 -2.608 -0.857 -1.011 1.00 0.00 C ATOM 1144 CD1 PHE A 72 -3.498 -1.464 -1.882 1.00 0.00 C ATOM 1145 CD2 PHE A 72 -2.687 -1.159 0.339 1.00 0.00 C ATOM 1146 CE1 PHE A 72 -4.449 -2.352 -1.417 1.00 0.00 C ATOM 1147 CE2 PHE A 72 -3.635 -2.048 0.811 1.00 0.00 C ATOM 1148 CZ PHE A 72 -4.517 -2.646 -0.069 1.00 0.00 C ATOM 0 H PHE A 72 0.275 1.363 -2.581 1.00 0.00 H new ATOM 0 HA PHE A 72 0.264 -0.908 -1.075 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.356 0.837 -0.738 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -1.993 0.663 -2.361 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -3.448 -1.240 -2.937 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.000 -0.694 1.031 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.139 -2.816 -2.107 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.686 -2.275 1.866 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.258 -3.342 0.296 1.00 0.00 H new ATOM 1158 N ASN A 73 -0.927 -1.502 -4.097 1.00 0.00 N ATOM 1159 CA ASN A 73 -1.247 -2.565 -5.042 1.00 0.00 C ATOM 1160 C ASN A 73 -0.113 -3.582 -5.124 1.00 0.00 C ATOM 1161 O ASN A 73 -0.344 -4.790 -5.086 1.00 0.00 O ATOM 1162 CB ASN A 73 -1.520 -1.977 -6.429 1.00 0.00 C ATOM 1163 CG ASN A 73 -2.483 -0.806 -6.380 1.00 0.00 C ATOM 1164 OD1 ASN A 73 -3.080 -0.521 -5.342 1.00 0.00 O ATOM 1165 ND2 ASN A 73 -2.636 -0.120 -7.506 1.00 0.00 N ATOM 0 H ASN A 73 -0.991 -0.560 -4.484 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.143 -3.075 -4.686 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.580 -1.653 -6.875 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -1.928 -2.753 -7.076 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.269 0.679 -7.534 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.121 -0.392 -8.343 1.00 0.00 H new ATOM 1172 N LEU A 74 1.114 -3.084 -5.233 1.00 0.00 N ATOM 1173 CA LEU A 74 2.286 -3.948 -5.320 1.00 0.00 C ATOM 1174 C LEU A 74 2.329 -4.924 -4.148 1.00 0.00 C ATOM 1175 O LEU A 74 2.317 -6.141 -4.342 1.00 0.00 O ATOM 1176 CB LEU A 74 3.564 -3.107 -5.345 1.00 0.00 C ATOM 1177 CG LEU A 74 3.910 -2.451 -6.681 1.00 0.00 C ATOM 1178 CD1 LEU A 74 4.925 -1.336 -6.483 1.00 0.00 C ATOM 1179 CD2 LEU A 74 4.439 -3.487 -7.662 1.00 0.00 C ATOM 0 H LEU A 74 1.323 -2.086 -5.263 1.00 0.00 H new ATOM 0 HA LEU A 74 2.218 -4.521 -6.245 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.475 -2.325 -4.591 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.399 -3.742 -5.048 1.00 0.00 H new ATOM 0 HG LEU A 74 3.001 -2.016 -7.096 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.158 -0.881 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.510 -0.580 -5.816 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.835 -1.746 -6.045 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.680 -3.002 -8.608 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.336 -3.951 -7.253 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.680 -4.251 -7.829 1.00 0.00 H new ATOM 1191 N ILE A 75 2.378 -4.384 -2.936 1.00 0.00 N ATOM 1192 CA ILE A 75 2.419 -5.208 -1.734 1.00 0.00 C ATOM 1193 C ILE A 75 1.567 -6.462 -1.897 1.00 0.00 C ATOM 1194 O ILE A 75 1.910 -7.530 -1.389 1.00 0.00 O ATOM 1195 CB ILE A 75 1.932 -4.427 -0.500 1.00 0.00 C ATOM 1196 CG1 ILE A 75 2.791 -3.180 -0.286 1.00 0.00 C ATOM 1197 CG2 ILE A 75 1.962 -5.316 0.736 1.00 0.00 C ATOM 1198 CD1 ILE A 75 2.344 -2.330 0.884 1.00 0.00 C ATOM 0 H ILE A 75 2.390 -3.379 -2.760 1.00 0.00 H new ATOM 0 HA ILE A 75 3.460 -5.496 -1.584 1.00 0.00 H new ATOM 0 HB ILE A 75 0.903 -4.111 -0.672 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.826 -3.484 -0.129 1.00 0.00 H new ATOM 0 HG13 ILE A 75 2.771 -2.575 -1.193 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.615 -4.750 1.600 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.311 -6.177 0.581 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.981 -5.659 0.913 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.999 -1.463 0.975 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.320 -1.995 0.720 1.00 0.00 H new ATOM 0 HD13 ILE A 75 2.391 -2.919 1.800 1.00 0.00 H new ATOM 1210 N VAL A 76 0.454 -6.325 -2.612 1.00 0.00 N ATOM 1211 CA VAL A 76 -0.447 -7.448 -2.846 1.00 0.00 C ATOM 1212 C VAL A 76 -0.018 -8.251 -4.069 1.00 0.00 C ATOM 1213 O VAL A 76 0.068 -9.478 -4.020 1.00 0.00 O ATOM 1214 CB VAL A 76 -1.898 -6.972 -3.040 1.00 0.00 C ATOM 1215 CG1 VAL A 76 -2.793 -8.134 -3.443 1.00 0.00 C ATOM 1216 CG2 VAL A 76 -2.415 -6.305 -1.774 1.00 0.00 C ATOM 0 H VAL A 76 0.155 -5.448 -3.039 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.397 -8.084 -1.962 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.915 -6.236 -3.844 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.815 -7.778 -3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.434 -8.562 -4.379 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.773 -8.896 -2.664 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.442 -5.975 -1.930 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.384 -7.017 -0.949 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.790 -5.445 -1.535 1.00 0.00 H new ATOM 1226 N SER A 77 0.250 -7.550 -5.166 1.00 0.00 N ATOM 1227 CA SER A 77 0.667 -8.197 -6.405 1.00 0.00 C ATOM 1228 C SER A 77 1.984 -8.941 -6.211 1.00 0.00 C ATOM 1229 O SER A 77 2.033 -10.168 -6.283 1.00 0.00 O ATOM 1230 CB SER A 77 0.810 -7.163 -7.523 1.00 0.00 C ATOM 1231 OG SER A 77 0.608 -7.754 -8.794 1.00 0.00 O ATOM 0 H SER A 77 0.186 -6.534 -5.222 1.00 0.00 H new ATOM 0 HA SER A 77 -0.100 -8.919 -6.686 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.089 -6.359 -7.374 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.802 -6.713 -7.481 1.00 0.00 H new ATOM 0 HG SER A 77 0.703 -7.072 -9.491 1.00 0.00 H new ATOM 1237 N ASN A 78 3.052 -8.187 -5.967 1.00 0.00 N ATOM 1238 CA ASN A 78 4.372 -8.774 -5.764 1.00 0.00 C ATOM 1239 C ASN A 78 4.272 -10.080 -4.981 1.00 0.00 C ATOM 1240 O ASN A 78 5.059 -11.003 -5.192 1.00 0.00 O ATOM 1241 CB ASN A 78 5.282 -7.791 -5.024 1.00 0.00 C ATOM 1242 CG ASN A 78 5.683 -6.612 -5.890 1.00 0.00 C ATOM 1243 OD1 ASN A 78 5.748 -6.720 -7.114 1.00 0.00 O ATOM 1244 ND2 ASN A 78 5.956 -5.478 -5.256 1.00 0.00 N ATOM 0 H ASN A 78 3.029 -7.169 -5.905 1.00 0.00 H new ATOM 0 HA ASN A 78 4.801 -8.990 -6.743 1.00 0.00 H new ATOM 0 HB2 ASN A 78 4.771 -7.427 -4.133 1.00 0.00 H new ATOM 0 HB3 ASN A 78 6.178 -8.312 -4.687 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.233 -4.651 -5.786 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.889 -5.433 -4.239 1.00 0.00 H new ATOM 1251 N CYS A 79 3.300 -10.148 -4.079 1.00 0.00 N ATOM 1252 CA CYS A 79 3.098 -11.341 -3.264 1.00 0.00 C ATOM 1253 C CYS A 79 2.329 -12.406 -4.039 1.00 0.00 C ATOM 1254 O CYS A 79 2.661 -13.591 -3.984 1.00 0.00 O ATOM 1255 CB CYS A 79 2.346 -10.985 -1.980 1.00 0.00 C ATOM 1256 SG CYS A 79 2.404 -12.271 -0.710 1.00 0.00 S ATOM 0 H CYS A 79 2.640 -9.393 -3.893 1.00 0.00 H new ATOM 0 HA CYS A 79 4.077 -11.743 -3.004 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.764 -10.065 -1.570 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.304 -10.780 -2.227 1.00 0.00 H new ATOM 0 HG CYS A 79 1.257 -12.332 -0.101 1.00 0.00 H new ATOM 1262 N LEU A 80 1.298 -11.977 -4.760 1.00 0.00 N ATOM 1263 CA LEU A 80 0.480 -12.893 -5.546 1.00 0.00 C ATOM 1264 C LEU A 80 1.221 -13.347 -6.800 1.00 0.00 C ATOM 1265 O LEU A 80 0.783 -14.261 -7.497 1.00 0.00 O ATOM 1266 CB LEU A 80 -0.840 -12.224 -5.934 1.00 0.00 C ATOM 1267 CG LEU A 80 -1.752 -11.815 -4.778 1.00 0.00 C ATOM 1268 CD1 LEU A 80 -2.716 -10.724 -5.217 1.00 0.00 C ATOM 1269 CD2 LEU A 80 -2.512 -13.021 -4.246 1.00 0.00 C ATOM 0 H LEU A 80 1.009 -11.000 -4.816 1.00 0.00 H new ATOM 0 HA LEU A 80 0.270 -13.770 -4.933 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.614 -11.335 -6.523 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.392 -12.905 -6.582 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.132 -11.419 -3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.357 -10.446 -4.380 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.152 -9.852 -5.547 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.331 -11.091 -6.039 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.156 -12.711 -3.423 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.121 -13.448 -5.043 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.804 -13.769 -3.890 1.00 0.00 H new ATOM 1281 N LYS A 81 2.350 -12.702 -7.079 1.00 0.00 N ATOM 1282 CA LYS A 81 3.155 -13.041 -8.246 1.00 0.00 C ATOM 1283 C LYS A 81 4.354 -13.897 -7.849 1.00 0.00 C ATOM 1284 O LYS A 81 4.882 -14.658 -8.662 1.00 0.00 O ATOM 1285 CB LYS A 81 3.634 -11.768 -8.947 1.00 0.00 C ATOM 1286 CG LYS A 81 4.971 -11.258 -8.438 1.00 0.00 C ATOM 1287 CD LYS A 81 5.482 -10.097 -9.274 1.00 0.00 C ATOM 1288 CE LYS A 81 6.262 -10.582 -10.486 1.00 0.00 C ATOM 1289 NZ LYS A 81 7.412 -11.444 -10.096 1.00 0.00 N ATOM 0 H LYS A 81 2.727 -11.942 -6.513 1.00 0.00 H new ATOM 0 HA LYS A 81 2.532 -13.615 -8.933 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.712 -11.960 -10.017 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.884 -10.988 -8.817 1.00 0.00 H new ATOM 0 HG2 LYS A 81 4.869 -10.942 -7.400 1.00 0.00 H new ATOM 0 HG3 LYS A 81 5.700 -12.068 -8.455 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.641 -9.486 -9.602 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.119 -9.459 -8.661 1.00 0.00 H new ATOM 0 HE2 LYS A 81 5.598 -11.139 -11.146 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.626 -9.724 -11.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 8.296 -11.022 -10.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 7.452 -11.522 -9.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 7.292 -12.391 -10.510 1.00 0.00 H new ATOM 1303 N TYR A 82 4.779 -13.768 -6.597 1.00 0.00 N ATOM 1304 CA TYR A 82 5.916 -14.530 -6.094 1.00 0.00 C ATOM 1305 C TYR A 82 5.481 -15.916 -5.628 1.00 0.00 C ATOM 1306 O TYR A 82 6.069 -16.926 -6.014 1.00 0.00 O ATOM 1307 CB TYR A 82 6.588 -13.781 -4.942 1.00 0.00 C ATOM 1308 CG TYR A 82 8.024 -14.191 -4.710 1.00 0.00 C ATOM 1309 CD1 TYR A 82 8.956 -14.147 -5.740 1.00 0.00 C ATOM 1310 CD2 TYR A 82 8.450 -14.621 -3.459 1.00 0.00 C ATOM 1311 CE1 TYR A 82 10.269 -14.521 -5.531 1.00 0.00 C ATOM 1312 CE2 TYR A 82 9.763 -14.997 -3.241 1.00 0.00 C ATOM 1313 CZ TYR A 82 10.667 -14.945 -4.281 1.00 0.00 C ATOM 1314 OH TYR A 82 11.975 -15.318 -4.070 1.00 0.00 O ATOM 0 H TYR A 82 4.354 -13.143 -5.912 1.00 0.00 H new ATOM 0 HA TYR A 82 6.630 -14.648 -6.909 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.553 -12.711 -5.146 1.00 0.00 H new ATOM 0 HB3 TYR A 82 6.018 -13.950 -4.028 1.00 0.00 H new ATOM 0 HD1 TYR A 82 8.648 -13.815 -6.720 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.744 -14.662 -2.643 1.00 0.00 H new ATOM 0 HE1 TYR A 82 10.980 -14.482 -6.343 1.00 0.00 H new ATOM 0 HE2 TYR A 82 10.078 -15.329 -2.263 1.00 0.00 H new ATOM 0 HH TYR A 82 12.571 -14.714 -4.561 1.00 0.00 H new ATOM 1324 N ASN A 83 4.443 -15.955 -4.799 1.00 0.00 N ATOM 1325 CA ASN A 83 3.927 -17.217 -4.280 1.00 0.00 C ATOM 1326 C ASN A 83 2.569 -17.544 -4.894 1.00 0.00 C ATOM 1327 O ASN A 83 2.090 -16.833 -5.778 1.00 0.00 O ATOM 1328 CB ASN A 83 3.808 -17.156 -2.756 1.00 0.00 C ATOM 1329 CG ASN A 83 5.119 -16.783 -2.088 1.00 0.00 C ATOM 1330 OD1 ASN A 83 6.078 -17.554 -2.108 1.00 0.00 O ATOM 1331 ND2 ASN A 83 5.163 -15.597 -1.493 1.00 0.00 N ATOM 0 H ASN A 83 3.943 -15.128 -4.472 1.00 0.00 H new ATOM 0 HA ASN A 83 4.628 -18.006 -4.552 1.00 0.00 H new ATOM 0 HB2 ASN A 83 3.044 -16.428 -2.483 1.00 0.00 H new ATOM 0 HB3 ASN A 83 3.475 -18.124 -2.381 1.00 0.00 H new ATOM 0 HD21 ASN A 83 6.017 -15.292 -1.027 1.00 0.00 H new ATOM 0 HD22 ASN A 83 4.343 -14.991 -1.502 1.00 0.00 H new ATOM 1338 N ALA A 84 1.954 -18.621 -4.418 1.00 0.00 N ATOM 1339 CA ALA A 84 0.650 -19.039 -4.918 1.00 0.00 C ATOM 1340 C ALA A 84 -0.343 -19.221 -3.775 1.00 0.00 C ATOM 1341 O ALA A 84 0.048 -19.398 -2.621 1.00 0.00 O ATOM 1342 CB ALA A 84 0.780 -20.328 -5.718 1.00 0.00 C ATOM 0 H ALA A 84 2.337 -19.220 -3.687 1.00 0.00 H new ATOM 0 HA ALA A 84 0.270 -18.255 -5.573 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.201 -20.629 -6.085 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.450 -20.166 -6.563 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.185 -21.113 -5.079 1.00 0.00 H new ATOM 1348 N LYS A 85 -1.630 -19.178 -4.103 1.00 0.00 N ATOM 1349 CA LYS A 85 -2.680 -19.339 -3.105 1.00 0.00 C ATOM 1350 C LYS A 85 -2.267 -20.346 -2.038 1.00 0.00 C ATOM 1351 O LYS A 85 -2.607 -20.196 -0.864 1.00 0.00 O ATOM 1352 CB LYS A 85 -3.981 -19.792 -3.773 1.00 0.00 C ATOM 1353 CG LYS A 85 -4.557 -18.771 -4.738 1.00 0.00 C ATOM 1354 CD LYS A 85 -5.442 -19.429 -5.783 1.00 0.00 C ATOM 1355 CE LYS A 85 -5.436 -18.651 -7.090 1.00 0.00 C ATOM 1356 NZ LYS A 85 -4.109 -18.706 -7.762 1.00 0.00 N ATOM 0 H LYS A 85 -1.971 -19.033 -5.053 1.00 0.00 H new ATOM 0 HA LYS A 85 -2.842 -18.374 -2.625 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.799 -20.724 -4.309 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.720 -20.007 -3.001 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.135 -18.031 -4.184 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.745 -18.237 -5.232 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.098 -20.447 -5.963 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.462 -19.499 -5.405 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.198 -19.055 -7.757 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.702 -17.612 -6.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -4.244 -18.779 -8.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.573 -17.842 -7.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -3.582 -19.536 -7.422 1.00 0.00 H new ATOM 1370 N ASP A 86 -1.531 -21.372 -2.452 1.00 0.00 N ATOM 1371 CA ASP A 86 -1.068 -22.403 -1.530 1.00 0.00 C ATOM 1372 C ASP A 86 -0.413 -21.779 -0.302 1.00 0.00 C ATOM 1373 O ASP A 86 -0.728 -22.137 0.833 1.00 0.00 O ATOM 1374 CB ASP A 86 -0.081 -23.338 -2.231 1.00 0.00 C ATOM 1375 CG ASP A 86 0.569 -24.316 -1.273 1.00 0.00 C ATOM 1376 OD1 ASP A 86 1.625 -23.975 -0.700 1.00 0.00 O ATOM 1377 OD2 ASP A 86 0.021 -25.424 -1.093 1.00 0.00 O ATOM 0 H ASP A 86 -1.242 -21.512 -3.420 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.933 -22.980 -1.204 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.602 -23.891 -3.013 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.692 -22.745 -2.720 1.00 0.00 H new ATOM 1382 N THR A 87 0.503 -20.844 -0.537 1.00 0.00 N ATOM 1383 CA THR A 87 1.205 -20.173 0.549 1.00 0.00 C ATOM 1384 C THR A 87 0.256 -19.298 1.360 1.00 0.00 C ATOM 1385 O THR A 87 -0.905 -19.118 0.990 1.00 0.00 O ATOM 1386 CB THR A 87 2.360 -19.302 0.019 1.00 0.00 C ATOM 1387 OG1 THR A 87 1.849 -18.292 -0.857 1.00 0.00 O ATOM 1388 CG2 THR A 87 3.383 -20.152 -0.720 1.00 0.00 C ATOM 0 H THR A 87 0.775 -20.535 -1.470 1.00 0.00 H new ATOM 0 HA THR A 87 1.613 -20.954 1.190 1.00 0.00 H new ATOM 0 HB THR A 87 2.851 -18.830 0.870 1.00 0.00 H new ATOM 0 HG1 THR A 87 1.324 -18.712 -1.570 1.00 0.00 H new ATOM 0 HG21 THR A 87 4.189 -19.516 -1.085 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.791 -20.902 -0.042 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.903 -20.649 -1.563 1.00 0.00 H new ATOM 1396 N ILE A 88 0.755 -18.756 2.466 1.00 0.00 N ATOM 1397 CA ILE A 88 -0.049 -17.897 3.326 1.00 0.00 C ATOM 1398 C ILE A 88 -0.051 -16.459 2.822 1.00 0.00 C ATOM 1399 O ILE A 88 -1.090 -15.929 2.428 1.00 0.00 O ATOM 1400 CB ILE A 88 0.462 -17.919 4.779 1.00 0.00 C ATOM 1401 CG1 ILE A 88 -0.110 -19.126 5.526 1.00 0.00 C ATOM 1402 CG2 ILE A 88 0.093 -16.626 5.490 1.00 0.00 C ATOM 1403 CD1 ILE A 88 0.338 -19.211 6.968 1.00 0.00 C ATOM 0 H ILE A 88 1.713 -18.897 2.787 1.00 0.00 H new ATOM 0 HA ILE A 88 -1.066 -18.289 3.300 1.00 0.00 H new ATOM 0 HB ILE A 88 1.548 -18.006 4.765 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.199 -19.080 5.494 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.186 -20.038 5.007 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.461 -16.657 6.516 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.544 -15.782 4.968 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.991 -16.511 5.497 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.106 -20.090 7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 88 1.425 -19.288 7.007 1.00 0.00 H new ATOM 0 HD13 ILE A 88 0.018 -18.316 7.502 1.00 0.00 H new ATOM 1415 N PHE A 89 1.120 -15.831 2.834 1.00 0.00 N ATOM 1416 CA PHE A 89 1.254 -14.453 2.377 1.00 0.00 C ATOM 1417 C PHE A 89 0.365 -14.193 1.165 1.00 0.00 C ATOM 1418 O PHE A 89 -0.054 -13.062 0.919 1.00 0.00 O ATOM 1419 CB PHE A 89 2.713 -14.149 2.028 1.00 0.00 C ATOM 1420 CG PHE A 89 3.700 -14.897 2.876 1.00 0.00 C ATOM 1421 CD1 PHE A 89 3.541 -14.966 4.251 1.00 0.00 C ATOM 1422 CD2 PHE A 89 4.788 -15.534 2.299 1.00 0.00 C ATOM 1423 CE1 PHE A 89 4.449 -15.653 5.034 1.00 0.00 C ATOM 1424 CE2 PHE A 89 5.699 -16.223 3.077 1.00 0.00 C ATOM 1425 CZ PHE A 89 5.529 -16.283 4.446 1.00 0.00 C ATOM 0 H PHE A 89 1.990 -16.255 3.155 1.00 0.00 H new ATOM 0 HA PHE A 89 0.936 -13.796 3.186 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.886 -14.395 0.980 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.889 -13.079 2.138 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.698 -14.477 4.716 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.925 -15.491 1.229 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.315 -15.697 6.105 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.543 -16.714 2.615 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.239 -16.821 5.056 1.00 0.00 H new ATOM 1435 N TYR A 90 0.081 -15.249 0.410 1.00 0.00 N ATOM 1436 CA TYR A 90 -0.756 -15.136 -0.779 1.00 0.00 C ATOM 1437 C TYR A 90 -2.209 -14.866 -0.398 1.00 0.00 C ATOM 1438 O TYR A 90 -2.802 -13.879 -0.833 1.00 0.00 O ATOM 1439 CB TYR A 90 -0.665 -16.413 -1.615 1.00 0.00 C ATOM 1440 CG TYR A 90 -1.324 -16.297 -2.971 1.00 0.00 C ATOM 1441 CD1 TYR A 90 -2.690 -16.070 -3.084 1.00 0.00 C ATOM 1442 CD2 TYR A 90 -0.581 -16.414 -4.140 1.00 0.00 C ATOM 1443 CE1 TYR A 90 -3.297 -15.963 -4.321 1.00 0.00 C ATOM 1444 CE2 TYR A 90 -1.179 -16.308 -5.380 1.00 0.00 C ATOM 1445 CZ TYR A 90 -2.537 -16.084 -5.466 1.00 0.00 C ATOM 1446 OH TYR A 90 -3.137 -15.978 -6.700 1.00 0.00 O ATOM 0 H TYR A 90 0.418 -16.193 0.600 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.392 -14.296 -1.371 1.00 0.00 H new ATOM 0 HB2 TYR A 90 0.384 -16.674 -1.751 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.128 -17.232 -1.064 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -3.288 -15.976 -2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.483 -16.591 -4.077 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -4.360 -15.786 -4.391 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.586 -16.400 -6.278 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.462 -16.086 -7.402 1.00 0.00 H new ATOM 1456 N ARG A 91 -2.775 -15.751 0.416 1.00 0.00 N ATOM 1457 CA ARG A 91 -4.158 -15.610 0.855 1.00 0.00 C ATOM 1458 C ARG A 91 -4.367 -14.279 1.571 1.00 0.00 C ATOM 1459 O ARG A 91 -5.317 -13.551 1.283 1.00 0.00 O ATOM 1460 CB ARG A 91 -4.541 -16.766 1.781 1.00 0.00 C ATOM 1461 CG ARG A 91 -4.702 -18.095 1.062 1.00 0.00 C ATOM 1462 CD ARG A 91 -5.509 -19.083 1.890 1.00 0.00 C ATOM 1463 NE ARG A 91 -6.943 -18.959 1.644 1.00 0.00 N ATOM 1464 CZ ARG A 91 -7.536 -19.377 0.532 1.00 0.00 C ATOM 1465 NH1 ARG A 91 -6.823 -19.942 -0.433 1.00 0.00 N ATOM 1466 NH2 ARG A 91 -8.847 -19.230 0.382 1.00 0.00 N ATOM 0 H ARG A 91 -2.297 -16.573 0.785 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.798 -15.633 -0.027 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.778 -16.870 2.553 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.475 -16.521 2.287 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.195 -17.934 0.104 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.719 -18.515 0.848 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -5.188 -20.098 1.658 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.307 -18.919 2.949 1.00 0.00 H new ATOM 0 HE ARG A 91 -7.521 -18.528 2.366 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -5.816 -20.057 -0.322 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -7.282 -20.262 -1.286 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -9.399 -18.796 1.121 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -9.302 -19.551 -0.473 1.00 0.00 H new ATOM 1480 N ALA A 92 -3.475 -13.968 2.506 1.00 0.00 N ATOM 1481 CA ALA A 92 -3.562 -12.726 3.261 1.00 0.00 C ATOM 1482 C ALA A 92 -3.641 -11.521 2.330 1.00 0.00 C ATOM 1483 O ALA A 92 -4.448 -10.616 2.537 1.00 0.00 O ATOM 1484 CB ALA A 92 -2.370 -12.594 4.199 1.00 0.00 C ATOM 0 H ALA A 92 -2.684 -14.560 2.758 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.476 -12.754 3.854 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.448 -11.661 4.757 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.360 -13.433 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.448 -12.593 3.618 1.00 0.00 H new ATOM 1490 N ALA A 93 -2.795 -11.516 1.303 1.00 0.00 N ATOM 1491 CA ALA A 93 -2.771 -10.423 0.340 1.00 0.00 C ATOM 1492 C ALA A 93 -4.121 -10.269 -0.350 1.00 0.00 C ATOM 1493 O ALA A 93 -4.599 -9.154 -0.559 1.00 0.00 O ATOM 1494 CB ALA A 93 -1.673 -10.651 -0.689 1.00 0.00 C ATOM 0 H ALA A 93 -2.118 -12.257 1.118 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.562 -9.500 0.881 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -1.666 -9.827 -1.402 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.708 -10.703 -0.186 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -1.858 -11.587 -1.217 1.00 0.00 H new ATOM 1500 N VAL A 94 -4.733 -11.395 -0.702 1.00 0.00 N ATOM 1501 CA VAL A 94 -6.030 -11.385 -1.368 1.00 0.00 C ATOM 1502 C VAL A 94 -7.064 -10.622 -0.548 1.00 0.00 C ATOM 1503 O VAL A 94 -7.800 -9.790 -1.078 1.00 0.00 O ATOM 1504 CB VAL A 94 -6.544 -12.815 -1.617 1.00 0.00 C ATOM 1505 CG1 VAL A 94 -8.046 -12.809 -1.854 1.00 0.00 C ATOM 1506 CG2 VAL A 94 -5.813 -13.446 -2.794 1.00 0.00 C ATOM 0 H VAL A 94 -4.351 -12.326 -0.537 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.889 -10.885 -2.326 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.343 -13.415 -0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.391 -13.828 -2.028 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.551 -12.400 -0.979 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.274 -12.195 -2.725 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.188 -14.456 -2.956 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.981 -12.848 -3.690 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.745 -13.486 -2.580 1.00 0.00 H new ATOM 1516 N ARG A 95 -7.112 -10.910 0.749 1.00 0.00 N ATOM 1517 CA ARG A 95 -8.056 -10.250 1.643 1.00 0.00 C ATOM 1518 C ARG A 95 -7.798 -8.746 1.693 1.00 0.00 C ATOM 1519 O ARG A 95 -8.713 -7.943 1.503 1.00 0.00 O ATOM 1520 CB ARG A 95 -7.957 -10.842 3.050 1.00 0.00 C ATOM 1521 CG ARG A 95 -8.868 -10.166 4.061 1.00 0.00 C ATOM 1522 CD ARG A 95 -9.315 -11.136 5.144 1.00 0.00 C ATOM 1523 NE ARG A 95 -10.552 -11.826 4.784 1.00 0.00 N ATOM 1524 CZ ARG A 95 -10.995 -12.912 5.408 1.00 0.00 C ATOM 1525 NH1 ARG A 95 -10.306 -13.430 6.416 1.00 0.00 N ATOM 1526 NH2 ARG A 95 -12.130 -13.482 5.023 1.00 0.00 N ATOM 0 H ARG A 95 -6.509 -11.595 1.204 1.00 0.00 H new ATOM 0 HA ARG A 95 -9.061 -10.416 1.256 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -8.201 -11.903 3.006 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -6.926 -10.766 3.395 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.346 -9.325 4.517 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.742 -9.760 3.551 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -8.529 -11.870 5.320 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -9.461 -10.594 6.078 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.105 -11.454 4.012 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.433 -12.994 6.714 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -10.649 -14.264 6.893 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -12.662 -13.086 4.248 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -12.470 -14.316 5.502 1.00 0.00 H new ATOM 1540 N LEU A 96 -6.550 -8.373 1.949 1.00 0.00 N ATOM 1541 CA LEU A 96 -6.172 -6.966 2.025 1.00 0.00 C ATOM 1542 C LEU A 96 -6.661 -6.205 0.797 1.00 0.00 C ATOM 1543 O LEU A 96 -7.178 -5.094 0.908 1.00 0.00 O ATOM 1544 CB LEU A 96 -4.653 -6.833 2.151 1.00 0.00 C ATOM 1545 CG LEU A 96 -4.091 -6.880 3.571 1.00 0.00 C ATOM 1546 CD1 LEU A 96 -2.578 -7.036 3.543 1.00 0.00 C ATOM 1547 CD2 LEU A 96 -4.486 -5.629 4.344 1.00 0.00 C ATOM 0 H LEU A 96 -5.782 -9.025 2.108 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.643 -6.534 2.908 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.189 -7.631 1.572 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.352 -5.891 1.693 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.515 -7.746 4.079 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -2.197 -7.067 4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.317 -7.961 3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.135 -6.191 3.016 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -4.077 -5.680 5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.092 -4.748 3.837 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.573 -5.561 4.396 1.00 0.00 H new ATOM 1559 N ARG A 97 -6.495 -6.811 -0.374 1.00 0.00 N ATOM 1560 CA ARG A 97 -6.921 -6.192 -1.624 1.00 0.00 C ATOM 1561 C ARG A 97 -8.434 -5.995 -1.645 1.00 0.00 C ATOM 1562 O ARG A 97 -8.931 -4.981 -2.134 1.00 0.00 O ATOM 1563 CB ARG A 97 -6.490 -7.047 -2.815 1.00 0.00 C ATOM 1564 CG ARG A 97 -7.000 -6.532 -4.152 1.00 0.00 C ATOM 1565 CD ARG A 97 -6.706 -7.512 -5.275 1.00 0.00 C ATOM 1566 NE ARG A 97 -7.471 -7.207 -6.482 1.00 0.00 N ATOM 1567 CZ ARG A 97 -7.165 -6.221 -7.317 1.00 0.00 C ATOM 1568 NH1 ARG A 97 -6.115 -5.449 -7.080 1.00 0.00 N ATOM 1569 NH2 ARG A 97 -7.911 -6.007 -8.394 1.00 0.00 N ATOM 0 H ARG A 97 -6.068 -7.731 -0.484 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.444 -5.215 -1.697 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -5.401 -7.092 -2.844 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.847 -8.066 -2.668 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.074 -6.359 -4.091 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.535 -5.572 -4.375 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -5.641 -7.490 -5.506 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -6.940 -8.524 -4.944 1.00 0.00 H new ATOM 0 HE ARG A 97 -8.285 -7.783 -6.695 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -5.539 -5.611 -6.254 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -5.883 -4.692 -7.723 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -8.720 -6.600 -8.580 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -7.676 -5.249 -9.035 1.00 0.00 H new ATOM 1583 N GLU A 98 -9.160 -6.973 -1.112 1.00 0.00 N ATOM 1584 CA GLU A 98 -10.616 -6.907 -1.071 1.00 0.00 C ATOM 1585 C GLU A 98 -11.086 -5.878 -0.048 1.00 0.00 C ATOM 1586 O GLU A 98 -11.770 -4.913 -0.393 1.00 0.00 O ATOM 1587 CB GLU A 98 -11.201 -8.280 -0.736 1.00 0.00 C ATOM 1588 CG GLU A 98 -11.284 -9.216 -1.930 1.00 0.00 C ATOM 1589 CD GLU A 98 -12.367 -8.814 -2.912 1.00 0.00 C ATOM 1590 OE1 GLU A 98 -13.407 -8.286 -2.467 1.00 0.00 O ATOM 1591 OE2 GLU A 98 -12.173 -9.028 -4.128 1.00 0.00 O ATOM 0 H GLU A 98 -8.764 -7.819 -0.703 1.00 0.00 H new ATOM 0 HA GLU A 98 -10.968 -6.600 -2.056 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.591 -8.746 0.038 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -12.199 -8.148 -0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -10.322 -9.232 -2.442 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.475 -10.230 -1.579 1.00 0.00 H new ATOM 1598 N GLN A 99 -10.715 -6.090 1.210 1.00 0.00 N ATOM 1599 CA GLN A 99 -11.100 -5.181 2.284 1.00 0.00 C ATOM 1600 C GLN A 99 -10.472 -3.806 2.084 1.00 0.00 C ATOM 1601 O GLN A 99 -11.172 -2.797 2.012 1.00 0.00 O ATOM 1602 CB GLN A 99 -10.683 -5.754 3.639 1.00 0.00 C ATOM 1603 CG GLN A 99 -11.308 -7.106 3.946 1.00 0.00 C ATOM 1604 CD GLN A 99 -11.217 -7.470 5.415 1.00 0.00 C ATOM 1605 OE1 GLN A 99 -10.893 -6.630 6.256 1.00 0.00 O ATOM 1606 NE2 GLN A 99 -11.503 -8.728 5.732 1.00 0.00 N ATOM 0 H GLN A 99 -10.148 -6.883 1.511 1.00 0.00 H new ATOM 0 HA GLN A 99 -12.184 -5.071 2.263 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -9.598 -5.850 3.665 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -10.959 -5.049 4.423 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -12.355 -7.096 3.642 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.812 -7.875 3.354 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -11.767 -9.390 5.003 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -11.459 -9.031 6.705 1.00 0.00 H new ATOM 1615 N GLY A 100 -9.146 -3.774 1.995 1.00 0.00 N ATOM 1616 CA GLY A 100 -8.444 -2.518 1.806 1.00 0.00 C ATOM 1617 C GLY A 100 -9.105 -1.636 0.764 1.00 0.00 C ATOM 1618 O GLY A 100 -9.099 -0.412 0.883 1.00 0.00 O ATOM 0 H GLY A 100 -8.545 -4.596 2.050 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.400 -1.984 2.755 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.416 -2.721 1.506 1.00 0.00 H new ATOM 1622 N GLY A 101 -9.678 -2.261 -0.260 1.00 0.00 N ATOM 1623 CA GLY A 101 -10.337 -1.509 -1.312 1.00 0.00 C ATOM 1624 C GLY A 101 -11.290 -0.463 -0.768 1.00 0.00 C ATOM 1625 O GLY A 101 -11.387 0.639 -1.308 1.00 0.00 O ATOM 0 H GLY A 101 -9.698 -3.274 -0.380 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.584 -1.023 -1.933 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.886 -2.196 -1.956 1.00 0.00 H new ATOM 1629 N ALA A 102 -11.996 -0.809 0.304 1.00 0.00 N ATOM 1630 CA ALA A 102 -12.946 0.108 0.920 1.00 0.00 C ATOM 1631 C ALA A 102 -12.231 1.308 1.533 1.00 0.00 C ATOM 1632 O ALA A 102 -12.730 2.433 1.482 1.00 0.00 O ATOM 1633 CB ALA A 102 -13.768 -0.614 1.978 1.00 0.00 C ATOM 0 H ALA A 102 -11.928 -1.717 0.763 1.00 0.00 H new ATOM 0 HA ALA A 102 -13.616 0.474 0.142 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -14.473 0.084 2.430 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -14.316 -1.435 1.516 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -13.105 -1.008 2.748 1.00 0.00 H new ATOM 1639 N VAL A 103 -11.060 1.062 2.112 1.00 0.00 N ATOM 1640 CA VAL A 103 -10.277 2.122 2.734 1.00 0.00 C ATOM 1641 C VAL A 103 -9.721 3.081 1.688 1.00 0.00 C ATOM 1642 O VAL A 103 -9.639 4.289 1.916 1.00 0.00 O ATOM 1643 CB VAL A 103 -9.110 1.548 3.559 1.00 0.00 C ATOM 1644 CG1 VAL A 103 -8.314 2.668 4.211 1.00 0.00 C ATOM 1645 CG2 VAL A 103 -9.627 0.572 4.606 1.00 0.00 C ATOM 0 H VAL A 103 -10.633 0.137 2.163 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.950 2.664 3.398 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.445 1.006 2.886 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.494 2.243 4.789 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.912 3.325 3.440 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.965 3.240 4.872 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.789 0.176 5.180 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.314 1.088 5.277 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.149 -0.248 4.113 1.00 0.00 H new ATOM 1655 N LEU A 104 -9.340 2.536 0.537 1.00 0.00 N ATOM 1656 CA LEU A 104 -8.792 3.344 -0.547 1.00 0.00 C ATOM 1657 C LEU A 104 -9.906 3.993 -1.360 1.00 0.00 C ATOM 1658 O LEU A 104 -9.709 5.039 -1.978 1.00 0.00 O ATOM 1659 CB LEU A 104 -7.917 2.481 -1.458 1.00 0.00 C ATOM 1660 CG LEU A 104 -6.586 2.015 -0.868 1.00 0.00 C ATOM 1661 CD1 LEU A 104 -5.936 0.977 -1.768 1.00 0.00 C ATOM 1662 CD2 LEU A 104 -5.653 3.198 -0.654 1.00 0.00 C ATOM 0 H LEU A 104 -9.401 1.539 0.331 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.182 4.133 -0.107 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.490 1.601 -1.750 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.710 3.044 -2.369 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.783 1.554 0.100 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.990 0.658 -1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.598 0.117 -1.868 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.753 1.411 -2.751 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.711 2.847 -0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.464 3.689 -1.608 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.115 3.906 0.033 1.00 0.00 H new ATOM 1674 N ARG A 105 -11.079 3.369 -1.351 1.00 0.00 N ATOM 1675 CA ARG A 105 -12.227 3.887 -2.086 1.00 0.00 C ATOM 1676 C ARG A 105 -12.898 5.021 -1.318 1.00 0.00 C ATOM 1677 O ARG A 105 -13.440 5.951 -1.914 1.00 0.00 O ATOM 1678 CB ARG A 105 -13.236 2.769 -2.352 1.00 0.00 C ATOM 1679 CG ARG A 105 -12.978 2.009 -3.643 1.00 0.00 C ATOM 1680 CD ARG A 105 -14.267 1.462 -4.236 1.00 0.00 C ATOM 1681 NE ARG A 105 -14.951 2.450 -5.065 1.00 0.00 N ATOM 1682 CZ ARG A 105 -16.241 2.383 -5.375 1.00 0.00 C ATOM 1683 NH1 ARG A 105 -16.983 1.380 -4.926 1.00 0.00 N ATOM 1684 NH2 ARG A 105 -16.792 3.321 -6.137 1.00 0.00 N ATOM 0 H ARG A 105 -11.260 2.503 -0.843 1.00 0.00 H new ATOM 0 HA ARG A 105 -11.870 4.279 -3.039 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.217 2.068 -1.518 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -14.238 3.196 -2.386 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -12.496 2.669 -4.364 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -12.288 1.188 -3.451 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -14.044 0.579 -4.834 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -14.929 1.143 -3.431 1.00 0.00 H new ATOM 0 HE ARG A 105 -14.409 3.235 -5.426 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -16.564 0.657 -4.341 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -17.973 1.331 -5.166 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -16.225 4.094 -6.485 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -17.783 3.268 -6.374 1.00 0.00 H new ATOM 1698 N GLN A 106 -12.858 4.935 0.009 1.00 0.00 N ATOM 1699 CA GLN A 106 -13.464 5.953 0.858 1.00 0.00 C ATOM 1700 C GLN A 106 -12.528 7.146 1.030 1.00 0.00 C ATOM 1701 O GLN A 106 -12.968 8.252 1.344 1.00 0.00 O ATOM 1702 CB GLN A 106 -13.815 5.364 2.225 1.00 0.00 C ATOM 1703 CG GLN A 106 -12.652 5.362 3.204 1.00 0.00 C ATOM 1704 CD GLN A 106 -13.076 4.997 4.613 1.00 0.00 C ATOM 1705 OE1 GLN A 106 -14.222 4.617 4.850 1.00 0.00 O ATOM 1706 NE2 GLN A 106 -12.150 5.110 5.558 1.00 0.00 N ATOM 0 H GLN A 106 -12.413 4.171 0.518 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.377 6.298 0.374 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.640 5.932 2.655 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -14.168 4.341 2.091 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -11.895 4.656 2.862 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -12.187 6.348 3.212 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -11.212 5.429 5.317 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -12.377 4.878 6.525 1.00 0.00 H new ATOM 1715 N ALA A 107 -11.236 6.912 0.823 1.00 0.00 N ATOM 1716 CA ALA A 107 -10.239 7.968 0.954 1.00 0.00 C ATOM 1717 C ALA A 107 -9.976 8.644 -0.387 1.00 0.00 C ATOM 1718 O ALA A 107 -9.513 9.783 -0.438 1.00 0.00 O ATOM 1719 CB ALA A 107 -8.947 7.404 1.526 1.00 0.00 C ATOM 0 H ALA A 107 -10.855 6.002 0.564 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.629 8.720 1.639 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -8.211 8.203 1.619 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -9.141 6.974 2.508 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -8.562 6.631 0.861 1.00 0.00 H new ATOM 1725 N ARG A 108 -10.273 7.933 -1.470 1.00 0.00 N ATOM 1726 CA ARG A 108 -10.066 8.465 -2.812 1.00 0.00 C ATOM 1727 C ARG A 108 -10.877 9.739 -3.023 1.00 0.00 C ATOM 1728 O ARG A 108 -10.345 10.760 -3.461 1.00 0.00 O ATOM 1729 CB ARG A 108 -10.453 7.421 -3.862 1.00 0.00 C ATOM 1730 CG ARG A 108 -10.277 7.902 -5.293 1.00 0.00 C ATOM 1731 CD ARG A 108 -10.216 6.738 -6.269 1.00 0.00 C ATOM 1732 NE ARG A 108 -9.714 7.147 -7.578 1.00 0.00 N ATOM 1733 CZ ARG A 108 -10.414 7.879 -8.437 1.00 0.00 C ATOM 1734 NH1 ARG A 108 -11.638 8.282 -8.127 1.00 0.00 N ATOM 1735 NH2 ARG A 108 -9.889 8.212 -9.609 1.00 0.00 N ATOM 0 H ARG A 108 -10.657 6.988 -1.445 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.009 8.706 -2.921 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -9.849 6.526 -3.712 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -11.493 7.133 -3.710 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -11.104 8.560 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -9.363 8.491 -5.370 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -9.573 5.957 -5.862 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -11.211 6.306 -6.381 1.00 0.00 H new ATOM 0 HE ARG A 108 -8.775 6.855 -7.847 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -12.045 8.030 -7.226 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.173 8.844 -8.789 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -8.947 7.906 -9.851 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -10.428 8.774 -10.268 1.00 0.00 H new ATOM 1749 N ARG A 109 -12.167 9.673 -2.710 1.00 0.00 N ATOM 1750 CA ARG A 109 -13.052 10.821 -2.867 1.00 0.00 C ATOM 1751 C ARG A 109 -12.492 12.041 -2.143 1.00 0.00 C ATOM 1752 O ARG A 109 -12.666 13.174 -2.591 1.00 0.00 O ATOM 1753 CB ARG A 109 -14.448 10.493 -2.332 1.00 0.00 C ATOM 1754 CG ARG A 109 -14.470 10.166 -0.848 1.00 0.00 C ATOM 1755 CD ARG A 109 -15.701 9.356 -0.475 1.00 0.00 C ATOM 1756 NE ARG A 109 -15.525 7.933 -0.751 1.00 0.00 N ATOM 1757 CZ ARG A 109 -16.505 7.040 -0.659 1.00 0.00 C ATOM 1758 NH1 ARG A 109 -17.722 7.421 -0.301 1.00 0.00 N ATOM 1759 NH2 ARG A 109 -16.265 5.763 -0.927 1.00 0.00 N ATOM 0 H ARG A 109 -12.623 8.836 -2.346 1.00 0.00 H new ATOM 0 HA ARG A 109 -13.123 11.051 -3.930 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.108 11.340 -2.519 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -14.851 9.647 -2.888 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -13.572 9.608 -0.584 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -14.452 11.090 -0.270 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -15.919 9.495 0.584 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -16.562 9.729 -1.030 1.00 0.00 H new ATOM 0 HE ARG A 109 -14.600 7.607 -1.030 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -17.909 8.402 -0.095 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -18.472 6.733 -0.231 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -15.329 5.467 -1.203 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -17.017 5.077 -0.857 1.00 0.00 H new ATOM 1773 N GLN A 110 -11.820 11.802 -1.022 1.00 0.00 N ATOM 1774 CA GLN A 110 -11.235 12.882 -0.236 1.00 0.00 C ATOM 1775 C GLN A 110 -10.139 13.595 -1.021 1.00 0.00 C ATOM 1776 O GLN A 110 -10.235 14.791 -1.294 1.00 0.00 O ATOM 1777 CB GLN A 110 -10.668 12.338 1.076 1.00 0.00 C ATOM 1778 CG GLN A 110 -11.671 11.534 1.886 1.00 0.00 C ATOM 1779 CD GLN A 110 -11.340 11.505 3.365 1.00 0.00 C ATOM 1780 OE1 GLN A 110 -11.052 10.448 3.928 1.00 0.00 O ATOM 1781 NE2 GLN A 110 -11.377 12.669 4.003 1.00 0.00 N ATOM 0 H GLN A 110 -11.667 10.870 -0.637 1.00 0.00 H new ATOM 0 HA GLN A 110 -12.023 13.602 -0.012 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.805 11.710 0.856 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -10.310 13.171 1.681 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -12.666 11.958 1.749 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -11.704 10.513 1.505 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -11.621 13.520 3.497 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -11.162 12.712 4.999 1.00 0.00 H new ATOM 1790 N ALA A 111 -9.097 12.852 -1.381 1.00 0.00 N ATOM 1791 CA ALA A 111 -7.984 13.413 -2.136 1.00 0.00 C ATOM 1792 C ALA A 111 -8.479 14.190 -3.351 1.00 0.00 C ATOM 1793 O ALA A 111 -7.749 14.998 -3.922 1.00 0.00 O ATOM 1794 CB ALA A 111 -7.028 12.310 -2.566 1.00 0.00 C ATOM 0 H ALA A 111 -9.001 11.860 -1.162 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.451 14.108 -1.486 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.202 12.744 -3.129 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.639 11.802 -1.684 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -7.558 11.593 -3.194 1.00 0.00 H new ATOM 1800 N GLU A 112 -9.725 13.937 -3.741 1.00 0.00 N ATOM 1801 CA GLU A 112 -10.317 14.611 -4.890 1.00 0.00 C ATOM 1802 C GLU A 112 -11.055 15.875 -4.458 1.00 0.00 C ATOM 1803 O GLU A 112 -11.013 16.897 -5.143 1.00 0.00 O ATOM 1804 CB GLU A 112 -11.278 13.672 -5.622 1.00 0.00 C ATOM 1805 CG GLU A 112 -10.600 12.443 -6.204 1.00 0.00 C ATOM 1806 CD GLU A 112 -11.290 11.934 -7.456 1.00 0.00 C ATOM 1807 OE1 GLU A 112 -11.312 12.674 -8.462 1.00 0.00 O ATOM 1808 OE2 GLU A 112 -11.808 10.799 -7.429 1.00 0.00 O ATOM 0 H GLU A 112 -10.343 13.271 -3.278 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.511 14.894 -5.567 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.059 13.353 -4.931 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.768 14.221 -6.426 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.562 12.681 -6.437 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.585 11.652 -5.455 1.00 0.00 H new ATOM 1815 N LYS A 113 -11.730 15.798 -3.317 1.00 0.00 N ATOM 1816 CA LYS A 113 -12.478 16.935 -2.790 1.00 0.00 C ATOM 1817 C LYS A 113 -11.537 18.067 -2.393 1.00 0.00 C ATOM 1818 O LYS A 113 -11.918 19.237 -2.409 1.00 0.00 O ATOM 1819 CB LYS A 113 -13.317 16.505 -1.585 1.00 0.00 C ATOM 1820 CG LYS A 113 -12.594 16.656 -0.257 1.00 0.00 C ATOM 1821 CD LYS A 113 -13.509 16.341 0.914 1.00 0.00 C ATOM 1822 CE LYS A 113 -12.924 16.839 2.228 1.00 0.00 C ATOM 1823 NZ LYS A 113 -11.786 15.993 2.684 1.00 0.00 N ATOM 0 H LYS A 113 -11.775 14.960 -2.738 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.142 17.298 -3.575 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -14.232 17.096 -1.560 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -13.613 15.464 -1.712 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -11.730 15.992 -0.234 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -12.216 17.674 -0.161 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.483 16.802 0.750 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.671 15.265 0.971 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -12.586 17.868 2.108 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -13.701 16.845 2.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -11.822 15.892 3.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -11.852 15.054 2.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -10.888 16.442 2.411 1.00 0.00 H new ATOM 1837 N MET A 114 -10.307 17.711 -2.036 1.00 0.00 N ATOM 1838 CA MET A 114 -9.312 18.699 -1.636 1.00 0.00 C ATOM 1839 C MET A 114 -9.379 19.931 -2.532 1.00 0.00 C ATOM 1840 O MET A 114 -9.683 21.030 -2.071 1.00 0.00 O ATOM 1841 CB MET A 114 -7.909 18.090 -1.688 1.00 0.00 C ATOM 1842 CG MET A 114 -7.713 16.931 -0.725 1.00 0.00 C ATOM 1843 SD MET A 114 -7.214 17.473 0.922 1.00 0.00 S ATOM 1844 CE MET A 114 -6.976 15.897 1.739 1.00 0.00 C ATOM 0 H MET A 114 -9.976 16.746 -2.016 1.00 0.00 H new ATOM 0 HA MET A 114 -9.530 19.005 -0.613 1.00 0.00 H new ATOM 0 HB2 MET A 114 -7.709 17.746 -2.703 1.00 0.00 H new ATOM 0 HB3 MET A 114 -7.177 18.866 -1.464 1.00 0.00 H new ATOM 0 HG2 MET A 114 -8.641 16.364 -0.651 1.00 0.00 H new ATOM 0 HG3 MET A 114 -6.958 16.255 -1.125 1.00 0.00 H new ATOM 0 HE1 MET A 114 -6.221 16.001 2.518 1.00 0.00 H new ATOM 0 HE2 MET A 114 -7.916 15.573 2.186 1.00 0.00 H new ATOM 0 HE3 MET A 114 -6.646 15.156 1.011 1.00 0.00 H new ATOM 1854 N GLY A 115 -9.092 19.740 -3.816 1.00 0.00 N ATOM 1855 CA GLY A 115 -9.125 20.845 -4.756 1.00 0.00 C ATOM 1856 C GLY A 115 -10.265 20.729 -5.748 1.00 0.00 C ATOM 1857 O GLY A 115 -11.254 20.044 -5.489 1.00 0.00 O ATOM 0 H GLY A 115 -8.837 18.840 -4.222 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -9.219 21.782 -4.207 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -8.180 20.886 -5.297 1.00 0.00 H new ATOM 1861 N SER A 116 -10.130 21.404 -6.886 1.00 0.00 N ATOM 1862 CA SER A 116 -11.160 21.377 -7.916 1.00 0.00 C ATOM 1863 C SER A 116 -10.852 20.313 -8.966 1.00 0.00 C ATOM 1864 O SER A 116 -10.168 20.579 -9.954 1.00 0.00 O ATOM 1865 CB SER A 116 -11.277 22.749 -8.584 1.00 0.00 C ATOM 1866 OG SER A 116 -11.558 23.759 -7.630 1.00 0.00 O ATOM 0 H SER A 116 -9.317 21.976 -7.117 1.00 0.00 H new ATOM 0 HA SER A 116 -12.109 21.129 -7.440 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.348 22.984 -9.104 1.00 0.00 H new ATOM 0 HB3 SER A 116 -12.066 22.725 -9.336 1.00 0.00 H new ATOM 0 HG SER A 116 -11.626 24.626 -8.082 1.00 0.00 H new ATOM 1872 N GLY A 117 -11.363 19.106 -8.743 1.00 0.00 N ATOM 1873 CA GLY A 117 -11.132 18.019 -9.677 1.00 0.00 C ATOM 1874 C GLY A 117 -11.999 18.125 -10.915 1.00 0.00 C ATOM 1875 O GLY A 117 -12.484 19.200 -11.269 1.00 0.00 O ATOM 0 H GLY A 117 -11.932 18.861 -7.933 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -10.083 18.014 -9.971 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -11.328 17.069 -9.180 1.00 0.00 H new ATOM 1879 N PRO A 118 -12.203 16.989 -11.599 1.00 0.00 N ATOM 1880 CA PRO A 118 -13.017 16.933 -12.817 1.00 0.00 C ATOM 1881 C PRO A 118 -14.500 17.144 -12.534 1.00 0.00 C ATOM 1882 O PRO A 118 -14.966 16.921 -11.416 1.00 0.00 O ATOM 1883 CB PRO A 118 -12.768 15.518 -13.345 1.00 0.00 C ATOM 1884 CG PRO A 118 -12.393 14.725 -12.140 1.00 0.00 C ATOM 1885 CD PRO A 118 -11.655 15.672 -11.235 1.00 0.00 C ATOM 0 HA PRO A 118 -12.749 17.719 -13.523 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -13.659 15.112 -13.825 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -11.972 15.508 -14.089 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -13.278 14.323 -11.646 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -11.766 13.876 -12.411 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -11.829 15.441 -10.184 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -10.578 15.626 -11.398 1.00 0.00 H new ATOM 1893 N SER A 119 -15.237 17.574 -13.552 1.00 0.00 N ATOM 1894 CA SER A 119 -16.668 17.817 -13.411 1.00 0.00 C ATOM 1895 C SER A 119 -17.364 17.771 -14.768 1.00 0.00 C ATOM 1896 O SER A 119 -16.723 17.566 -15.800 1.00 0.00 O ATOM 1897 CB SER A 119 -16.912 19.174 -12.746 1.00 0.00 C ATOM 1898 OG SER A 119 -18.169 19.202 -12.092 1.00 0.00 O ATOM 0 H SER A 119 -14.867 17.762 -14.484 1.00 0.00 H new ATOM 0 HA SER A 119 -17.085 17.031 -12.782 1.00 0.00 H new ATOM 0 HB2 SER A 119 -16.119 19.378 -12.026 1.00 0.00 H new ATOM 0 HB3 SER A 119 -16.871 19.963 -13.497 1.00 0.00 H new ATOM 0 HG SER A 119 -18.301 20.078 -11.674 1.00 0.00 H new ATOM 1904 N SER A 120 -18.679 17.963 -14.759 1.00 0.00 N ATOM 1905 CA SER A 120 -19.463 17.938 -15.988 1.00 0.00 C ATOM 1906 C SER A 120 -19.646 19.348 -16.543 1.00 0.00 C ATOM 1907 O SER A 120 -20.338 20.175 -15.952 1.00 0.00 O ATOM 1908 CB SER A 120 -20.829 17.298 -15.733 1.00 0.00 C ATOM 1909 OG SER A 120 -20.751 15.886 -15.809 1.00 0.00 O ATOM 0 H SER A 120 -19.224 18.138 -13.915 1.00 0.00 H new ATOM 0 HA SER A 120 -18.922 17.343 -16.724 1.00 0.00 H new ATOM 0 HB2 SER A 120 -21.195 17.593 -14.749 1.00 0.00 H new ATOM 0 HB3 SER A 120 -21.549 17.666 -16.464 1.00 0.00 H new ATOM 0 HG SER A 120 -21.636 15.500 -15.641 1.00 0.00 H new ATOM 1915 N GLY A 121 -19.018 19.613 -17.685 1.00 0.00 N ATOM 1916 CA GLY A 121 -19.122 20.923 -18.302 1.00 0.00 C ATOM 1917 C GLY A 121 -19.855 20.882 -19.628 1.00 0.00 C ATOM 1918 O GLY A 121 -19.269 21.147 -20.677 1.00 0.00 O ATOM 0 H GLY A 121 -18.439 18.944 -18.194 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -19.641 21.600 -17.624 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -18.122 21.330 -18.455 1.00 0.00 H new TER 1922 GLY A 121