USER MOD reduce.3.24.130724 H: found=0, std=0, add=794, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 792 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 60 ASN : amide:sc= -11.9! C(o=-14!,f=-12!) USER MOD Set 1.2: A 79 SER OG : rot -104:sc= -2.13! 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 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 CYS SG : rot 100:sc= -1.33 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 51:sc= 0.478 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 151:sc= -0.234 (180deg=-1.41!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -2.15! C(o=-2.1!,f=-3!) USER MOD Single : A 31 LYS NZ :NH3+ -149:sc= -0.896 (180deg=-2.4!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 165:sc= 0 USER MOD Single : A 36 MET CE :methyl -132:sc= -0.792 (180deg=-3.58!) USER MOD Single : A 37 THR OG1 : rot -140:sc= -0.0513 USER MOD Single : A 40 THR OG1 : rot -150:sc= -0.102 USER MOD Single : A 42 GLN : amide:sc= -0.585 K(o=-0.58,f=-1.4) USER MOD Single : A 46 MET CE :methyl -131:sc=-0.00359 (180deg=-3.09!) USER MOD Single : A 55 HIS : no HD1:sc= -0.0126 X(o=-0.013,f=-0.026) USER MOD Single : A 63 ASN : amide:sc= -0.29 X(o=-0.29,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 HIS : no HD1:sc= -3.05! C(o=-3!,f=-3.7!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -168:sc= -0.0366 (180deg=-0.324) USER MOD Single : A 90 LYS NZ :NH3+ -145:sc= 1.06 (180deg=-0.935!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 100 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.0251) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 64:sc= 1.17 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.055 -5.114 -23.072 1.00 0.00 N ATOM 2 CA GLY A 1 12.501 -5.060 -22.970 1.00 0.00 C ATOM 3 C GLY A 1 13.019 -5.725 -21.709 1.00 0.00 C ATOM 4 O GLY A 1 13.410 -6.892 -21.730 1.00 0.00 O ATOM 0 H1 GLY A 1 10.751 -4.647 -23.950 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.745 -6.107 -23.083 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.631 -4.628 -22.256 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.942 -5.546 -23.841 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.825 -4.019 -22.988 1.00 0.00 H new ATOM 8 N SER A 2 13.023 -4.980 -20.609 1.00 0.00 N ATOM 9 CA SER A 2 13.501 -5.502 -19.334 1.00 0.00 C ATOM 10 C SER A 2 12.386 -6.234 -18.594 1.00 0.00 C ATOM 11 O SER A 2 12.161 -6.005 -17.405 1.00 0.00 O ATOM 12 CB SER A 2 14.046 -4.366 -18.466 1.00 0.00 C ATOM 13 OG SER A 2 13.072 -3.352 -18.283 1.00 0.00 O ATOM 0 H SER A 2 12.701 -4.013 -20.575 1.00 0.00 H new ATOM 0 HA SER A 2 14.304 -6.211 -19.538 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.353 -4.759 -17.497 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.935 -3.941 -18.933 1.00 0.00 H new ATOM 0 HG SER A 2 13.444 -2.638 -17.724 1.00 0.00 H new ATOM 19 N SER A 3 11.691 -7.115 -19.306 1.00 0.00 N ATOM 20 CA SER A 3 10.597 -7.879 -18.718 1.00 0.00 C ATOM 21 C SER A 3 11.089 -8.720 -17.545 1.00 0.00 C ATOM 22 O SER A 3 12.293 -8.858 -17.327 1.00 0.00 O ATOM 23 CB SER A 3 9.953 -8.781 -19.773 1.00 0.00 C ATOM 24 OG SER A 3 10.726 -9.950 -19.984 1.00 0.00 O ATOM 0 H SER A 3 11.866 -7.317 -20.290 1.00 0.00 H new ATOM 0 HA SER A 3 9.852 -7.174 -18.348 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.948 -9.058 -19.455 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.851 -8.234 -20.710 1.00 0.00 H new ATOM 0 HG SER A 3 10.293 -10.511 -20.661 1.00 0.00 H new ATOM 30 N GLY A 4 10.149 -9.281 -16.791 1.00 0.00 N ATOM 31 CA GLY A 4 10.506 -10.102 -15.648 1.00 0.00 C ATOM 32 C GLY A 4 9.366 -10.993 -15.196 1.00 0.00 C ATOM 33 O GLY A 4 8.587 -11.480 -16.015 1.00 0.00 O ATOM 0 H GLY A 4 9.146 -9.182 -16.951 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.367 -10.720 -15.903 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.809 -9.458 -14.822 1.00 0.00 H new ATOM 37 N SER A 5 9.269 -11.208 -13.888 1.00 0.00 N ATOM 38 CA SER A 5 8.219 -12.051 -13.328 1.00 0.00 C ATOM 39 C SER A 5 7.008 -11.216 -12.926 1.00 0.00 C ATOM 40 O SER A 5 6.397 -11.449 -11.883 1.00 0.00 O ATOM 41 CB SER A 5 8.747 -12.821 -12.115 1.00 0.00 C ATOM 42 OG SER A 5 9.817 -13.676 -12.480 1.00 0.00 O ATOM 0 H SER A 5 9.904 -10.810 -13.196 1.00 0.00 H new ATOM 0 HA SER A 5 7.910 -12.761 -14.095 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.083 -12.118 -11.352 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.942 -13.409 -11.675 1.00 0.00 H new ATOM 0 HG SER A 5 10.138 -14.155 -11.688 1.00 0.00 H new ATOM 48 N SER A 6 6.667 -10.240 -13.762 1.00 0.00 N ATOM 49 CA SER A 6 5.531 -9.366 -13.493 1.00 0.00 C ATOM 50 C SER A 6 4.658 -9.213 -14.735 1.00 0.00 C ATOM 51 O SER A 6 5.148 -9.261 -15.862 1.00 0.00 O ATOM 52 CB SER A 6 6.016 -7.993 -13.025 1.00 0.00 C ATOM 53 OG SER A 6 4.948 -7.227 -12.497 1.00 0.00 O ATOM 0 H SER A 6 7.161 -10.035 -14.631 1.00 0.00 H new ATOM 0 HA SER A 6 4.933 -9.821 -12.703 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.789 -8.116 -12.266 1.00 0.00 H new ATOM 0 HB3 SER A 6 6.471 -7.461 -13.860 1.00 0.00 H new ATOM 0 HG SER A 6 5.285 -6.355 -12.203 1.00 0.00 H new ATOM 59 N GLY A 7 3.359 -9.027 -14.518 1.00 0.00 N ATOM 60 CA GLY A 7 2.437 -8.870 -15.628 1.00 0.00 C ATOM 61 C GLY A 7 0.988 -8.864 -15.182 1.00 0.00 C ATOM 62 O GLY A 7 0.240 -7.940 -15.497 1.00 0.00 O ATOM 0 H GLY A 7 2.929 -8.982 -13.594 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.657 -7.939 -16.150 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.591 -9.680 -16.341 1.00 0.00 H new ATOM 66 N GLN A 8 0.593 -9.899 -14.449 1.00 0.00 N ATOM 67 CA GLN A 8 -0.777 -10.011 -13.961 1.00 0.00 C ATOM 68 C GLN A 8 -1.134 -8.828 -13.067 1.00 0.00 C ATOM 69 O GLN A 8 -2.060 -8.066 -13.345 1.00 0.00 O ATOM 70 CB GLN A 8 -0.963 -11.320 -13.193 1.00 0.00 C ATOM 71 CG GLN A 8 -1.493 -12.458 -14.050 1.00 0.00 C ATOM 72 CD GLN A 8 -2.250 -13.494 -13.242 1.00 0.00 C ATOM 73 OE1 GLN A 8 -1.651 -14.342 -12.580 1.00 0.00 O ATOM 74 NE2 GLN A 8 -3.576 -13.430 -13.290 1.00 0.00 N ATOM 0 H GLN A 8 1.201 -10.672 -14.180 1.00 0.00 H new ATOM 0 HA GLN A 8 -1.444 -10.007 -14.823 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -0.008 -11.617 -12.760 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -1.650 -11.151 -12.364 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.150 -12.053 -14.820 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.660 -12.940 -14.563 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.032 -12.711 -13.852 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.138 -14.100 -12.765 1.00 0.00 H new ATOM 83 N PRO A 9 -0.384 -8.670 -11.966 1.00 0.00 N ATOM 84 CA PRO A 9 -0.603 -7.581 -11.009 1.00 0.00 C ATOM 85 C PRO A 9 -0.224 -6.220 -11.582 1.00 0.00 C ATOM 86 O PRO A 9 0.257 -6.124 -12.711 1.00 0.00 O ATOM 87 CB PRO A 9 0.318 -7.945 -9.842 1.00 0.00 C ATOM 88 CG PRO A 9 1.390 -8.781 -10.452 1.00 0.00 C ATOM 89 CD PRO A 9 0.736 -9.540 -11.572 1.00 0.00 C ATOM 0 HA PRO A 9 -1.653 -7.489 -10.730 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.731 -7.053 -9.371 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.220 -8.494 -9.069 1.00 0.00 H new ATOM 0 HG2 PRO A 9 2.205 -8.160 -10.825 1.00 0.00 H new ATOM 0 HG3 PRO A 9 1.819 -9.462 -9.717 1.00 0.00 H new ATOM 0 HD2 PRO A 9 1.425 -9.707 -12.400 1.00 0.00 H new ATOM 0 HD3 PRO A 9 0.388 -10.519 -11.244 1.00 0.00 H new ATOM 97 N ARG A 10 -0.444 -5.170 -10.797 1.00 0.00 N ATOM 98 CA ARG A 10 -0.126 -3.814 -11.227 1.00 0.00 C ATOM 99 C ARG A 10 1.105 -3.287 -10.497 1.00 0.00 C ATOM 100 O ARG A 10 1.340 -3.617 -9.333 1.00 0.00 O ATOM 101 CB ARG A 10 -1.316 -2.886 -10.980 1.00 0.00 C ATOM 102 CG ARG A 10 -2.426 -3.031 -12.008 1.00 0.00 C ATOM 103 CD ARG A 10 -2.047 -2.387 -13.332 1.00 0.00 C ATOM 104 NE ARG A 10 -2.406 -0.972 -13.376 1.00 0.00 N ATOM 105 CZ ARG A 10 -1.920 -0.118 -14.269 1.00 0.00 C ATOM 106 NH1 ARG A 10 -1.059 -0.533 -15.189 1.00 0.00 N ATOM 107 NH2 ARG A 10 -2.295 1.155 -14.244 1.00 0.00 N ATOM 0 H ARG A 10 -0.841 -5.233 -9.860 1.00 0.00 H new ATOM 0 HA ARG A 10 0.090 -3.839 -12.295 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -1.722 -3.086 -9.989 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -0.966 -1.854 -10.979 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -2.642 -4.088 -12.165 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -3.338 -2.572 -11.627 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -0.974 -2.494 -13.493 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.545 -2.913 -14.146 1.00 0.00 H new ATOM 0 HE ARG A 10 -3.066 -0.621 -12.683 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -0.769 -1.511 -15.212 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -0.687 0.125 -15.874 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -2.957 1.478 -13.538 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -1.921 1.810 -14.930 1.00 0.00 H new ATOM 121 N LEU A 11 1.889 -2.465 -11.186 1.00 0.00 N ATOM 122 CA LEU A 11 3.098 -1.892 -10.604 1.00 0.00 C ATOM 123 C LEU A 11 2.824 -0.500 -10.044 1.00 0.00 C ATOM 124 O LEU A 11 2.541 0.437 -10.792 1.00 0.00 O ATOM 125 CB LEU A 11 4.210 -1.823 -11.651 1.00 0.00 C ATOM 126 CG LEU A 11 5.618 -1.559 -11.119 1.00 0.00 C ATOM 127 CD1 LEU A 11 5.607 -0.403 -10.130 1.00 0.00 C ATOM 128 CD2 LEU A 11 6.187 -2.812 -10.470 1.00 0.00 C ATOM 0 H LEU A 11 1.709 -2.180 -12.149 1.00 0.00 H new ATOM 0 HA LEU A 11 3.419 -2.537 -9.786 1.00 0.00 H new ATOM 0 HB2 LEU A 11 4.222 -2.764 -12.201 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.960 -1.039 -12.366 1.00 0.00 H new ATOM 0 HG LEU A 11 6.257 -1.286 -11.959 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.618 -0.230 -9.762 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.242 0.497 -10.626 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.953 -0.647 -9.293 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.190 -2.605 -10.097 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.547 -3.115 -9.641 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.232 -3.615 -11.206 1.00 0.00 H new ATOM 140 N CYS A 12 2.912 -0.371 -8.725 1.00 0.00 N ATOM 141 CA CYS A 12 2.675 0.908 -8.064 1.00 0.00 C ATOM 142 C CYS A 12 3.991 1.558 -7.650 1.00 0.00 C ATOM 143 O CYS A 12 4.560 1.225 -6.610 1.00 0.00 O ATOM 144 CB CYS A 12 1.780 0.715 -6.839 1.00 0.00 C ATOM 145 SG CYS A 12 0.194 -0.073 -7.201 1.00 0.00 S ATOM 0 H CYS A 12 3.146 -1.136 -8.092 1.00 0.00 H new ATOM 0 HA CYS A 12 2.172 1.567 -8.772 1.00 0.00 H new ATOM 0 HB2 CYS A 12 2.314 0.113 -6.104 1.00 0.00 H new ATOM 0 HB3 CYS A 12 1.595 1.687 -6.381 1.00 0.00 H new ATOM 0 HG CYS A 12 0.256 -1.335 -6.893 1.00 0.00 H new ATOM 151 N TYR A 13 4.471 2.486 -8.471 1.00 0.00 N ATOM 152 CA TYR A 13 5.723 3.180 -8.192 1.00 0.00 C ATOM 153 C TYR A 13 5.477 4.430 -7.353 1.00 0.00 C ATOM 154 O TYR A 13 4.884 5.402 -7.823 1.00 0.00 O ATOM 155 CB TYR A 13 6.422 3.558 -9.499 1.00 0.00 C ATOM 156 CG TYR A 13 7.931 3.540 -9.405 1.00 0.00 C ATOM 157 CD1 TYR A 13 8.644 2.362 -9.590 1.00 0.00 C ATOM 158 CD2 TYR A 13 8.643 4.701 -9.131 1.00 0.00 C ATOM 159 CE1 TYR A 13 10.023 2.341 -9.505 1.00 0.00 C ATOM 160 CE2 TYR A 13 10.022 4.690 -9.046 1.00 0.00 C ATOM 161 CZ TYR A 13 10.707 3.507 -9.233 1.00 0.00 C ATOM 162 OH TYR A 13 12.080 3.491 -9.147 1.00 0.00 O ATOM 0 H TYR A 13 4.012 2.775 -9.335 1.00 0.00 H new ATOM 0 HA TYR A 13 6.366 2.506 -7.626 1.00 0.00 H new ATOM 0 HB2 TYR A 13 6.107 2.869 -10.282 1.00 0.00 H new ATOM 0 HB3 TYR A 13 6.097 4.554 -9.801 1.00 0.00 H new ATOM 0 HD1 TYR A 13 8.111 1.447 -9.804 1.00 0.00 H new ATOM 0 HD2 TYR A 13 8.109 5.628 -8.982 1.00 0.00 H new ATOM 0 HE1 TYR A 13 10.562 1.417 -9.651 1.00 0.00 H new ATOM 0 HE2 TYR A 13 10.561 5.602 -8.834 1.00 0.00 H new ATOM 0 HH TYR A 13 12.406 4.394 -8.951 1.00 0.00 H new ATOM 172 N LEU A 14 5.938 4.398 -6.107 1.00 0.00 N ATOM 173 CA LEU A 14 5.771 5.528 -5.200 1.00 0.00 C ATOM 174 C LEU A 14 7.005 6.424 -5.213 1.00 0.00 C ATOM 175 O LEU A 14 8.137 5.939 -5.208 1.00 0.00 O ATOM 176 CB LEU A 14 5.502 5.031 -3.779 1.00 0.00 C ATOM 177 CG LEU A 14 4.034 4.802 -3.414 1.00 0.00 C ATOM 178 CD1 LEU A 14 3.371 6.114 -3.023 1.00 0.00 C ATOM 179 CD2 LEU A 14 3.292 4.151 -4.572 1.00 0.00 C ATOM 0 H LEU A 14 6.430 3.602 -5.702 1.00 0.00 H new ATOM 0 HA LEU A 14 4.917 6.113 -5.541 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.042 4.095 -3.635 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.922 5.752 -3.078 1.00 0.00 H new ATOM 0 HG LEU A 14 3.992 4.128 -2.558 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.327 5.932 -2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.887 6.540 -2.163 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.423 6.811 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.249 3.996 -4.295 1.00 0.00 H new ATOM 0 HD22 LEU A 14 3.342 4.799 -5.447 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.752 3.191 -4.805 1.00 0.00 H new ATOM 191 N VAL A 15 6.779 7.734 -5.227 1.00 0.00 N ATOM 192 CA VAL A 15 7.873 8.698 -5.237 1.00 0.00 C ATOM 193 C VAL A 15 7.697 9.738 -4.137 1.00 0.00 C ATOM 194 O VAL A 15 6.716 10.482 -4.120 1.00 0.00 O ATOM 195 CB VAL A 15 7.975 9.416 -6.596 1.00 0.00 C ATOM 196 CG1 VAL A 15 9.229 10.276 -6.652 1.00 0.00 C ATOM 197 CG2 VAL A 15 7.960 8.407 -7.734 1.00 0.00 C ATOM 0 H VAL A 15 5.849 8.152 -5.232 1.00 0.00 H new ATOM 0 HA VAL A 15 8.791 8.138 -5.061 1.00 0.00 H new ATOM 0 HB VAL A 15 7.109 10.069 -6.709 1.00 0.00 H new ATOM 0 HG11 VAL A 15 9.285 10.776 -7.619 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.194 11.023 -5.859 1.00 0.00 H new ATOM 0 HG13 VAL A 15 10.108 9.646 -6.518 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.033 8.932 -8.687 1.00 0.00 H new ATOM 0 HG22 VAL A 15 8.805 7.727 -7.629 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.031 7.838 -7.703 1.00 0.00 H new ATOM 207 N LYS A 16 8.656 9.787 -3.218 1.00 0.00 N ATOM 208 CA LYS A 16 8.610 10.737 -2.113 1.00 0.00 C ATOM 209 C LYS A 16 8.226 12.128 -2.608 1.00 0.00 C ATOM 210 O LYS A 16 9.033 12.821 -3.226 1.00 0.00 O ATOM 211 CB LYS A 16 9.966 10.793 -1.405 1.00 0.00 C ATOM 212 CG LYS A 16 10.098 9.798 -0.265 1.00 0.00 C ATOM 213 CD LYS A 16 11.260 10.147 0.649 1.00 0.00 C ATOM 214 CE LYS A 16 11.297 9.246 1.873 1.00 0.00 C ATOM 215 NZ LYS A 16 12.010 9.887 3.013 1.00 0.00 N ATOM 0 H LYS A 16 9.475 9.179 -3.217 1.00 0.00 H new ATOM 0 HA LYS A 16 7.852 10.399 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.755 10.605 -2.133 1.00 0.00 H new ATOM 0 HB3 LYS A 16 10.123 11.800 -1.018 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.173 9.780 0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.241 8.796 -0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 16 12.197 10.054 0.100 1.00 0.00 H new ATOM 0 HD3 LYS A 16 11.177 11.187 0.964 1.00 0.00 H new ATOM 0 HE2 LYS A 16 10.279 9.000 2.174 1.00 0.00 H new ATOM 0 HE3 LYS A 16 11.789 8.308 1.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 12.013 9.241 3.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 12.990 10.099 2.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 11.526 10.770 3.273 1.00 0.00 H new ATOM 229 N GLU A 17 6.989 12.529 -2.330 1.00 0.00 N ATOM 230 CA GLU A 17 6.500 13.838 -2.746 1.00 0.00 C ATOM 231 C GLU A 17 6.279 14.746 -1.540 1.00 0.00 C ATOM 232 O GLU A 17 6.882 15.813 -1.433 1.00 0.00 O ATOM 233 CB GLU A 17 5.196 13.692 -3.534 1.00 0.00 C ATOM 234 CG GLU A 17 4.979 14.793 -4.559 1.00 0.00 C ATOM 235 CD GLU A 17 4.646 16.127 -3.921 1.00 0.00 C ATOM 236 OE1 GLU A 17 5.559 16.751 -3.341 1.00 0.00 O ATOM 237 OE2 GLU A 17 3.473 16.548 -4.001 1.00 0.00 O ATOM 0 H GLU A 17 6.308 11.967 -1.819 1.00 0.00 H new ATOM 0 HA GLU A 17 7.256 14.293 -3.387 1.00 0.00 H new ATOM 0 HB2 GLU A 17 5.194 12.728 -4.043 1.00 0.00 H new ATOM 0 HB3 GLU A 17 4.358 13.686 -2.837 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.877 14.900 -5.168 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.171 14.504 -5.231 1.00 0.00 H new ATOM 244 N GLY A 18 5.409 14.313 -0.633 1.00 0.00 N ATOM 245 CA GLY A 18 5.122 15.098 0.554 1.00 0.00 C ATOM 246 C GLY A 18 5.256 14.290 1.830 1.00 0.00 C ATOM 247 O GLY A 18 4.567 13.288 2.013 1.00 0.00 O ATOM 0 H GLY A 18 4.898 13.433 -0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 18 5.800 15.951 0.595 1.00 0.00 H new ATOM 0 HA3 GLY A 18 4.110 15.498 0.485 1.00 0.00 H new ATOM 251 N GLY A 19 6.147 14.727 2.715 1.00 0.00 N ATOM 252 CA GLY A 19 6.354 14.025 3.968 1.00 0.00 C ATOM 253 C GLY A 19 7.020 12.677 3.774 1.00 0.00 C ATOM 254 O GLY A 19 8.240 12.594 3.635 1.00 0.00 O ATOM 0 H GLY A 19 6.729 15.555 2.586 1.00 0.00 H new ATOM 0 HA2 GLY A 19 6.968 14.638 4.628 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.394 13.884 4.465 1.00 0.00 H new ATOM 258 N SER A 20 6.217 11.617 3.765 1.00 0.00 N ATOM 259 CA SER A 20 6.736 10.266 3.592 1.00 0.00 C ATOM 260 C SER A 20 6.143 9.611 2.348 1.00 0.00 C ATOM 261 O SER A 20 6.864 9.268 1.411 1.00 0.00 O ATOM 262 CB SER A 20 6.426 9.416 4.826 1.00 0.00 C ATOM 263 OG SER A 20 7.339 9.688 5.875 1.00 0.00 O ATOM 0 H SER A 20 5.204 11.669 3.876 1.00 0.00 H new ATOM 0 HA SER A 20 7.817 10.332 3.467 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.409 9.617 5.164 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.472 8.359 4.564 1.00 0.00 H new ATOM 0 HG SER A 20 7.119 9.134 6.652 1.00 0.00 H new ATOM 269 N TYR A 21 4.826 9.441 2.347 1.00 0.00 N ATOM 270 CA TYR A 21 4.135 8.826 1.220 1.00 0.00 C ATOM 271 C TYR A 21 2.627 9.022 1.333 1.00 0.00 C ATOM 272 O TYR A 21 2.140 9.664 2.263 1.00 0.00 O ATOM 273 CB TYR A 21 4.463 7.333 1.148 1.00 0.00 C ATOM 274 CG TYR A 21 5.788 7.035 0.483 1.00 0.00 C ATOM 275 CD1 TYR A 21 6.045 7.456 -0.816 1.00 0.00 C ATOM 276 CD2 TYR A 21 6.781 6.333 1.154 1.00 0.00 C ATOM 277 CE1 TYR A 21 7.254 7.185 -1.428 1.00 0.00 C ATOM 278 CE2 TYR A 21 7.993 6.059 0.550 1.00 0.00 C ATOM 279 CZ TYR A 21 8.225 6.487 -0.741 1.00 0.00 C ATOM 280 OH TYR A 21 9.430 6.216 -1.346 1.00 0.00 O ATOM 0 H TYR A 21 4.215 9.721 3.114 1.00 0.00 H new ATOM 0 HA TYR A 21 4.478 9.312 0.307 1.00 0.00 H new ATOM 0 HB2 TYR A 21 4.473 6.923 2.158 1.00 0.00 H new ATOM 0 HB3 TYR A 21 3.670 6.821 0.603 1.00 0.00 H new ATOM 0 HD1 TYR A 21 5.287 8.004 -1.356 1.00 0.00 H new ATOM 0 HD2 TYR A 21 6.603 5.996 2.164 1.00 0.00 H new ATOM 0 HE1 TYR A 21 7.437 7.518 -2.439 1.00 0.00 H new ATOM 0 HE2 TYR A 21 8.755 5.512 1.086 1.00 0.00 H new ATOM 0 HH TYR A 21 9.800 7.042 -1.722 1.00 0.00 H new ATOM 290 N GLY A 22 1.891 8.463 0.377 1.00 0.00 N ATOM 291 CA GLY A 22 0.445 8.586 0.386 1.00 0.00 C ATOM 292 C GLY A 22 -0.249 7.264 0.646 1.00 0.00 C ATOM 293 O GLY A 22 -1.314 6.993 0.091 1.00 0.00 O ATOM 0 H GLY A 22 2.271 7.927 -0.404 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.150 9.304 1.151 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.112 8.985 -0.572 1.00 0.00 H new ATOM 297 N PHE A 23 0.357 6.436 1.492 1.00 0.00 N ATOM 298 CA PHE A 23 -0.208 5.133 1.822 1.00 0.00 C ATOM 299 C PHE A 23 0.148 4.732 3.251 1.00 0.00 C ATOM 300 O PHE A 23 1.136 5.205 3.812 1.00 0.00 O ATOM 301 CB PHE A 23 0.297 4.071 0.842 1.00 0.00 C ATOM 302 CG PHE A 23 1.783 3.864 0.896 1.00 0.00 C ATOM 303 CD1 PHE A 23 2.340 2.982 1.809 1.00 0.00 C ATOM 304 CD2 PHE A 23 2.624 4.551 0.036 1.00 0.00 C ATOM 305 CE1 PHE A 23 3.708 2.789 1.861 1.00 0.00 C ATOM 306 CE2 PHE A 23 3.992 4.362 0.083 1.00 0.00 C ATOM 307 CZ PHE A 23 4.535 3.480 0.998 1.00 0.00 C ATOM 0 H PHE A 23 1.239 6.645 1.961 1.00 0.00 H new ATOM 0 HA PHE A 23 -1.293 5.205 1.742 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -0.201 3.125 1.055 1.00 0.00 H new ATOM 0 HB3 PHE A 23 0.015 4.359 -0.171 1.00 0.00 H new ATOM 0 HD1 PHE A 23 1.698 2.440 2.487 1.00 0.00 H new ATOM 0 HD2 PHE A 23 2.205 5.243 -0.680 1.00 0.00 H new ATOM 0 HE1 PHE A 23 4.129 2.098 2.576 1.00 0.00 H new ATOM 0 HE2 PHE A 23 4.636 4.903 -0.594 1.00 0.00 H new ATOM 0 HZ PHE A 23 5.604 3.332 1.038 1.00 0.00 H new ATOM 317 N SER A 24 -0.666 3.858 3.834 1.00 0.00 N ATOM 318 CA SER A 24 -0.441 3.396 5.199 1.00 0.00 C ATOM 319 C SER A 24 -0.390 1.873 5.255 1.00 0.00 C ATOM 320 O SER A 24 -1.019 1.188 4.448 1.00 0.00 O ATOM 321 CB SER A 24 -1.543 3.915 6.123 1.00 0.00 C ATOM 322 OG SER A 24 -1.462 5.322 6.275 1.00 0.00 O ATOM 0 H SER A 24 -1.487 3.455 3.383 1.00 0.00 H new ATOM 0 HA SER A 24 0.519 3.787 5.535 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.518 3.646 5.718 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.460 3.436 7.098 1.00 0.00 H new ATOM 0 HG SER A 24 -2.179 5.629 6.869 1.00 0.00 H new ATOM 328 N LEU A 25 0.365 1.348 6.214 1.00 0.00 N ATOM 329 CA LEU A 25 0.500 -0.095 6.378 1.00 0.00 C ATOM 330 C LEU A 25 -0.053 -0.544 7.727 1.00 0.00 C ATOM 331 O LEU A 25 0.021 0.186 8.715 1.00 0.00 O ATOM 332 CB LEU A 25 1.968 -0.508 6.253 1.00 0.00 C ATOM 333 CG LEU A 25 2.698 -0.018 5.003 1.00 0.00 C ATOM 334 CD1 LEU A 25 4.202 -0.174 5.167 1.00 0.00 C ATOM 335 CD2 LEU A 25 2.213 -0.771 3.772 1.00 0.00 C ATOM 0 H LEU A 25 0.893 1.900 6.890 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.076 -0.580 5.590 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.504 -0.142 7.129 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.022 -1.596 6.278 1.00 0.00 H new ATOM 0 HG LEU A 25 2.476 1.041 4.868 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.705 0.180 4.267 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.537 0.411 6.024 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.443 -1.225 5.328 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.744 -0.409 2.891 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.404 -1.837 3.898 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.143 -0.607 3.644 1.00 0.00 H new ATOM 347 N LYS A 26 -0.606 -1.752 7.761 1.00 0.00 N ATOM 348 CA LYS A 26 -1.169 -2.302 8.989 1.00 0.00 C ATOM 349 C LYS A 26 -1.149 -3.827 8.962 1.00 0.00 C ATOM 350 O LYS A 26 -1.381 -4.443 7.921 1.00 0.00 O ATOM 351 CB LYS A 26 -2.603 -1.804 9.185 1.00 0.00 C ATOM 352 CG LYS A 26 -3.539 -2.182 8.050 1.00 0.00 C ATOM 353 CD LYS A 26 -4.972 -1.776 8.350 1.00 0.00 C ATOM 354 CE LYS A 26 -5.724 -2.881 9.075 1.00 0.00 C ATOM 355 NZ LYS A 26 -5.430 -2.887 10.534 1.00 0.00 N ATOM 0 H LYS A 26 -0.676 -2.369 6.952 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.555 -1.963 9.824 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -2.995 -2.209 10.118 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.591 -0.719 9.289 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -3.209 -1.701 7.129 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.492 -3.258 7.882 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.975 -0.872 8.959 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.486 -1.535 7.419 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.795 -2.753 8.921 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.454 -3.846 8.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.250 -3.262 11.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.600 -3.487 10.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.234 -1.917 10.853 1.00 0.00 H new ATOM 369 N THR A 27 -0.870 -4.431 10.113 1.00 0.00 N ATOM 370 CA THR A 27 -0.820 -5.884 10.221 1.00 0.00 C ATOM 371 C THR A 27 -2.130 -6.440 10.768 1.00 0.00 C ATOM 372 O THR A 27 -2.715 -5.880 11.696 1.00 0.00 O ATOM 373 CB THR A 27 0.337 -6.340 11.129 1.00 0.00 C ATOM 374 OG1 THR A 27 0.067 -5.977 12.487 1.00 0.00 O ATOM 375 CG2 THR A 27 1.652 -5.716 10.684 1.00 0.00 C ATOM 0 H THR A 27 -0.675 -3.936 10.984 1.00 0.00 H new ATOM 0 HA THR A 27 -0.656 -6.270 9.215 1.00 0.00 H new ATOM 0 HB THR A 27 0.423 -7.424 11.054 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.807 -6.272 13.058 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.455 -6.052 11.340 1.00 0.00 H new ATOM 0 HG22 THR A 27 1.870 -6.018 9.660 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.574 -4.630 10.733 1.00 0.00 H new ATOM 383 N VAL A 28 -2.586 -7.546 10.189 1.00 0.00 N ATOM 384 CA VAL A 28 -3.826 -8.179 10.620 1.00 0.00 C ATOM 385 C VAL A 28 -3.606 -9.652 10.949 1.00 0.00 C ATOM 386 O VAL A 28 -3.093 -10.411 10.128 1.00 0.00 O ATOM 387 CB VAL A 28 -4.920 -8.064 9.542 1.00 0.00 C ATOM 388 CG1 VAL A 28 -6.166 -8.829 9.961 1.00 0.00 C ATOM 389 CG2 VAL A 28 -5.247 -6.603 9.270 1.00 0.00 C ATOM 0 H VAL A 28 -2.115 -8.022 9.420 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.154 -7.654 11.517 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.545 -8.507 8.619 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -6.928 -8.736 9.187 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -5.917 -9.881 10.101 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -6.547 -8.419 10.896 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -6.022 -6.540 8.506 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -5.602 -6.133 10.187 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.351 -6.088 8.922 1.00 0.00 H new ATOM 399 N GLN A 29 -3.997 -10.047 12.156 1.00 0.00 N ATOM 400 CA GLN A 29 -3.842 -11.430 12.594 1.00 0.00 C ATOM 401 C GLN A 29 -4.262 -12.399 11.495 1.00 0.00 C ATOM 402 O GLN A 29 -5.235 -12.160 10.781 1.00 0.00 O ATOM 403 CB GLN A 29 -4.667 -11.683 13.857 1.00 0.00 C ATOM 404 CG GLN A 29 -6.134 -11.313 13.709 1.00 0.00 C ATOM 405 CD GLN A 29 -6.391 -9.838 13.947 1.00 0.00 C ATOM 406 OE1 GLN A 29 -6.952 -9.148 13.095 1.00 0.00 O ATOM 407 NE2 GLN A 29 -5.982 -9.346 15.110 1.00 0.00 N ATOM 0 H GLN A 29 -4.423 -9.430 12.848 1.00 0.00 H new ATOM 0 HA GLN A 29 -2.788 -11.598 12.818 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -4.592 -12.737 14.125 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -4.238 -11.113 14.681 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.473 -11.580 12.708 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.725 -11.899 14.413 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.521 -9.954 15.787 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.128 -8.360 15.326 1.00 0.00 H new ATOM 416 N GLY A 30 -3.521 -13.495 11.364 1.00 0.00 N ATOM 417 CA GLY A 30 -3.833 -14.485 10.348 1.00 0.00 C ATOM 418 C GLY A 30 -3.227 -14.144 9.001 1.00 0.00 C ATOM 419 O GLY A 30 -2.641 -15.002 8.340 1.00 0.00 O ATOM 0 H GLY A 30 -2.710 -13.716 11.943 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -3.468 -15.460 10.671 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.915 -14.568 10.246 1.00 0.00 H new ATOM 423 N LYS A 31 -3.368 -12.888 8.592 1.00 0.00 N ATOM 424 CA LYS A 31 -2.831 -12.434 7.315 1.00 0.00 C ATOM 425 C LYS A 31 -1.308 -12.350 7.364 1.00 0.00 C ATOM 426 O LYS A 31 -0.728 -12.013 8.396 1.00 0.00 O ATOM 427 CB LYS A 31 -3.416 -11.068 6.948 1.00 0.00 C ATOM 428 CG LYS A 31 -4.922 -11.086 6.750 1.00 0.00 C ATOM 429 CD LYS A 31 -5.415 -9.798 6.110 1.00 0.00 C ATOM 430 CE LYS A 31 -6.679 -10.029 5.296 1.00 0.00 C ATOM 431 NZ LYS A 31 -6.373 -10.544 3.933 1.00 0.00 N ATOM 0 H LYS A 31 -3.850 -12.166 9.127 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.113 -13.160 6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.169 -10.353 7.733 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.942 -10.713 6.033 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.198 -11.934 6.123 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.415 -11.228 7.712 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.610 -9.057 6.885 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.636 -9.389 5.467 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.322 -10.739 5.817 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.235 -9.095 5.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -7.098 -10.212 3.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.440 -10.197 3.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -6.367 -11.584 3.948 1.00 0.00 H new ATOM 445 N LYS A 32 -0.667 -12.655 6.241 1.00 0.00 N ATOM 446 CA LYS A 32 0.788 -12.612 6.155 1.00 0.00 C ATOM 447 C LYS A 32 1.266 -11.230 5.720 1.00 0.00 C ATOM 448 O LYS A 32 0.537 -10.489 5.061 1.00 0.00 O ATOM 449 CB LYS A 32 1.293 -13.670 5.171 1.00 0.00 C ATOM 450 CG LYS A 32 0.553 -13.671 3.845 1.00 0.00 C ATOM 451 CD LYS A 32 1.215 -14.595 2.838 1.00 0.00 C ATOM 452 CE LYS A 32 0.684 -16.016 2.952 1.00 0.00 C ATOM 453 NZ LYS A 32 1.315 -16.927 1.958 1.00 0.00 N ATOM 0 H LYS A 32 -1.132 -12.935 5.377 1.00 0.00 H new ATOM 0 HA LYS A 32 1.192 -12.823 7.145 1.00 0.00 H new ATOM 0 HB2 LYS A 32 2.354 -13.504 4.985 1.00 0.00 H new ATOM 0 HB3 LYS A 32 1.200 -14.654 5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.479 -13.984 4.004 1.00 0.00 H new ATOM 0 HG3 LYS A 32 0.521 -12.658 3.444 1.00 0.00 H new ATOM 0 HD2 LYS A 32 1.041 -14.220 1.829 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.293 -14.595 2.996 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.869 -16.393 3.958 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -0.396 -16.012 2.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 0.926 -17.885 2.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.117 -16.582 0.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.343 -16.951 2.113 1.00 0.00 H new ATOM 467 N GLY A 33 2.496 -10.889 6.093 1.00 0.00 N ATOM 468 CA GLY A 33 3.050 -9.598 5.732 1.00 0.00 C ATOM 469 C GLY A 33 2.078 -8.461 5.978 1.00 0.00 C ATOM 470 O GLY A 33 1.314 -8.485 6.942 1.00 0.00 O ATOM 0 H GLY A 33 3.119 -11.485 6.639 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.961 -9.424 6.305 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.333 -9.609 4.679 1.00 0.00 H new ATOM 474 N VAL A 34 2.108 -7.459 5.104 1.00 0.00 N ATOM 475 CA VAL A 34 1.223 -6.307 5.231 1.00 0.00 C ATOM 476 C VAL A 34 0.576 -5.961 3.895 1.00 0.00 C ATOM 477 O VAL A 34 0.897 -6.555 2.865 1.00 0.00 O ATOM 478 CB VAL A 34 1.980 -5.073 5.757 1.00 0.00 C ATOM 479 CG1 VAL A 34 2.384 -5.274 7.210 1.00 0.00 C ATOM 480 CG2 VAL A 34 3.198 -4.787 4.891 1.00 0.00 C ATOM 0 H VAL A 34 2.736 -7.422 4.301 1.00 0.00 H new ATOM 0 HA VAL A 34 0.448 -6.581 5.947 1.00 0.00 H new ATOM 0 HB VAL A 34 1.315 -4.211 5.706 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.918 -4.392 7.565 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.492 -5.427 7.818 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.032 -6.147 7.290 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.721 -3.912 5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.867 -5.647 4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.879 -4.597 3.866 1.00 0.00 H new ATOM 490 N TYR A 35 -0.336 -4.996 3.918 1.00 0.00 N ATOM 491 CA TYR A 35 -1.030 -4.571 2.708 1.00 0.00 C ATOM 492 C TYR A 35 -1.566 -3.150 2.858 1.00 0.00 C ATOM 493 O TYR A 35 -1.965 -2.737 3.946 1.00 0.00 O ATOM 494 CB TYR A 35 -2.178 -5.530 2.390 1.00 0.00 C ATOM 495 CG TYR A 35 -3.332 -5.438 3.363 1.00 0.00 C ATOM 496 CD1 TYR A 35 -4.117 -4.293 3.434 1.00 0.00 C ATOM 497 CD2 TYR A 35 -3.637 -6.495 4.211 1.00 0.00 C ATOM 498 CE1 TYR A 35 -5.171 -4.204 4.322 1.00 0.00 C ATOM 499 CE2 TYR A 35 -4.691 -6.415 5.101 1.00 0.00 C ATOM 500 CZ TYR A 35 -5.454 -5.268 5.153 1.00 0.00 C ATOM 501 OH TYR A 35 -6.505 -5.183 6.038 1.00 0.00 O ATOM 0 H TYR A 35 -0.612 -4.493 4.761 1.00 0.00 H new ATOM 0 HA TYR A 35 -0.315 -4.585 1.885 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -2.544 -5.324 1.384 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -1.797 -6.551 2.387 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -3.899 -3.459 2.784 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -3.040 -7.394 4.174 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -5.770 -3.307 4.366 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -4.916 -7.247 5.752 1.00 0.00 H new ATOM 0 HH TYR A 35 -6.724 -6.078 6.373 1.00 0.00 H new ATOM 511 N MET A 36 -1.572 -2.408 1.756 1.00 0.00 N ATOM 512 CA MET A 36 -2.061 -1.034 1.763 1.00 0.00 C ATOM 513 C MET A 36 -3.526 -0.980 2.183 1.00 0.00 C ATOM 514 O MET A 36 -4.373 -1.667 1.610 1.00 0.00 O ATOM 515 CB MET A 36 -1.891 -0.403 0.379 1.00 0.00 C ATOM 516 CG MET A 36 -0.464 -0.452 -0.140 1.00 0.00 C ATOM 517 SD MET A 36 0.638 0.664 0.749 1.00 0.00 S ATOM 518 CE MET A 36 2.085 0.623 -0.305 1.00 0.00 C ATOM 0 H MET A 36 -1.244 -2.735 0.847 1.00 0.00 H new ATOM 0 HA MET A 36 -1.473 -0.469 2.487 1.00 0.00 H new ATOM 0 HB2 MET A 36 -2.544 -0.916 -0.328 1.00 0.00 H new ATOM 0 HB3 MET A 36 -2.219 0.636 0.420 1.00 0.00 H new ATOM 0 HG2 MET A 36 -0.086 -1.471 -0.057 1.00 0.00 H new ATOM 0 HG3 MET A 36 -0.458 -0.195 -1.199 1.00 0.00 H new ATOM 0 HE1 MET A 36 2.974 0.461 0.304 1.00 0.00 H new ATOM 0 HE2 MET A 36 1.987 -0.188 -1.026 1.00 0.00 H new ATOM 0 HE3 MET A 36 2.176 1.571 -0.835 1.00 0.00 H new ATOM 528 N THR A 37 -3.819 -0.160 3.188 1.00 0.00 N ATOM 529 CA THR A 37 -5.181 -0.018 3.686 1.00 0.00 C ATOM 530 C THR A 37 -5.696 1.402 3.483 1.00 0.00 C ATOM 531 O THR A 37 -6.842 1.606 3.082 1.00 0.00 O ATOM 532 CB THR A 37 -5.273 -0.377 5.181 1.00 0.00 C ATOM 533 OG1 THR A 37 -6.624 -0.238 5.636 1.00 0.00 O ATOM 534 CG2 THR A 37 -4.360 0.515 6.008 1.00 0.00 C ATOM 0 H THR A 37 -3.131 0.416 3.673 1.00 0.00 H new ATOM 0 HA THR A 37 -5.800 -0.710 3.115 1.00 0.00 H new ATOM 0 HB THR A 37 -4.953 -1.412 5.304 1.00 0.00 H new ATOM 0 HG1 THR A 37 -6.628 0.158 6.532 1.00 0.00 H new ATOM 0 HG21 THR A 37 -4.442 0.243 7.060 1.00 0.00 H new ATOM 0 HG22 THR A 37 -3.329 0.385 5.679 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.654 1.557 5.878 1.00 0.00 H new ATOM 542 N ASP A 38 -4.842 2.381 3.761 1.00 0.00 N ATOM 543 CA ASP A 38 -5.210 3.784 3.607 1.00 0.00 C ATOM 544 C ASP A 38 -4.471 4.413 2.430 1.00 0.00 C ATOM 545 O ASP A 38 -3.251 4.578 2.467 1.00 0.00 O ATOM 546 CB ASP A 38 -4.903 4.557 4.891 1.00 0.00 C ATOM 547 CG ASP A 38 -5.775 5.788 5.047 1.00 0.00 C ATOM 548 OD1 ASP A 38 -6.918 5.647 5.529 1.00 0.00 O ATOM 549 OD2 ASP A 38 -5.314 6.891 4.687 1.00 0.00 O ATOM 0 H ASP A 38 -3.890 2.229 4.094 1.00 0.00 H new ATOM 0 HA ASP A 38 -6.281 3.835 3.409 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -5.047 3.902 5.750 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.855 4.855 4.890 1.00 0.00 H new ATOM 554 N ILE A 39 -5.218 4.761 1.388 1.00 0.00 N ATOM 555 CA ILE A 39 -4.633 5.372 0.201 1.00 0.00 C ATOM 556 C ILE A 39 -4.900 6.873 0.167 1.00 0.00 C ATOM 557 O ILE A 39 -5.910 7.324 -0.376 1.00 0.00 O ATOM 558 CB ILE A 39 -5.184 4.736 -1.089 1.00 0.00 C ATOM 559 CG1 ILE A 39 -4.768 3.265 -1.176 1.00 0.00 C ATOM 560 CG2 ILE A 39 -4.695 5.502 -2.309 1.00 0.00 C ATOM 561 CD1 ILE A 39 -3.269 3.061 -1.178 1.00 0.00 C ATOM 0 H ILE A 39 -6.229 4.630 1.342 1.00 0.00 H new ATOM 0 HA ILE A 39 -3.558 5.197 0.253 1.00 0.00 H new ATOM 0 HB ILE A 39 -6.273 4.787 -1.065 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -5.199 2.723 -0.334 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -5.187 2.830 -2.083 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.093 5.040 -3.212 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.035 6.536 -2.250 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.606 5.480 -2.340 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.047 1.996 -1.242 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.833 3.574 -2.035 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.845 3.466 -0.259 1.00 0.00 H new ATOM 573 N THR A 40 -3.987 7.645 0.750 1.00 0.00 N ATOM 574 CA THR A 40 -4.123 9.095 0.786 1.00 0.00 C ATOM 575 C THR A 40 -4.791 9.617 -0.481 1.00 0.00 C ATOM 576 O THR A 40 -4.423 9.258 -1.599 1.00 0.00 O ATOM 577 CB THR A 40 -2.755 9.783 0.952 1.00 0.00 C ATOM 578 OG1 THR A 40 -2.110 9.312 2.141 1.00 0.00 O ATOM 579 CG2 THR A 40 -2.914 11.295 1.020 1.00 0.00 C ATOM 0 H THR A 40 -3.146 7.289 1.204 1.00 0.00 H new ATOM 0 HA THR A 40 -4.748 9.332 1.647 1.00 0.00 H new ATOM 0 HB THR A 40 -2.142 9.537 0.085 1.00 0.00 H new ATOM 0 HG1 THR A 40 -1.536 10.019 2.504 1.00 0.00 H new ATOM 0 HG21 THR A 40 -1.935 11.759 1.137 1.00 0.00 H new ATOM 0 HG22 THR A 40 -3.378 11.654 0.101 1.00 0.00 H new ATOM 0 HG23 THR A 40 -3.544 11.557 1.870 1.00 0.00 H new ATOM 587 N PRO A 41 -5.798 10.485 -0.305 1.00 0.00 N ATOM 588 CA PRO A 41 -6.539 11.076 -1.423 1.00 0.00 C ATOM 589 C PRO A 41 -5.695 12.066 -2.219 1.00 0.00 C ATOM 590 O PRO A 41 -5.111 12.991 -1.655 1.00 0.00 O ATOM 591 CB PRO A 41 -7.703 11.796 -0.737 1.00 0.00 C ATOM 592 CG PRO A 41 -7.208 12.093 0.636 1.00 0.00 C ATOM 593 CD PRO A 41 -6.291 10.958 1.000 1.00 0.00 C ATOM 0 HA PRO A 41 -6.853 10.324 -2.147 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.971 12.710 -1.267 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -8.595 11.170 -0.710 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -6.679 13.046 0.663 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -8.035 12.168 1.342 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.475 11.291 1.641 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -6.819 10.172 1.539 1.00 0.00 H new ATOM 601 N GLN A 42 -5.635 11.864 -3.531 1.00 0.00 N ATOM 602 CA GLN A 42 -4.861 12.740 -4.403 1.00 0.00 C ATOM 603 C GLN A 42 -3.450 12.941 -3.860 1.00 0.00 C ATOM 604 O GLN A 42 -2.879 14.025 -3.974 1.00 0.00 O ATOM 605 CB GLN A 42 -5.560 14.092 -4.554 1.00 0.00 C ATOM 606 CG GLN A 42 -6.871 14.017 -5.319 1.00 0.00 C ATOM 607 CD GLN A 42 -8.017 13.509 -4.467 1.00 0.00 C ATOM 608 OE1 GLN A 42 -8.230 13.978 -3.349 1.00 0.00 O ATOM 609 NE2 GLN A 42 -8.762 12.543 -4.991 1.00 0.00 N ATOM 0 H GLN A 42 -6.112 11.102 -4.013 1.00 0.00 H new ATOM 0 HA GLN A 42 -4.789 12.265 -5.381 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -5.750 14.506 -3.564 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -4.890 14.783 -5.065 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.120 15.006 -5.703 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -6.747 13.362 -6.181 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -8.550 12.183 -5.922 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -9.546 12.161 -4.463 1.00 0.00 H new ATOM 618 N GLY A 43 -2.893 11.889 -3.268 1.00 0.00 N ATOM 619 CA GLY A 43 -1.554 11.971 -2.716 1.00 0.00 C ATOM 620 C GLY A 43 -0.511 11.360 -3.630 1.00 0.00 C ATOM 621 O GLY A 43 -0.572 11.523 -4.849 1.00 0.00 O ATOM 0 H GLY A 43 -3.346 10.981 -3.161 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.304 13.016 -2.532 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.530 11.463 -1.752 1.00 0.00 H new ATOM 625 N VAL A 44 0.451 10.657 -3.041 1.00 0.00 N ATOM 626 CA VAL A 44 1.513 10.020 -3.811 1.00 0.00 C ATOM 627 C VAL A 44 1.084 8.643 -4.304 1.00 0.00 C ATOM 628 O VAL A 44 1.171 8.344 -5.495 1.00 0.00 O ATOM 629 CB VAL A 44 2.801 9.877 -2.979 1.00 0.00 C ATOM 630 CG1 VAL A 44 3.868 9.136 -3.770 1.00 0.00 C ATOM 631 CG2 VAL A 44 3.305 11.243 -2.538 1.00 0.00 C ATOM 0 H VAL A 44 0.517 10.514 -2.033 1.00 0.00 H new ATOM 0 HA VAL A 44 1.712 10.664 -4.668 1.00 0.00 H new ATOM 0 HB VAL A 44 2.573 9.294 -2.087 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.771 9.045 -3.166 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.503 8.142 -4.031 1.00 0.00 H new ATOM 0 HG13 VAL A 44 4.096 9.689 -4.681 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.216 11.123 -1.951 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.517 11.853 -3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.544 11.733 -1.930 1.00 0.00 H new ATOM 641 N ALA A 45 0.620 7.807 -3.381 1.00 0.00 N ATOM 642 CA ALA A 45 0.175 6.462 -3.722 1.00 0.00 C ATOM 643 C ALA A 45 -1.029 6.503 -4.657 1.00 0.00 C ATOM 644 O ALA A 45 -0.946 6.078 -5.809 1.00 0.00 O ATOM 645 CB ALA A 45 -0.162 5.682 -2.460 1.00 0.00 C ATOM 0 H ALA A 45 0.543 8.038 -2.391 1.00 0.00 H new ATOM 0 HA ALA A 45 0.989 5.957 -4.242 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -0.493 4.679 -2.730 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.723 5.614 -1.827 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.958 6.193 -1.918 1.00 0.00 H new ATOM 651 N MET A 46 -2.147 7.016 -4.154 1.00 0.00 N ATOM 652 CA MET A 46 -3.367 7.113 -4.946 1.00 0.00 C ATOM 653 C MET A 46 -3.056 7.554 -6.373 1.00 0.00 C ATOM 654 O MET A 46 -3.680 7.087 -7.326 1.00 0.00 O ATOM 655 CB MET A 46 -4.345 8.095 -4.298 1.00 0.00 C ATOM 656 CG MET A 46 -5.553 8.411 -5.165 1.00 0.00 C ATOM 657 SD MET A 46 -7.022 8.798 -4.194 1.00 0.00 S ATOM 658 CE MET A 46 -7.485 7.168 -3.613 1.00 0.00 C ATOM 0 H MET A 46 -2.233 7.371 -3.202 1.00 0.00 H new ATOM 0 HA MET A 46 -3.826 6.125 -4.982 1.00 0.00 H new ATOM 0 HB2 MET A 46 -4.687 7.681 -3.349 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.819 9.022 -4.070 1.00 0.00 H new ATOM 0 HG2 MET A 46 -5.319 9.255 -5.814 1.00 0.00 H new ATOM 0 HG3 MET A 46 -5.764 7.560 -5.812 1.00 0.00 H new ATOM 0 HE1 MET A 46 -8.547 7.004 -3.797 1.00 0.00 H new ATOM 0 HE2 MET A 46 -6.904 6.414 -4.144 1.00 0.00 H new ATOM 0 HE3 MET A 46 -7.286 7.093 -2.544 1.00 0.00 H new ATOM 668 N ARG A 47 -2.089 8.454 -6.511 1.00 0.00 N ATOM 669 CA ARG A 47 -1.697 8.959 -7.822 1.00 0.00 C ATOM 670 C ARG A 47 -0.962 7.886 -8.620 1.00 0.00 C ATOM 671 O ARG A 47 -1.123 7.784 -9.836 1.00 0.00 O ATOM 672 CB ARG A 47 -0.809 10.195 -7.671 1.00 0.00 C ATOM 673 CG ARG A 47 -0.767 11.070 -8.913 1.00 0.00 C ATOM 674 CD ARG A 47 0.246 10.554 -9.923 1.00 0.00 C ATOM 675 NE ARG A 47 0.560 11.552 -10.942 1.00 0.00 N ATOM 676 CZ ARG A 47 1.423 12.545 -10.758 1.00 0.00 C ATOM 677 NH1 ARG A 47 2.055 12.671 -9.599 1.00 0.00 N ATOM 678 NH2 ARG A 47 1.655 13.414 -11.733 1.00 0.00 N ATOM 0 H ARG A 47 -1.562 8.849 -5.732 1.00 0.00 H new ATOM 0 HA ARG A 47 -2.602 9.234 -8.363 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.168 10.789 -6.830 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.204 9.876 -7.427 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.756 11.101 -9.371 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.514 12.092 -8.631 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.160 10.265 -9.404 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -0.145 9.657 -10.403 1.00 0.00 H new ATOM 0 HE ARG A 47 0.091 11.483 -11.845 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.879 12.005 -8.847 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.717 13.434 -9.460 1.00 0.00 H new ATOM 0 HH21 ARG A 47 1.170 13.320 -12.626 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.318 14.176 -11.590 1.00 0.00 H new ATOM 692 N ALA A 48 -0.156 7.089 -7.927 1.00 0.00 N ATOM 693 CA ALA A 48 0.602 6.023 -8.571 1.00 0.00 C ATOM 694 C ALA A 48 -0.327 4.969 -9.162 1.00 0.00 C ATOM 695 O ALA A 48 0.071 4.196 -10.033 1.00 0.00 O ATOM 696 CB ALA A 48 1.563 5.385 -7.578 1.00 0.00 C ATOM 0 H ALA A 48 -0.011 7.161 -6.920 1.00 0.00 H new ATOM 0 HA ALA A 48 1.177 6.461 -9.387 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.123 4.591 -8.072 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.256 6.140 -7.206 1.00 0.00 H new ATOM 0 HB3 ALA A 48 1.000 4.967 -6.744 1.00 0.00 H new ATOM 702 N GLY A 49 -1.567 4.943 -8.684 1.00 0.00 N ATOM 703 CA GLY A 49 -2.533 3.979 -9.177 1.00 0.00 C ATOM 704 C GLY A 49 -2.665 2.773 -8.268 1.00 0.00 C ATOM 705 O GLY A 49 -2.963 1.670 -8.726 1.00 0.00 O ATOM 0 H GLY A 49 -1.920 5.573 -7.964 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -3.505 4.462 -9.278 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -2.236 3.649 -10.173 1.00 0.00 H new ATOM 709 N VAL A 50 -2.440 2.982 -6.974 1.00 0.00 N ATOM 710 CA VAL A 50 -2.534 1.903 -5.998 1.00 0.00 C ATOM 711 C VAL A 50 -3.868 1.945 -5.260 1.00 0.00 C ATOM 712 O VAL A 50 -4.288 2.995 -4.772 1.00 0.00 O ATOM 713 CB VAL A 50 -1.389 1.974 -4.970 1.00 0.00 C ATOM 714 CG1 VAL A 50 -1.308 3.363 -4.356 1.00 0.00 C ATOM 715 CG2 VAL A 50 -1.575 0.916 -3.893 1.00 0.00 C ATOM 0 H VAL A 50 -2.191 3.889 -6.578 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.457 0.967 -6.552 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.449 1.775 -5.484 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.493 3.394 -3.632 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.125 4.097 -5.140 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.248 3.595 -3.855 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -0.757 0.980 -3.175 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.522 1.082 -3.380 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.579 -0.073 -4.351 1.00 0.00 H new ATOM 725 N LEU A 51 -4.531 0.796 -5.183 1.00 0.00 N ATOM 726 CA LEU A 51 -5.818 0.700 -4.503 1.00 0.00 C ATOM 727 C LEU A 51 -5.638 0.265 -3.053 1.00 0.00 C ATOM 728 O LEU A 51 -4.591 -0.264 -2.679 1.00 0.00 O ATOM 729 CB LEU A 51 -6.730 -0.287 -5.234 1.00 0.00 C ATOM 730 CG LEU A 51 -7.479 0.264 -6.448 1.00 0.00 C ATOM 731 CD1 LEU A 51 -7.753 -0.844 -7.454 1.00 0.00 C ATOM 732 CD2 LEU A 51 -8.778 0.929 -6.017 1.00 0.00 C ATOM 0 H LEU A 51 -4.199 -0.082 -5.583 1.00 0.00 H new ATOM 0 HA LEU A 51 -6.280 1.687 -4.511 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -6.128 -1.136 -5.558 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.462 -0.669 -4.523 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.852 1.015 -6.928 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.287 -0.433 -8.311 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -6.809 -1.275 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -8.360 -1.619 -6.986 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -9.297 1.315 -6.894 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -9.411 0.199 -5.513 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.558 1.750 -5.335 1.00 0.00 H new ATOM 744 N ALA A 52 -6.665 0.489 -2.241 1.00 0.00 N ATOM 745 CA ALA A 52 -6.622 0.116 -0.832 1.00 0.00 C ATOM 746 C ALA A 52 -6.795 -1.389 -0.657 1.00 0.00 C ATOM 747 O ALA A 52 -7.118 -2.101 -1.608 1.00 0.00 O ATOM 748 CB ALA A 52 -7.692 0.867 -0.054 1.00 0.00 C ATOM 0 H ALA A 52 -7.538 0.927 -2.534 1.00 0.00 H new ATOM 0 HA ALA A 52 -5.643 0.391 -0.439 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -7.648 0.579 0.996 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.521 1.940 -0.143 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -8.675 0.621 -0.457 1.00 0.00 H new ATOM 754 N ASP A 53 -6.579 -1.867 0.563 1.00 0.00 N ATOM 755 CA ASP A 53 -6.711 -3.288 0.863 1.00 0.00 C ATOM 756 C ASP A 53 -5.983 -4.133 -0.177 1.00 0.00 C ATOM 757 O ASP A 53 -6.339 -5.288 -0.413 1.00 0.00 O ATOM 758 CB ASP A 53 -8.188 -3.684 0.917 1.00 0.00 C ATOM 759 CG ASP A 53 -8.775 -3.540 2.307 1.00 0.00 C ATOM 760 OD1 ASP A 53 -9.243 -2.431 2.641 1.00 0.00 O ATOM 761 OD2 ASP A 53 -8.766 -4.535 3.061 1.00 0.00 O ATOM 0 H ASP A 53 -6.311 -1.291 1.361 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.257 -3.472 1.837 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -8.753 -3.064 0.221 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -8.297 -4.716 0.585 1.00 0.00 H new ATOM 766 N ASP A 54 -4.963 -3.550 -0.797 1.00 0.00 N ATOM 767 CA ASP A 54 -4.184 -4.249 -1.812 1.00 0.00 C ATOM 768 C ASP A 54 -3.073 -5.074 -1.172 1.00 0.00 C ATOM 769 O ASP A 54 -2.048 -4.536 -0.751 1.00 0.00 O ATOM 770 CB ASP A 54 -3.587 -3.250 -2.805 1.00 0.00 C ATOM 771 CG ASP A 54 -4.508 -2.979 -3.978 1.00 0.00 C ATOM 772 OD1 ASP A 54 -5.474 -3.748 -4.164 1.00 0.00 O ATOM 773 OD2 ASP A 54 -4.262 -1.998 -4.711 1.00 0.00 O ATOM 0 H ASP A 54 -4.656 -2.595 -0.614 1.00 0.00 H new ATOM 0 HA ASP A 54 -4.852 -4.925 -2.346 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -3.374 -2.313 -2.290 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -2.636 -3.634 -3.175 1.00 0.00 H new ATOM 778 N HIS A 55 -3.283 -6.385 -1.100 1.00 0.00 N ATOM 779 CA HIS A 55 -2.298 -7.286 -0.510 1.00 0.00 C ATOM 780 C HIS A 55 -0.912 -7.032 -1.093 1.00 0.00 C ATOM 781 O HIS A 55 -0.673 -7.266 -2.279 1.00 0.00 O ATOM 782 CB HIS A 55 -2.704 -8.741 -0.743 1.00 0.00 C ATOM 783 CG HIS A 55 -2.178 -9.683 0.296 1.00 0.00 C ATOM 784 ND1 HIS A 55 -2.678 -10.954 0.483 1.00 0.00 N ATOM 785 CD2 HIS A 55 -1.187 -9.533 1.207 1.00 0.00 C ATOM 786 CE1 HIS A 55 -2.020 -11.545 1.464 1.00 0.00 C ATOM 787 NE2 HIS A 55 -1.109 -10.704 1.920 1.00 0.00 N ATOM 0 H HIS A 55 -4.125 -6.847 -1.442 1.00 0.00 H new ATOM 0 HA HIS A 55 -2.262 -7.094 0.562 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -3.792 -8.807 -0.764 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -2.346 -9.057 -1.723 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.573 -8.656 1.347 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.197 -12.545 1.831 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -0.454 -10.894 2.679 1.00 0.00 H new ATOM 796 N LEU A 56 -0.001 -6.552 -0.253 1.00 0.00 N ATOM 797 CA LEU A 56 1.363 -6.266 -0.686 1.00 0.00 C ATOM 798 C LEU A 56 2.068 -7.540 -1.142 1.00 0.00 C ATOM 799 O LEU A 56 1.878 -8.608 -0.560 1.00 0.00 O ATOM 800 CB LEU A 56 2.152 -5.611 0.450 1.00 0.00 C ATOM 801 CG LEU A 56 3.201 -4.581 0.030 1.00 0.00 C ATOM 802 CD1 LEU A 56 2.596 -3.186 -0.003 1.00 0.00 C ATOM 803 CD2 LEU A 56 4.396 -4.624 0.971 1.00 0.00 C ATOM 0 H LEU A 56 -0.182 -6.353 0.731 1.00 0.00 H new ATOM 0 HA LEU A 56 1.314 -5.578 -1.530 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.446 -5.127 1.124 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.650 -6.396 1.020 1.00 0.00 H new ATOM 0 HG LEU A 56 3.545 -4.829 -0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.357 -2.466 -0.304 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.773 -3.163 -0.717 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.224 -2.927 0.988 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.133 -3.885 0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.068 -4.401 1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.845 -5.617 0.944 1.00 0.00 H new ATOM 815 N ILE A 57 2.883 -7.417 -2.184 1.00 0.00 N ATOM 816 CA ILE A 57 3.620 -8.558 -2.715 1.00 0.00 C ATOM 817 C ILE A 57 5.114 -8.423 -2.443 1.00 0.00 C ATOM 818 O ILE A 57 5.741 -9.334 -1.905 1.00 0.00 O ATOM 819 CB ILE A 57 3.397 -8.715 -4.231 1.00 0.00 C ATOM 820 CG1 ILE A 57 1.908 -8.897 -4.534 1.00 0.00 C ATOM 821 CG2 ILE A 57 4.200 -9.891 -4.765 1.00 0.00 C ATOM 822 CD1 ILE A 57 1.361 -10.236 -4.090 1.00 0.00 C ATOM 0 H ILE A 57 3.050 -6.540 -2.677 1.00 0.00 H new ATOM 0 HA ILE A 57 3.240 -9.444 -2.206 1.00 0.00 H new ATOM 0 HB ILE A 57 3.741 -7.809 -4.730 1.00 0.00 H new ATOM 0 HG12 ILE A 57 1.346 -8.103 -4.043 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.747 -8.785 -5.606 1.00 0.00 H new ATOM 0 HG21 ILE A 57 4.032 -9.989 -5.838 1.00 0.00 H new ATOM 0 HG22 ILE A 57 5.260 -9.722 -4.578 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.884 -10.805 -4.263 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.301 -10.296 -4.336 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.898 -11.036 -4.601 1.00 0.00 H new ATOM 0 HD13 ILE A 57 1.490 -10.343 -3.013 1.00 0.00 H new ATOM 834 N GLU A 58 5.677 -7.278 -2.817 1.00 0.00 N ATOM 835 CA GLU A 58 7.098 -7.023 -2.612 1.00 0.00 C ATOM 836 C GLU A 58 7.401 -5.530 -2.697 1.00 0.00 C ATOM 837 O GLU A 58 6.558 -4.737 -3.116 1.00 0.00 O ATOM 838 CB GLU A 58 7.929 -7.783 -3.648 1.00 0.00 C ATOM 839 CG GLU A 58 7.557 -7.458 -5.085 1.00 0.00 C ATOM 840 CD GLU A 58 8.245 -8.366 -6.086 1.00 0.00 C ATOM 841 OE1 GLU A 58 9.493 -8.424 -6.073 1.00 0.00 O ATOM 842 OE2 GLU A 58 7.537 -9.018 -6.882 1.00 0.00 O ATOM 0 H GLU A 58 5.171 -6.513 -3.263 1.00 0.00 H new ATOM 0 HA GLU A 58 7.364 -7.374 -1.615 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.984 -7.554 -3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.808 -8.854 -3.484 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.477 -7.544 -5.205 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.820 -6.422 -5.299 1.00 0.00 H new ATOM 849 N VAL A 59 8.611 -5.154 -2.296 1.00 0.00 N ATOM 850 CA VAL A 59 9.027 -3.757 -2.327 1.00 0.00 C ATOM 851 C VAL A 59 10.388 -3.603 -2.996 1.00 0.00 C ATOM 852 O VAL A 59 11.353 -4.268 -2.623 1.00 0.00 O ATOM 853 CB VAL A 59 9.095 -3.161 -0.908 1.00 0.00 C ATOM 854 CG1 VAL A 59 9.463 -1.686 -0.966 1.00 0.00 C ATOM 855 CG2 VAL A 59 7.773 -3.360 -0.183 1.00 0.00 C ATOM 0 H VAL A 59 9.321 -5.798 -1.946 1.00 0.00 H new ATOM 0 HA VAL A 59 8.278 -3.216 -2.906 1.00 0.00 H new ATOM 0 HB VAL A 59 9.872 -3.684 -0.350 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.506 -1.282 0.045 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.436 -1.572 -1.444 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.711 -1.146 -1.541 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.839 -2.933 0.818 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.976 -2.864 -0.737 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.555 -4.425 -0.109 1.00 0.00 H new ATOM 865 N ASN A 60 10.457 -2.722 -3.988 1.00 0.00 N ATOM 866 CA ASN A 60 11.700 -2.480 -4.711 1.00 0.00 C ATOM 867 C ASN A 60 12.304 -3.790 -5.208 1.00 0.00 C ATOM 868 O ASN A 60 13.520 -3.977 -5.176 1.00 0.00 O ATOM 869 CB ASN A 60 12.703 -1.751 -3.814 1.00 0.00 C ATOM 870 CG ASN A 60 12.276 -0.329 -3.507 1.00 0.00 C ATOM 871 OD1 ASN A 60 12.320 0.545 -4.373 1.00 0.00 O ATOM 872 ND2 ASN A 60 11.860 -0.090 -2.268 1.00 0.00 N ATOM 0 H ASN A 60 9.667 -2.163 -4.310 1.00 0.00 H new ATOM 0 HA ASN A 60 11.473 -1.854 -5.574 1.00 0.00 H new ATOM 0 HB2 ASN A 60 12.819 -2.302 -2.881 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.679 -1.738 -4.300 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.561 0.848 -2.003 1.00 0.00 H new ATOM 0 HD22 ASN A 60 11.840 -0.845 -1.582 1.00 0.00 H new ATOM 879 N GLY A 61 11.445 -4.695 -5.667 1.00 0.00 N ATOM 880 CA GLY A 61 11.912 -5.976 -6.164 1.00 0.00 C ATOM 881 C GLY A 61 12.420 -6.878 -5.056 1.00 0.00 C ATOM 882 O GLY A 61 13.479 -7.491 -5.183 1.00 0.00 O ATOM 0 H GLY A 61 10.434 -4.564 -5.704 1.00 0.00 H new ATOM 0 HA2 GLY A 61 11.099 -6.476 -6.691 1.00 0.00 H new ATOM 0 HA3 GLY A 61 12.709 -5.812 -6.889 1.00 0.00 H new ATOM 886 N GLU A 62 11.663 -6.958 -3.966 1.00 0.00 N ATOM 887 CA GLU A 62 12.044 -7.789 -2.831 1.00 0.00 C ATOM 888 C GLU A 62 10.819 -8.446 -2.202 1.00 0.00 C ATOM 889 O GLU A 62 9.995 -7.778 -1.578 1.00 0.00 O ATOM 890 CB GLU A 62 12.783 -6.954 -1.784 1.00 0.00 C ATOM 891 CG GLU A 62 14.195 -6.573 -2.195 1.00 0.00 C ATOM 892 CD GLU A 62 14.861 -5.640 -1.202 1.00 0.00 C ATOM 893 OE1 GLU A 62 15.469 -6.142 -0.233 1.00 0.00 O ATOM 894 OE2 GLU A 62 14.773 -4.409 -1.393 1.00 0.00 O ATOM 0 H GLU A 62 10.783 -6.457 -3.846 1.00 0.00 H new ATOM 0 HA GLU A 62 12.709 -8.573 -3.195 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.213 -6.046 -1.588 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.824 -7.513 -0.849 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.796 -7.477 -2.298 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.168 -6.095 -3.174 1.00 0.00 H new ATOM 901 N ASN A 63 10.706 -9.760 -2.371 1.00 0.00 N ATOM 902 CA ASN A 63 9.581 -10.507 -1.821 1.00 0.00 C ATOM 903 C ASN A 63 9.384 -10.185 -0.343 1.00 0.00 C ATOM 904 O ASN A 63 10.242 -10.482 0.488 1.00 0.00 O ATOM 905 CB ASN A 63 9.804 -12.010 -2.001 1.00 0.00 C ATOM 906 CG ASN A 63 8.603 -12.829 -1.570 1.00 0.00 C ATOM 907 OD1 ASN A 63 8.735 -13.800 -0.825 1.00 0.00 O ATOM 908 ND2 ASN A 63 7.423 -12.439 -2.037 1.00 0.00 N ATOM 0 H ASN A 63 11.380 -10.329 -2.884 1.00 0.00 H new ATOM 0 HA ASN A 63 8.682 -10.212 -2.362 1.00 0.00 H new ATOM 0 HB2 ASN A 63 10.026 -12.219 -3.048 1.00 0.00 H new ATOM 0 HB3 ASN A 63 10.676 -12.317 -1.423 1.00 0.00 H new ATOM 0 HD21 ASN A 63 6.579 -12.951 -1.781 1.00 0.00 H new ATOM 0 HD22 ASN A 63 7.361 -11.628 -2.652 1.00 0.00 H new ATOM 915 N VAL A 64 8.248 -9.574 -0.023 1.00 0.00 N ATOM 916 CA VAL A 64 7.936 -9.212 1.355 1.00 0.00 C ATOM 917 C VAL A 64 6.573 -9.753 1.770 1.00 0.00 C ATOM 918 O VAL A 64 6.040 -9.382 2.816 1.00 0.00 O ATOM 919 CB VAL A 64 7.952 -7.684 1.551 1.00 0.00 C ATOM 920 CG1 VAL A 64 9.175 -7.073 0.886 1.00 0.00 C ATOM 921 CG2 VAL A 64 6.674 -7.065 1.007 1.00 0.00 C ATOM 0 H VAL A 64 7.528 -9.319 -0.699 1.00 0.00 H new ATOM 0 HA VAL A 64 8.707 -9.659 1.982 1.00 0.00 H new ATOM 0 HB VAL A 64 8.006 -7.472 2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.169 -5.993 1.035 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.078 -7.495 1.327 1.00 0.00 H new ATOM 0 HG13 VAL A 64 9.156 -7.292 -0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 64 6.702 -5.985 1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.588 -7.285 -0.057 1.00 0.00 H new ATOM 0 HG23 VAL A 64 5.815 -7.481 1.534 1.00 0.00 H new ATOM 931 N GLU A 65 6.014 -10.631 0.944 1.00 0.00 N ATOM 932 CA GLU A 65 4.711 -11.223 1.226 1.00 0.00 C ATOM 933 C GLU A 65 4.652 -11.750 2.657 1.00 0.00 C ATOM 934 O GLU A 65 3.749 -11.406 3.420 1.00 0.00 O ATOM 935 CB GLU A 65 4.417 -12.356 0.241 1.00 0.00 C ATOM 936 CG GLU A 65 3.837 -11.878 -1.080 1.00 0.00 C ATOM 937 CD GLU A 65 2.327 -11.744 -1.040 1.00 0.00 C ATOM 938 OE1 GLU A 65 1.822 -10.980 -0.192 1.00 0.00 O ATOM 939 OE2 GLU A 65 1.651 -12.404 -1.857 1.00 0.00 O ATOM 0 H GLU A 65 6.442 -10.948 0.074 1.00 0.00 H new ATOM 0 HA GLU A 65 3.955 -10.447 1.111 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.338 -12.905 0.046 1.00 0.00 H new ATOM 0 HB3 GLU A 65 3.720 -13.056 0.702 1.00 0.00 H new ATOM 0 HG2 GLU A 65 4.277 -10.915 -1.338 1.00 0.00 H new ATOM 0 HG3 GLU A 65 4.115 -12.577 -1.869 1.00 0.00 H new ATOM 946 N ASP A 66 5.620 -12.588 3.013 1.00 0.00 N ATOM 947 CA ASP A 66 5.679 -13.163 4.352 1.00 0.00 C ATOM 948 C ASP A 66 6.488 -12.274 5.290 1.00 0.00 C ATOM 949 O ASP A 66 6.410 -12.409 6.511 1.00 0.00 O ATOM 950 CB ASP A 66 6.292 -14.564 4.301 1.00 0.00 C ATOM 951 CG ASP A 66 7.755 -14.541 3.904 1.00 0.00 C ATOM 952 OD1 ASP A 66 8.098 -13.820 2.944 1.00 0.00 O ATOM 953 OD2 ASP A 66 8.557 -15.246 4.552 1.00 0.00 O ATOM 0 H ASP A 66 6.374 -12.884 2.393 1.00 0.00 H new ATOM 0 HA ASP A 66 4.661 -13.233 4.736 1.00 0.00 H new ATOM 0 HB2 ASP A 66 6.191 -15.038 5.278 1.00 0.00 H new ATOM 0 HB3 ASP A 66 5.735 -15.176 3.591 1.00 0.00 H new ATOM 958 N ALA A 67 7.266 -11.365 4.711 1.00 0.00 N ATOM 959 CA ALA A 67 8.089 -10.453 5.496 1.00 0.00 C ATOM 960 C ALA A 67 7.238 -9.647 6.471 1.00 0.00 C ATOM 961 O ALA A 67 6.159 -9.170 6.121 1.00 0.00 O ATOM 962 CB ALA A 67 8.868 -9.522 4.578 1.00 0.00 C ATOM 0 H ALA A 67 7.344 -11.241 3.702 1.00 0.00 H new ATOM 0 HA ALA A 67 8.795 -11.048 6.076 1.00 0.00 H new ATOM 0 HB1 ALA A 67 9.478 -8.847 5.178 1.00 0.00 H new ATOM 0 HB2 ALA A 67 9.513 -10.110 3.925 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.172 -8.941 3.973 1.00 0.00 H new ATOM 968 N SER A 68 7.731 -9.499 7.697 1.00 0.00 N ATOM 969 CA SER A 68 7.013 -8.755 8.725 1.00 0.00 C ATOM 970 C SER A 68 7.028 -7.260 8.423 1.00 0.00 C ATOM 971 O SER A 68 7.800 -6.791 7.586 1.00 0.00 O ATOM 972 CB SER A 68 7.633 -9.015 10.100 1.00 0.00 C ATOM 973 OG SER A 68 7.061 -10.160 10.708 1.00 0.00 O ATOM 0 H SER A 68 8.625 -9.885 8.002 1.00 0.00 H new ATOM 0 HA SER A 68 5.978 -9.097 8.730 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.709 -9.153 9.997 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.483 -8.146 10.740 1.00 0.00 H new ATOM 0 HG SER A 68 7.475 -10.306 11.584 1.00 0.00 H new ATOM 979 N HIS A 69 6.169 -6.515 9.111 1.00 0.00 N ATOM 980 CA HIS A 69 6.082 -5.071 8.917 1.00 0.00 C ATOM 981 C HIS A 69 7.421 -4.402 9.214 1.00 0.00 C ATOM 982 O HIS A 69 7.871 -3.535 8.466 1.00 0.00 O ATOM 983 CB HIS A 69 4.993 -4.480 9.813 1.00 0.00 C ATOM 984 CG HIS A 69 4.510 -3.137 9.361 1.00 0.00 C ATOM 985 ND1 HIS A 69 3.238 -2.670 9.615 1.00 0.00 N ATOM 986 CD2 HIS A 69 5.137 -2.157 8.668 1.00 0.00 C ATOM 987 CE1 HIS A 69 3.102 -1.462 9.097 1.00 0.00 C ATOM 988 NE2 HIS A 69 4.241 -1.128 8.516 1.00 0.00 N ATOM 0 H HIS A 69 5.523 -6.887 9.808 1.00 0.00 H new ATOM 0 HA HIS A 69 5.825 -4.883 7.874 1.00 0.00 H new ATOM 0 HB2 HIS A 69 4.148 -5.168 9.847 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.377 -4.396 10.830 1.00 0.00 H new ATOM 0 HD2 HIS A 69 6.153 -2.181 8.303 1.00 0.00 H new ATOM 0 HE1 HIS A 69 2.212 -0.852 9.141 1.00 0.00 H new ATOM 0 HE2 HIS A 69 4.425 -0.249 8.033 1.00 0.00 H new ATOM 997 N GLU A 70 8.051 -4.811 10.311 1.00 0.00 N ATOM 998 CA GLU A 70 9.337 -4.249 10.707 1.00 0.00 C ATOM 999 C GLU A 70 10.383 -4.464 9.617 1.00 0.00 C ATOM 1000 O GLU A 70 11.313 -3.671 9.470 1.00 0.00 O ATOM 1001 CB GLU A 70 9.813 -4.880 12.017 1.00 0.00 C ATOM 1002 CG GLU A 70 9.239 -4.215 13.257 1.00 0.00 C ATOM 1003 CD GLU A 70 7.732 -4.351 13.347 1.00 0.00 C ATOM 1004 OE1 GLU A 70 7.211 -5.428 12.985 1.00 0.00 O ATOM 1005 OE2 GLU A 70 7.073 -3.382 13.778 1.00 0.00 O ATOM 0 H GLU A 70 7.692 -5.529 10.941 1.00 0.00 H new ATOM 0 HA GLU A 70 9.206 -3.177 10.855 1.00 0.00 H new ATOM 0 HB2 GLU A 70 9.541 -5.935 12.022 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.901 -4.831 12.060 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.693 -4.656 14.144 1.00 0.00 H new ATOM 0 HG3 GLU A 70 9.505 -3.158 13.254 1.00 0.00 H new ATOM 1012 N GLU A 71 10.223 -5.542 8.855 1.00 0.00 N ATOM 1013 CA GLU A 71 11.154 -5.861 7.779 1.00 0.00 C ATOM 1014 C GLU A 71 10.927 -4.952 6.575 1.00 0.00 C ATOM 1015 O GLU A 71 11.874 -4.546 5.902 1.00 0.00 O ATOM 1016 CB GLU A 71 11.003 -7.325 7.362 1.00 0.00 C ATOM 1017 CG GLU A 71 11.562 -8.308 8.377 1.00 0.00 C ATOM 1018 CD GLU A 71 11.436 -7.808 9.803 1.00 0.00 C ATOM 1019 OE1 GLU A 71 12.024 -6.751 10.114 1.00 0.00 O ATOM 1020 OE2 GLU A 71 10.752 -8.474 10.608 1.00 0.00 O ATOM 0 H GLU A 71 9.458 -6.208 8.963 1.00 0.00 H new ATOM 0 HA GLU A 71 12.166 -5.698 8.149 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.947 -7.542 7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.507 -7.476 6.407 1.00 0.00 H new ATOM 0 HG2 GLU A 71 11.039 -9.260 8.282 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.612 -8.498 8.154 1.00 0.00 H new ATOM 1027 N VAL A 72 9.663 -4.636 6.309 1.00 0.00 N ATOM 1028 CA VAL A 72 9.310 -3.775 5.187 1.00 0.00 C ATOM 1029 C VAL A 72 9.597 -2.312 5.506 1.00 0.00 C ATOM 1030 O VAL A 72 10.387 -1.660 4.823 1.00 0.00 O ATOM 1031 CB VAL A 72 7.824 -3.925 4.810 1.00 0.00 C ATOM 1032 CG1 VAL A 72 7.462 -2.974 3.679 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.515 -5.364 4.428 1.00 0.00 C ATOM 0 H VAL A 72 8.867 -4.964 6.856 1.00 0.00 H new ATOM 0 HA VAL A 72 9.924 -4.087 4.343 1.00 0.00 H new ATOM 0 HB VAL A 72 7.218 -3.666 5.678 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.409 -3.094 3.426 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.645 -1.947 3.995 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.073 -3.199 2.805 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.461 -5.452 4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 72 8.128 -5.653 3.574 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.734 -6.019 5.271 1.00 0.00 H new ATOM 1043 N VAL A 73 8.949 -1.801 6.548 1.00 0.00 N ATOM 1044 CA VAL A 73 9.136 -0.415 6.960 1.00 0.00 C ATOM 1045 C VAL A 73 10.568 0.045 6.710 1.00 0.00 C ATOM 1046 O VAL A 73 10.798 1.057 6.049 1.00 0.00 O ATOM 1047 CB VAL A 73 8.799 -0.221 8.450 1.00 0.00 C ATOM 1048 CG1 VAL A 73 9.603 -1.185 9.309 1.00 0.00 C ATOM 1049 CG2 VAL A 73 9.052 1.219 8.871 1.00 0.00 C ATOM 0 H VAL A 73 8.290 -2.326 7.122 1.00 0.00 H new ATOM 0 HA VAL A 73 8.454 0.187 6.360 1.00 0.00 H new ATOM 0 HB VAL A 73 7.741 -0.437 8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 73 9.352 -1.033 10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 73 9.367 -2.210 9.024 1.00 0.00 H new ATOM 0 HG13 VAL A 73 10.667 -1.003 9.161 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.808 1.338 9.927 1.00 0.00 H new ATOM 0 HG22 VAL A 73 10.102 1.466 8.711 1.00 0.00 H new ATOM 0 HG23 VAL A 73 8.428 1.887 8.277 1.00 0.00 H new ATOM 1059 N GLU A 74 11.526 -0.706 7.243 1.00 0.00 N ATOM 1060 CA GLU A 74 12.936 -0.375 7.077 1.00 0.00 C ATOM 1061 C GLU A 74 13.347 -0.460 5.610 1.00 0.00 C ATOM 1062 O GLU A 74 14.054 0.409 5.100 1.00 0.00 O ATOM 1063 CB GLU A 74 13.805 -1.314 7.917 1.00 0.00 C ATOM 1064 CG GLU A 74 13.847 -2.738 7.390 1.00 0.00 C ATOM 1065 CD GLU A 74 14.616 -3.675 8.301 1.00 0.00 C ATOM 1066 OE1 GLU A 74 15.719 -3.297 8.747 1.00 0.00 O ATOM 1067 OE2 GLU A 74 14.113 -4.787 8.569 1.00 0.00 O ATOM 0 H GLU A 74 11.352 -1.547 7.793 1.00 0.00 H new ATOM 0 HA GLU A 74 13.085 0.649 7.418 1.00 0.00 H new ATOM 0 HB2 GLU A 74 14.820 -0.919 7.955 1.00 0.00 H new ATOM 0 HB3 GLU A 74 13.429 -1.325 8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.828 -3.108 7.271 1.00 0.00 H new ATOM 0 HG3 GLU A 74 14.305 -2.742 6.401 1.00 0.00 H new ATOM 1074 N LYS A 75 12.898 -1.514 4.937 1.00 0.00 N ATOM 1075 CA LYS A 75 13.217 -1.715 3.528 1.00 0.00 C ATOM 1076 C LYS A 75 12.783 -0.512 2.696 1.00 0.00 C ATOM 1077 O LYS A 75 13.427 -0.166 1.705 1.00 0.00 O ATOM 1078 CB LYS A 75 12.537 -2.982 3.006 1.00 0.00 C ATOM 1079 CG LYS A 75 13.311 -4.254 3.303 1.00 0.00 C ATOM 1080 CD LYS A 75 12.449 -5.490 3.108 1.00 0.00 C ATOM 1081 CE LYS A 75 13.286 -6.697 2.714 1.00 0.00 C ATOM 1082 NZ LYS A 75 13.798 -7.430 3.905 1.00 0.00 N ATOM 0 H LYS A 75 12.312 -2.243 5.345 1.00 0.00 H new ATOM 0 HA LYS A 75 14.297 -1.827 3.437 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.544 -3.060 3.448 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.400 -2.893 1.928 1.00 0.00 H new ATOM 0 HG2 LYS A 75 14.183 -4.311 2.651 1.00 0.00 H new ATOM 0 HG3 LYS A 75 13.681 -4.225 4.328 1.00 0.00 H new ATOM 0 HD2 LYS A 75 11.908 -5.706 4.029 1.00 0.00 H new ATOM 0 HD3 LYS A 75 11.703 -5.296 2.338 1.00 0.00 H new ATOM 0 HE2 LYS A 75 12.686 -7.371 2.103 1.00 0.00 H new ATOM 0 HE3 LYS A 75 14.125 -6.372 2.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 14.363 -8.246 3.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 14.392 -6.794 4.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.997 -7.763 4.479 1.00 0.00 H new ATOM 1096 N VAL A 76 11.689 0.122 3.105 1.00 0.00 N ATOM 1097 CA VAL A 76 11.171 1.287 2.399 1.00 0.00 C ATOM 1098 C VAL A 76 12.121 2.474 2.525 1.00 0.00 C ATOM 1099 O VAL A 76 12.653 2.966 1.530 1.00 0.00 O ATOM 1100 CB VAL A 76 9.784 1.695 2.929 1.00 0.00 C ATOM 1101 CG1 VAL A 76 9.340 3.011 2.308 1.00 0.00 C ATOM 1102 CG2 VAL A 76 8.767 0.597 2.658 1.00 0.00 C ATOM 0 H VAL A 76 11.144 -0.152 3.922 1.00 0.00 H new ATOM 0 HA VAL A 76 11.082 1.006 1.350 1.00 0.00 H new ATOM 0 HB VAL A 76 9.853 1.836 4.008 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.358 3.283 2.695 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.058 3.792 2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.286 2.902 1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.792 0.902 3.039 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.698 0.422 1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.081 -0.320 3.156 1.00 0.00 H new ATOM 1112 N LYS A 77 12.330 2.928 3.756 1.00 0.00 N ATOM 1113 CA LYS A 77 13.217 4.056 4.015 1.00 0.00 C ATOM 1114 C LYS A 77 14.584 3.830 3.378 1.00 0.00 C ATOM 1115 O LYS A 77 15.228 4.772 2.915 1.00 0.00 O ATOM 1116 CB LYS A 77 13.374 4.271 5.522 1.00 0.00 C ATOM 1117 CG LYS A 77 13.849 3.036 6.267 1.00 0.00 C ATOM 1118 CD LYS A 77 14.238 3.363 7.699 1.00 0.00 C ATOM 1119 CE LYS A 77 13.041 3.286 8.634 1.00 0.00 C ATOM 1120 NZ LYS A 77 13.303 3.972 9.929 1.00 0.00 N ATOM 0 H LYS A 77 11.897 2.532 4.590 1.00 0.00 H new ATOM 0 HA LYS A 77 12.772 4.946 3.571 1.00 0.00 H new ATOM 0 HB2 LYS A 77 14.081 5.082 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.418 4.589 5.937 1.00 0.00 H new ATOM 0 HG2 LYS A 77 13.060 2.284 6.266 1.00 0.00 H new ATOM 0 HG3 LYS A 77 14.703 2.603 5.747 1.00 0.00 H new ATOM 0 HD2 LYS A 77 15.009 2.669 8.035 1.00 0.00 H new ATOM 0 HD3 LYS A 77 14.669 4.363 7.740 1.00 0.00 H new ATOM 0 HE2 LYS A 77 12.174 3.739 8.152 1.00 0.00 H new ATOM 0 HE3 LYS A 77 12.793 2.241 8.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.463 3.897 10.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 14.114 3.524 10.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.515 4.975 9.754 1.00 0.00 H new ATOM 1134 N LYS A 78 15.022 2.576 3.356 1.00 0.00 N ATOM 1135 CA LYS A 78 16.312 2.226 2.772 1.00 0.00 C ATOM 1136 C LYS A 78 16.295 2.418 1.259 1.00 0.00 C ATOM 1137 O LYS A 78 17.220 2.993 0.687 1.00 0.00 O ATOM 1138 CB LYS A 78 16.670 0.776 3.109 1.00 0.00 C ATOM 1139 CG LYS A 78 17.197 0.592 4.521 1.00 0.00 C ATOM 1140 CD LYS A 78 17.958 -0.715 4.667 1.00 0.00 C ATOM 1141 CE LYS A 78 17.895 -1.241 6.092 1.00 0.00 C ATOM 1142 NZ LYS A 78 18.828 -2.382 6.304 1.00 0.00 N ATOM 0 H LYS A 78 14.503 1.785 3.736 1.00 0.00 H new ATOM 0 HA LYS A 78 17.067 2.889 3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 78 15.786 0.152 2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 78 17.420 0.422 2.401 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.851 1.425 4.778 1.00 0.00 H new ATOM 0 HG3 LYS A 78 16.366 0.611 5.226 1.00 0.00 H new ATOM 0 HD2 LYS A 78 17.542 -1.457 3.986 1.00 0.00 H new ATOM 0 HD3 LYS A 78 18.999 -0.565 4.379 1.00 0.00 H new ATOM 0 HE2 LYS A 78 18.140 -0.438 6.787 1.00 0.00 H new ATOM 0 HE3 LYS A 78 16.877 -1.558 6.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.755 -2.712 7.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 18.579 -3.159 5.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 19.803 -2.073 6.114 1.00 0.00 H new ATOM 1156 N SER A 79 15.236 1.934 0.618 1.00 0.00 N ATOM 1157 CA SER A 79 15.100 2.051 -0.830 1.00 0.00 C ATOM 1158 C SER A 79 15.708 3.359 -1.328 1.00 0.00 C ATOM 1159 O SER A 79 16.380 3.391 -2.358 1.00 0.00 O ATOM 1160 CB SER A 79 13.626 1.974 -1.232 1.00 0.00 C ATOM 1161 OG SER A 79 13.480 2.015 -2.641 1.00 0.00 O ATOM 0 H SER A 79 14.460 1.457 1.078 1.00 0.00 H new ATOM 0 HA SER A 79 15.638 1.222 -1.290 1.00 0.00 H new ATOM 0 HB2 SER A 79 13.187 1.055 -0.844 1.00 0.00 H new ATOM 0 HB3 SER A 79 13.079 2.803 -0.782 1.00 0.00 H new ATOM 0 HG SER A 79 13.175 2.906 -2.912 1.00 0.00 H new ATOM 1167 N GLY A 80 15.465 4.437 -0.589 1.00 0.00 N ATOM 1168 CA GLY A 80 15.995 5.733 -0.971 1.00 0.00 C ATOM 1169 C GLY A 80 14.915 6.792 -1.077 1.00 0.00 C ATOM 1170 O GLY A 80 14.227 7.087 -0.100 1.00 0.00 O ATOM 0 H GLY A 80 14.911 4.436 0.267 1.00 0.00 H new ATOM 0 HA2 GLY A 80 16.738 6.048 -0.239 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.508 5.645 -1.929 1.00 0.00 H new ATOM 1174 N SER A 81 14.767 7.367 -2.266 1.00 0.00 N ATOM 1175 CA SER A 81 13.767 8.403 -2.495 1.00 0.00 C ATOM 1176 C SER A 81 12.453 7.794 -2.975 1.00 0.00 C ATOM 1177 O SER A 81 11.394 8.044 -2.400 1.00 0.00 O ATOM 1178 CB SER A 81 14.278 9.417 -3.521 1.00 0.00 C ATOM 1179 OG SER A 81 15.331 10.199 -2.984 1.00 0.00 O ATOM 0 H SER A 81 15.327 7.133 -3.086 1.00 0.00 H new ATOM 0 HA SER A 81 13.586 8.914 -1.549 1.00 0.00 H new ATOM 0 HB2 SER A 81 14.627 8.894 -4.411 1.00 0.00 H new ATOM 0 HB3 SER A 81 13.461 10.067 -3.833 1.00 0.00 H new ATOM 0 HG SER A 81 15.641 10.838 -3.659 1.00 0.00 H new ATOM 1185 N ARG A 82 12.531 6.995 -4.034 1.00 0.00 N ATOM 1186 CA ARG A 82 11.349 6.351 -4.593 1.00 0.00 C ATOM 1187 C ARG A 82 11.370 4.849 -4.325 1.00 0.00 C ATOM 1188 O ARG A 82 12.423 4.270 -4.057 1.00 0.00 O ATOM 1189 CB ARG A 82 11.266 6.609 -6.099 1.00 0.00 C ATOM 1190 CG ARG A 82 11.529 8.056 -6.484 1.00 0.00 C ATOM 1191 CD ARG A 82 13.003 8.296 -6.773 1.00 0.00 C ATOM 1192 NE ARG A 82 13.328 8.078 -8.180 1.00 0.00 N ATOM 1193 CZ ARG A 82 14.570 8.040 -8.650 1.00 0.00 C ATOM 1194 NH1 ARG A 82 15.598 8.204 -7.829 1.00 0.00 N ATOM 1195 NH2 ARG A 82 14.785 7.837 -9.943 1.00 0.00 N ATOM 0 H ARG A 82 13.400 6.778 -4.522 1.00 0.00 H new ATOM 0 HA ARG A 82 10.471 6.777 -4.108 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.986 5.969 -6.609 1.00 0.00 H new ATOM 0 HB3 ARG A 82 10.277 6.321 -6.454 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.938 8.313 -7.363 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.203 8.713 -5.678 1.00 0.00 H new ATOM 0 HD2 ARG A 82 13.265 9.317 -6.494 1.00 0.00 H new ATOM 0 HD3 ARG A 82 13.606 7.632 -6.155 1.00 0.00 H new ATOM 0 HE ARG A 82 12.559 7.948 -8.838 1.00 0.00 H new ATOM 0 HH11 ARG A 82 15.436 8.360 -6.834 1.00 0.00 H new ATOM 0 HH12 ARG A 82 16.551 8.174 -8.192 1.00 0.00 H new ATOM 0 HH21 ARG A 82 13.996 7.710 -10.577 1.00 0.00 H new ATOM 0 HH22 ARG A 82 15.739 7.808 -10.303 1.00 0.00 H new ATOM 1209 N VAL A 83 10.199 4.223 -4.397 1.00 0.00 N ATOM 1210 CA VAL A 83 10.082 2.789 -4.162 1.00 0.00 C ATOM 1211 C VAL A 83 9.141 2.142 -5.172 1.00 0.00 C ATOM 1212 O VAL A 83 8.430 2.831 -5.903 1.00 0.00 O ATOM 1213 CB VAL A 83 9.574 2.493 -2.739 1.00 0.00 C ATOM 1214 CG1 VAL A 83 10.607 2.911 -1.704 1.00 0.00 C ATOM 1215 CG2 VAL A 83 8.246 3.194 -2.491 1.00 0.00 C ATOM 0 H VAL A 83 9.318 4.687 -4.616 1.00 0.00 H new ATOM 0 HA VAL A 83 11.080 2.366 -4.278 1.00 0.00 H new ATOM 0 HB VAL A 83 9.416 1.419 -2.645 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.229 2.694 -0.705 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.532 2.359 -1.870 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.801 3.980 -1.794 1.00 0.00 H new ATOM 0 HG21 VAL A 83 7.902 2.974 -1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.376 4.270 -2.604 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.508 2.840 -3.211 1.00 0.00 H new ATOM 1225 N MET A 84 9.142 0.813 -5.206 1.00 0.00 N ATOM 1226 CA MET A 84 8.286 0.073 -6.125 1.00 0.00 C ATOM 1227 C MET A 84 7.396 -0.909 -5.368 1.00 0.00 C ATOM 1228 O MET A 84 7.842 -1.984 -4.967 1.00 0.00 O ATOM 1229 CB MET A 84 9.135 -0.679 -7.153 1.00 0.00 C ATOM 1230 CG MET A 84 8.339 -1.664 -7.994 1.00 0.00 C ATOM 1231 SD MET A 84 9.391 -2.848 -8.856 1.00 0.00 S ATOM 1232 CE MET A 84 10.490 -1.744 -9.740 1.00 0.00 C ATOM 0 H MET A 84 9.725 0.228 -4.608 1.00 0.00 H new ATOM 0 HA MET A 84 7.648 0.789 -6.644 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.617 0.043 -7.812 1.00 0.00 H new ATOM 0 HB3 MET A 84 9.929 -1.216 -6.634 1.00 0.00 H new ATOM 0 HG2 MET A 84 7.641 -2.203 -7.353 1.00 0.00 H new ATOM 0 HG3 MET A 84 7.743 -1.115 -8.723 1.00 0.00 H new ATOM 0 HE1 MET A 84 11.057 -2.310 -10.479 1.00 0.00 H new ATOM 0 HE2 MET A 84 9.905 -0.974 -10.243 1.00 0.00 H new ATOM 0 HE3 MET A 84 11.178 -1.275 -9.036 1.00 0.00 H new ATOM 1242 N PHE A 85 6.137 -0.531 -5.176 1.00 0.00 N ATOM 1243 CA PHE A 85 5.185 -1.378 -4.467 1.00 0.00 C ATOM 1244 C PHE A 85 4.336 -2.182 -5.447 1.00 0.00 C ATOM 1245 O PHE A 85 3.659 -1.619 -6.308 1.00 0.00 O ATOM 1246 CB PHE A 85 4.281 -0.526 -3.572 1.00 0.00 C ATOM 1247 CG PHE A 85 5.020 0.177 -2.469 1.00 0.00 C ATOM 1248 CD1 PHE A 85 5.713 -0.545 -1.512 1.00 0.00 C ATOM 1249 CD2 PHE A 85 5.021 1.560 -2.391 1.00 0.00 C ATOM 1250 CE1 PHE A 85 6.395 0.098 -0.496 1.00 0.00 C ATOM 1251 CE2 PHE A 85 5.701 2.210 -1.377 1.00 0.00 C ATOM 1252 CZ PHE A 85 6.388 1.478 -0.428 1.00 0.00 C ATOM 0 H PHE A 85 5.752 0.356 -5.501 1.00 0.00 H new ATOM 0 HA PHE A 85 5.749 -2.074 -3.846 1.00 0.00 H new ATOM 0 HB2 PHE A 85 3.770 0.215 -4.186 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.512 -1.163 -3.135 1.00 0.00 H new ATOM 0 HD1 PHE A 85 5.721 -1.624 -1.560 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.485 2.137 -3.130 1.00 0.00 H new ATOM 0 HE1 PHE A 85 6.932 -0.477 0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 85 5.695 3.289 -1.327 1.00 0.00 H new ATOM 0 HZ PHE A 85 6.919 1.983 0.365 1.00 0.00 H new ATOM 1262 N LEU A 86 4.378 -3.503 -5.310 1.00 0.00 N ATOM 1263 CA LEU A 86 3.614 -4.387 -6.183 1.00 0.00 C ATOM 1264 C LEU A 86 2.504 -5.092 -5.408 1.00 0.00 C ATOM 1265 O LEU A 86 2.770 -5.850 -4.474 1.00 0.00 O ATOM 1266 CB LEU A 86 4.537 -5.422 -6.828 1.00 0.00 C ATOM 1267 CG LEU A 86 3.857 -6.477 -7.702 1.00 0.00 C ATOM 1268 CD1 LEU A 86 3.593 -5.926 -9.095 1.00 0.00 C ATOM 1269 CD2 LEU A 86 4.707 -7.737 -7.776 1.00 0.00 C ATOM 0 H LEU A 86 4.933 -3.985 -4.603 1.00 0.00 H new ATOM 0 HA LEU A 86 3.157 -3.779 -6.964 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.272 -4.895 -7.436 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.085 -5.933 -6.037 1.00 0.00 H new ATOM 0 HG LEU A 86 2.900 -6.735 -7.249 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.109 -6.690 -9.703 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.944 -5.053 -9.024 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.537 -5.639 -9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.208 -8.477 -8.402 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.679 -7.495 -8.205 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.844 -8.143 -6.774 1.00 0.00 H new ATOM 1281 N LEU A 87 1.262 -4.839 -5.803 1.00 0.00 N ATOM 1282 CA LEU A 87 0.111 -5.451 -5.148 1.00 0.00 C ATOM 1283 C LEU A 87 -0.954 -5.839 -6.168 1.00 0.00 C ATOM 1284 O LEU A 87 -0.851 -5.501 -7.348 1.00 0.00 O ATOM 1285 CB LEU A 87 -0.482 -4.492 -4.114 1.00 0.00 C ATOM 1286 CG LEU A 87 0.501 -3.520 -3.459 1.00 0.00 C ATOM 1287 CD1 LEU A 87 0.730 -2.310 -4.350 1.00 0.00 C ATOM 1288 CD2 LEU A 87 -0.008 -3.089 -2.091 1.00 0.00 C ATOM 0 H LEU A 87 1.025 -4.214 -6.574 1.00 0.00 H new ATOM 0 HA LEU A 87 0.450 -6.355 -4.643 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.269 -3.912 -4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.955 -5.083 -3.330 1.00 0.00 H new ATOM 0 HG LEU A 87 1.454 -4.032 -3.326 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.432 -1.630 -3.867 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.139 -2.635 -5.307 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.217 -1.796 -4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 87 0.703 -2.398 -1.639 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.974 -2.595 -2.201 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -0.119 -3.965 -1.452 1.00 0.00 H new ATOM 1300 N VAL A 88 -1.979 -6.548 -5.706 1.00 0.00 N ATOM 1301 CA VAL A 88 -3.066 -6.979 -6.577 1.00 0.00 C ATOM 1302 C VAL A 88 -4.398 -6.392 -6.125 1.00 0.00 C ATOM 1303 O VAL A 88 -4.571 -6.046 -4.957 1.00 0.00 O ATOM 1304 CB VAL A 88 -3.180 -8.514 -6.614 1.00 0.00 C ATOM 1305 CG1 VAL A 88 -4.005 -8.960 -7.812 1.00 0.00 C ATOM 1306 CG2 VAL A 88 -1.799 -9.151 -6.640 1.00 0.00 C ATOM 0 H VAL A 88 -2.079 -6.836 -4.733 1.00 0.00 H new ATOM 0 HA VAL A 88 -2.833 -6.615 -7.578 1.00 0.00 H new ATOM 0 HB VAL A 88 -3.690 -8.844 -5.709 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -4.074 -10.048 -7.821 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -5.006 -8.533 -7.744 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -3.527 -8.619 -8.730 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.899 -10.236 -6.666 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -1.260 -8.815 -7.526 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.247 -8.859 -5.747 1.00 0.00 H new ATOM 1316 N ASP A 89 -5.337 -6.283 -7.059 1.00 0.00 N ATOM 1317 CA ASP A 89 -6.656 -5.738 -6.757 1.00 0.00 C ATOM 1318 C ASP A 89 -7.384 -6.612 -5.740 1.00 0.00 C ATOM 1319 O ASP A 89 -7.050 -7.782 -5.558 1.00 0.00 O ATOM 1320 CB ASP A 89 -7.487 -5.621 -8.035 1.00 0.00 C ATOM 1321 CG ASP A 89 -6.642 -5.280 -9.247 1.00 0.00 C ATOM 1322 OD1 ASP A 89 -6.015 -6.201 -9.810 1.00 0.00 O ATOM 1323 OD2 ASP A 89 -6.606 -4.092 -9.630 1.00 0.00 O ATOM 0 H ASP A 89 -5.209 -6.565 -8.031 1.00 0.00 H new ATOM 0 HA ASP A 89 -6.523 -4.745 -6.327 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -8.009 -6.561 -8.213 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.249 -4.854 -7.900 1.00 0.00 H new ATOM 1328 N LYS A 90 -8.381 -6.034 -5.078 1.00 0.00 N ATOM 1329 CA LYS A 90 -9.158 -6.758 -4.079 1.00 0.00 C ATOM 1330 C LYS A 90 -10.200 -7.653 -4.744 1.00 0.00 C ATOM 1331 O LYS A 90 -10.527 -8.723 -4.233 1.00 0.00 O ATOM 1332 CB LYS A 90 -9.846 -5.776 -3.128 1.00 0.00 C ATOM 1333 CG LYS A 90 -11.194 -6.261 -2.624 1.00 0.00 C ATOM 1334 CD LYS A 90 -11.049 -7.478 -1.726 1.00 0.00 C ATOM 1335 CE LYS A 90 -12.348 -8.266 -1.640 1.00 0.00 C ATOM 1336 NZ LYS A 90 -12.434 -9.310 -2.698 1.00 0.00 N ATOM 0 H LYS A 90 -8.670 -5.066 -5.216 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.474 -7.387 -3.509 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.193 -5.592 -2.275 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.980 -4.822 -3.638 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.688 -5.459 -2.075 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.833 -6.507 -3.472 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -10.257 -8.121 -2.109 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.748 -7.161 -0.728 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.424 -8.736 -0.659 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -13.193 -7.584 -1.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -13.421 -9.406 -3.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -11.839 -9.035 -3.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.102 -10.219 -2.317 1.00 0.00 H new ATOM 1350 N GLU A 91 -10.715 -7.207 -5.885 1.00 0.00 N ATOM 1351 CA GLU A 91 -11.718 -7.969 -6.619 1.00 0.00 C ATOM 1352 C GLU A 91 -11.105 -9.221 -7.240 1.00 0.00 C ATOM 1353 O GLU A 91 -11.648 -10.319 -7.118 1.00 0.00 O ATOM 1354 CB GLU A 91 -12.352 -7.103 -7.710 1.00 0.00 C ATOM 1355 CG GLU A 91 -13.510 -6.253 -7.216 1.00 0.00 C ATOM 1356 CD GLU A 91 -13.669 -4.968 -8.006 1.00 0.00 C ATOM 1357 OE1 GLU A 91 -12.702 -4.179 -8.056 1.00 0.00 O ATOM 1358 OE2 GLU A 91 -14.760 -4.752 -8.574 1.00 0.00 O ATOM 0 H GLU A 91 -10.454 -6.322 -6.321 1.00 0.00 H new ATOM 0 HA GLU A 91 -12.491 -8.276 -5.914 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -11.588 -6.451 -8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -12.703 -7.748 -8.516 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -14.432 -6.830 -7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -13.356 -6.012 -6.164 1.00 0.00 H new ATOM 1365 N THR A 92 -9.969 -9.046 -7.909 1.00 0.00 N ATOM 1366 CA THR A 92 -9.282 -10.160 -8.551 1.00 0.00 C ATOM 1367 C THR A 92 -8.910 -11.235 -7.537 1.00 0.00 C ATOM 1368 O THR A 92 -9.339 -12.384 -7.650 1.00 0.00 O ATOM 1369 CB THR A 92 -8.005 -9.690 -9.274 1.00 0.00 C ATOM 1370 OG1 THR A 92 -8.337 -8.712 -10.267 1.00 0.00 O ATOM 1371 CG2 THR A 92 -7.292 -10.863 -9.930 1.00 0.00 C ATOM 0 H THR A 92 -9.506 -8.144 -8.020 1.00 0.00 H new ATOM 0 HA THR A 92 -9.973 -10.578 -9.283 1.00 0.00 H new ATOM 0 HB THR A 92 -7.338 -9.246 -8.535 1.00 0.00 H new ATOM 0 HG1 THR A 92 -7.520 -8.417 -10.721 1.00 0.00 H new ATOM 0 HG21 THR A 92 -6.394 -10.507 -10.434 1.00 0.00 H new ATOM 0 HG22 THR A 92 -7.016 -11.593 -9.169 1.00 0.00 H new ATOM 0 HG23 THR A 92 -7.955 -11.331 -10.658 1.00 0.00 H new ATOM 1379 N ASP A 93 -8.111 -10.856 -6.545 1.00 0.00 N ATOM 1380 CA ASP A 93 -7.683 -11.789 -5.509 1.00 0.00 C ATOM 1381 C ASP A 93 -8.876 -12.284 -4.697 1.00 0.00 C ATOM 1382 O ASP A 93 -9.782 -11.516 -4.373 1.00 0.00 O ATOM 1383 CB ASP A 93 -6.662 -11.124 -4.585 1.00 0.00 C ATOM 1384 CG ASP A 93 -5.239 -11.289 -5.080 1.00 0.00 C ATOM 1385 OD1 ASP A 93 -5.059 -11.586 -6.280 1.00 0.00 O ATOM 1386 OD2 ASP A 93 -4.304 -11.121 -4.269 1.00 0.00 O ATOM 0 H ASP A 93 -7.747 -9.909 -6.437 1.00 0.00 H new ATOM 0 HA ASP A 93 -7.217 -12.646 -5.996 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.892 -10.062 -4.498 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -6.748 -11.552 -3.586 1.00 0.00 H new ATOM 1391 N LYS A 94 -8.871 -13.572 -4.373 1.00 0.00 N ATOM 1392 CA LYS A 94 -9.952 -14.172 -3.599 1.00 0.00 C ATOM 1393 C LYS A 94 -9.399 -14.996 -2.441 1.00 0.00 C ATOM 1394 O LYS A 94 -9.231 -16.210 -2.555 1.00 0.00 O ATOM 1395 CB LYS A 94 -10.822 -15.054 -4.498 1.00 0.00 C ATOM 1396 CG LYS A 94 -10.028 -15.860 -5.511 1.00 0.00 C ATOM 1397 CD LYS A 94 -10.819 -16.084 -6.788 1.00 0.00 C ATOM 1398 CE LYS A 94 -9.904 -16.387 -7.965 1.00 0.00 C ATOM 1399 NZ LYS A 94 -9.243 -17.714 -7.827 1.00 0.00 N ATOM 0 H LYS A 94 -8.130 -14.222 -4.635 1.00 0.00 H new ATOM 0 HA LYS A 94 -10.563 -13.367 -3.190 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.399 -15.737 -3.874 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.538 -14.425 -5.027 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -9.099 -15.339 -5.744 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -9.754 -16.822 -5.078 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -11.516 -16.910 -6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.415 -15.198 -7.008 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -10.481 -16.363 -8.889 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -9.144 -15.609 -8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.628 -17.883 -8.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -8.671 -17.728 -6.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -9.967 -18.459 -7.777 1.00 0.00 H new ATOM 1413 N ARG A 95 -9.120 -14.329 -1.326 1.00 0.00 N ATOM 1414 CA ARG A 95 -8.587 -15.000 -0.147 1.00 0.00 C ATOM 1415 C ARG A 95 -9.673 -15.192 0.907 1.00 0.00 C ATOM 1416 O ARG A 95 -10.409 -14.260 1.233 1.00 0.00 O ATOM 1417 CB ARG A 95 -7.426 -14.197 0.442 1.00 0.00 C ATOM 1418 CG ARG A 95 -6.972 -14.694 1.805 1.00 0.00 C ATOM 1419 CD ARG A 95 -5.953 -15.816 1.679 1.00 0.00 C ATOM 1420 NE ARG A 95 -5.568 -16.355 2.980 1.00 0.00 N ATOM 1421 CZ ARG A 95 -6.312 -17.214 3.669 1.00 0.00 C ATOM 1422 NH1 ARG A 95 -7.473 -17.630 3.182 1.00 0.00 N ATOM 1423 NH2 ARG A 95 -5.894 -17.660 4.846 1.00 0.00 N ATOM 0 H ARG A 95 -9.254 -13.324 -1.215 1.00 0.00 H new ATOM 0 HA ARG A 95 -8.223 -15.981 -0.452 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -6.583 -14.233 -0.248 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -7.724 -13.152 0.526 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -6.537 -13.868 2.368 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -7.835 -15.046 2.371 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -6.368 -16.615 1.064 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -5.067 -15.445 1.164 1.00 0.00 H new ATOM 0 HE ARG A 95 -4.680 -16.056 3.382 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -7.797 -17.291 2.276 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -8.042 -18.289 3.713 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -5.001 -17.344 5.223 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -6.466 -18.319 5.374 1.00 0.00 H new ATOM 1437 N HIS A 96 -9.768 -16.408 1.437 1.00 0.00 N ATOM 1438 CA HIS A 96 -10.765 -16.722 2.454 1.00 0.00 C ATOM 1439 C HIS A 96 -10.400 -16.080 3.789 1.00 0.00 C ATOM 1440 O HIS A 96 -9.776 -16.711 4.643 1.00 0.00 O ATOM 1441 CB HIS A 96 -10.893 -18.237 2.622 1.00 0.00 C ATOM 1442 CG HIS A 96 -11.592 -18.909 1.480 1.00 0.00 C ATOM 1443 ND1 HIS A 96 -10.989 -19.142 0.262 1.00 0.00 N ATOM 1444 CD2 HIS A 96 -12.849 -19.399 1.376 1.00 0.00 C ATOM 1445 CE1 HIS A 96 -11.846 -19.746 -0.542 1.00 0.00 C ATOM 1446 NE2 HIS A 96 -12.982 -19.914 0.110 1.00 0.00 N ATOM 0 H HIS A 96 -9.167 -17.191 1.179 1.00 0.00 H new ATOM 0 HA HIS A 96 -11.723 -16.318 2.126 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -9.898 -18.668 2.732 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -11.435 -18.448 3.544 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -13.607 -19.387 2.146 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -11.651 -20.051 -1.560 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -13.822 -20.355 -0.266 1.00 0.00 H new ATOM 1455 N VAL A 97 -10.792 -14.822 3.962 1.00 0.00 N ATOM 1456 CA VAL A 97 -10.507 -14.095 5.193 1.00 0.00 C ATOM 1457 C VAL A 97 -11.744 -14.008 6.080 1.00 0.00 C ATOM 1458 O VAL A 97 -12.872 -14.104 5.599 1.00 0.00 O ATOM 1459 CB VAL A 97 -9.999 -12.671 4.899 1.00 0.00 C ATOM 1460 CG1 VAL A 97 -9.622 -11.960 6.190 1.00 0.00 C ATOM 1461 CG2 VAL A 97 -8.818 -12.714 3.941 1.00 0.00 C ATOM 0 H VAL A 97 -11.308 -14.285 3.265 1.00 0.00 H new ATOM 0 HA VAL A 97 -9.728 -14.651 5.715 1.00 0.00 H new ATOM 0 HB VAL A 97 -10.803 -12.109 4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -9.265 -10.956 5.961 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -10.496 -11.896 6.839 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -8.834 -12.518 6.696 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.472 -11.699 3.744 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.009 -13.293 4.386 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -9.126 -13.180 3.005 1.00 0.00 H new ATOM 1471 N GLU A 98 -11.523 -13.826 7.378 1.00 0.00 N ATOM 1472 CA GLU A 98 -12.621 -13.726 8.333 1.00 0.00 C ATOM 1473 C GLU A 98 -12.196 -12.941 9.571 1.00 0.00 C ATOM 1474 O GLU A 98 -11.389 -13.414 10.370 1.00 0.00 O ATOM 1475 CB GLU A 98 -13.100 -15.121 8.739 1.00 0.00 C ATOM 1476 CG GLU A 98 -11.970 -16.111 8.969 1.00 0.00 C ATOM 1477 CD GLU A 98 -11.503 -16.138 10.411 1.00 0.00 C ATOM 1478 OE1 GLU A 98 -12.323 -15.848 11.307 1.00 0.00 O ATOM 1479 OE2 GLU A 98 -10.317 -16.451 10.644 1.00 0.00 O ATOM 0 H GLU A 98 -10.595 -13.745 7.792 1.00 0.00 H new ATOM 0 HA GLU A 98 -13.441 -13.194 7.851 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -13.693 -15.041 9.650 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -13.759 -15.509 7.963 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -12.301 -17.108 8.679 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.130 -15.854 8.324 1.00 0.00 H new ATOM 1486 N GLN A 99 -12.747 -11.741 9.720 1.00 0.00 N ATOM 1487 CA GLN A 99 -12.424 -10.890 10.859 1.00 0.00 C ATOM 1488 C GLN A 99 -12.187 -11.725 12.113 1.00 0.00 C ATOM 1489 O GLN A 99 -11.283 -11.442 12.899 1.00 0.00 O ATOM 1490 CB GLN A 99 -13.550 -9.885 11.107 1.00 0.00 C ATOM 1491 CG GLN A 99 -14.912 -10.532 11.298 1.00 0.00 C ATOM 1492 CD GLN A 99 -15.976 -9.539 11.725 1.00 0.00 C ATOM 1493 OE1 GLN A 99 -15.745 -8.704 12.600 1.00 0.00 O ATOM 1494 NE2 GLN A 99 -17.148 -9.626 11.109 1.00 0.00 N ATOM 0 H GLN A 99 -13.418 -11.336 9.067 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.507 -10.348 10.627 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -13.310 -9.294 11.991 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -13.600 -9.193 10.266 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -15.218 -11.008 10.366 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -14.834 -11.320 12.047 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -17.295 -10.334 10.390 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -17.902 -8.985 11.355 1.00 0.00 H new ATOM 1503 N LYS A 100 -13.006 -12.756 12.294 1.00 0.00 N ATOM 1504 CA LYS A 100 -12.886 -13.635 13.452 1.00 0.00 C ATOM 1505 C LYS A 100 -13.860 -14.804 13.350 1.00 0.00 C ATOM 1506 O LYS A 100 -14.892 -14.709 12.686 1.00 0.00 O ATOM 1507 CB LYS A 100 -13.145 -12.852 14.741 1.00 0.00 C ATOM 1508 CG LYS A 100 -12.573 -13.516 15.981 1.00 0.00 C ATOM 1509 CD LYS A 100 -12.253 -12.497 17.062 1.00 0.00 C ATOM 1510 CE LYS A 100 -13.480 -12.170 17.900 1.00 0.00 C ATOM 1511 NZ LYS A 100 -14.253 -11.031 17.330 1.00 0.00 N ATOM 0 H LYS A 100 -13.760 -13.003 11.653 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.871 -14.031 13.473 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -12.716 -11.855 14.643 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -14.220 -12.726 14.870 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -13.286 -14.245 16.366 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -11.668 -14.064 15.717 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -11.464 -12.884 17.706 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -11.871 -11.585 16.603 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -14.122 -13.049 17.963 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -13.171 -11.927 18.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -14.225 -10.228 17.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -13.834 -10.747 16.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -15.240 -11.322 17.180 1.00 0.00 H new ATOM 1525 N SER A 101 -13.526 -15.906 14.014 1.00 0.00 N ATOM 1526 CA SER A 101 -14.370 -17.095 13.997 1.00 0.00 C ATOM 1527 C SER A 101 -15.658 -16.857 14.778 1.00 0.00 C ATOM 1528 O SER A 101 -15.638 -16.705 15.999 1.00 0.00 O ATOM 1529 CB SER A 101 -13.617 -18.290 14.584 1.00 0.00 C ATOM 1530 OG SER A 101 -12.514 -18.648 13.769 1.00 0.00 O ATOM 0 H SER A 101 -12.676 -16.000 14.571 1.00 0.00 H new ATOM 0 HA SER A 101 -14.629 -17.312 12.961 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.268 -18.047 15.587 1.00 0.00 H new ATOM 0 HB3 SER A 101 -14.294 -19.139 14.679 1.00 0.00 H new ATOM 0 HG SER A 101 -12.048 -19.413 14.167 1.00 0.00 H new ATOM 1536 N GLY A 102 -16.780 -16.828 14.064 1.00 0.00 N ATOM 1537 CA GLY A 102 -18.063 -16.608 14.706 1.00 0.00 C ATOM 1538 C GLY A 102 -18.263 -17.494 15.920 1.00 0.00 C ATOM 1539 O GLY A 102 -17.799 -18.634 15.966 1.00 0.00 O ATOM 0 H GLY A 102 -16.823 -16.953 13.053 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -18.141 -15.563 15.006 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -18.862 -16.795 13.988 1.00 0.00 H new ATOM 1543 N PRO A 103 -18.967 -16.968 16.932 1.00 0.00 N ATOM 1544 CA PRO A 103 -19.242 -17.702 18.171 1.00 0.00 C ATOM 1545 C PRO A 103 -20.222 -18.851 17.959 1.00 0.00 C ATOM 1546 O PRO A 103 -21.366 -18.637 17.560 1.00 0.00 O ATOM 1547 CB PRO A 103 -19.856 -16.638 19.085 1.00 0.00 C ATOM 1548 CG PRO A 103 -20.443 -15.633 18.155 1.00 0.00 C ATOM 1549 CD PRO A 103 -19.549 -15.615 16.946 1.00 0.00 C ATOM 0 HA PRO A 103 -18.343 -18.166 18.577 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -20.618 -17.067 19.736 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -19.102 -16.187 19.730 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -21.463 -15.903 17.882 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -20.488 -14.649 18.622 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -20.110 -15.409 16.034 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -18.779 -14.847 17.027 1.00 0.00 H new ATOM 1557 N SER A 104 -19.764 -20.069 18.228 1.00 0.00 N ATOM 1558 CA SER A 104 -20.600 -21.253 18.063 1.00 0.00 C ATOM 1559 C SER A 104 -21.474 -21.477 19.293 1.00 0.00 C ATOM 1560 O SER A 104 -21.305 -22.458 20.017 1.00 0.00 O ATOM 1561 CB SER A 104 -19.730 -22.486 17.810 1.00 0.00 C ATOM 1562 OG SER A 104 -19.075 -22.900 18.996 1.00 0.00 O ATOM 0 H SER A 104 -18.819 -20.262 18.561 1.00 0.00 H new ATOM 0 HA SER A 104 -21.249 -21.092 17.202 1.00 0.00 H new ATOM 0 HB2 SER A 104 -20.348 -23.299 17.429 1.00 0.00 H new ATOM 0 HB3 SER A 104 -18.990 -22.261 17.042 1.00 0.00 H new ATOM 0 HG SER A 104 -19.742 -23.184 19.656 1.00 0.00 H new ATOM 1568 N SER A 105 -22.408 -20.560 19.523 1.00 0.00 N ATOM 1569 CA SER A 105 -23.306 -20.654 20.668 1.00 0.00 C ATOM 1570 C SER A 105 -22.571 -21.187 21.893 1.00 0.00 C ATOM 1571 O SER A 105 -23.057 -22.084 22.582 1.00 0.00 O ATOM 1572 CB SER A 105 -24.494 -21.560 20.337 1.00 0.00 C ATOM 1573 OG SER A 105 -25.159 -21.122 19.165 1.00 0.00 O ATOM 0 H SER A 105 -22.563 -19.743 18.932 1.00 0.00 H new ATOM 0 HA SER A 105 -23.673 -19.653 20.894 1.00 0.00 H new ATOM 0 HB2 SER A 105 -24.147 -22.584 20.201 1.00 0.00 H new ATOM 0 HB3 SER A 105 -25.193 -21.569 21.174 1.00 0.00 H new ATOM 0 HG SER A 105 -25.913 -21.718 18.974 1.00 0.00 H new ATOM 1579 N GLY A 106 -21.394 -20.628 22.160 1.00 0.00 N ATOM 1580 CA GLY A 106 -20.610 -21.060 23.302 1.00 0.00 C ATOM 1581 C GLY A 106 -19.386 -21.857 22.896 1.00 0.00 C ATOM 1582 O GLY A 106 -18.356 -21.811 23.569 1.00 0.00 O ATOM 0 H GLY A 106 -20.970 -19.884 21.606 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -20.298 -20.187 23.876 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -21.234 -21.667 23.959 1.00 0.00 H new TER 1586 GLY A 106