USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1145 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 Single : A 4 SER OG : rot 180:sc=-0.00493 USER MOD Single : A 6 SER OG : rot 180:sc= 0.0363 USER MOD Single : A 9 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0228) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.015 X(o=-0.015,f=-0.29) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 26 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.481) USER MOD Single : A 27 GLN : amide:sc= -0.173 X(o=-0.17,f=-0.0087) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 24:sc= 0.643 USER MOD Single : A 37 GLN :FLIP amide:sc= -0.232 F(o=-0.81,f=-0.23) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= 0.605 K(o=0.6,f=-0.0031) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -65:sc= 0.421 USER MOD Single : A 68 MET CE :methyl 175:sc= 0 (180deg=-0.019) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -110:sc= -0.74 (180deg=-1.3) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -82:sc= 0.294 USER MOD Single : A 80 GLN : amide:sc= 0.926 K(o=0.93,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl -177:sc= -0.583 (180deg=-0.593) USER MOD Single : A 90 LYS NZ :NH3+ -168:sc= -0.0115 (180deg=-0.161) USER MOD Single : A 91 HIS : no HE2:sc= -0.139 X(o=-0.14,f=-0.14) USER MOD Single : A 104 SER OG : rot 85:sc= 0.962 USER MOD Single : A 106 HIS : no HD1:sc= -0.466 X(o=-0.47,f=-0.0053) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.136 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 178:sc= -0.766 (180deg=-0.824) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HE2:sc= 0.654 K(o=0.65,f=-2.8!) USER MOD Single : A 132 HIS : no HE2:sc= -0.3 K(o=-0.3,f=-0.82) USER MOD Single : A 134 HIS : no HD1:sc= -0.0271 X(o=-0.027,f=-0.031) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 33.899 -20.792 -17.098 1.00 0.00 N ATOM 2 CA PRO A 1 33.547 -21.958 -16.270 1.00 0.00 C ATOM 3 C PRO A 1 32.057 -22.287 -16.407 1.00 0.00 C ATOM 4 O PRO A 1 31.221 -21.423 -16.149 1.00 0.00 O ATOM 5 CB PRO A 1 33.914 -21.582 -14.826 1.00 0.00 C ATOM 6 CG PRO A 1 33.840 -20.048 -14.811 1.00 0.00 C ATOM 7 CD PRO A 1 34.269 -19.664 -16.229 1.00 0.00 C ATOM 0 H2 PRO A 1 33.110 -20.533 -17.691 1.00 0.00 H new ATOM 0 H3 PRO A 1 34.675 -21.025 -17.718 1.00 0.00 H new ATOM 0 HA PRO A 1 34.085 -22.852 -16.584 1.00 0.00 H new ATOM 0 HB2 PRO A 1 33.220 -22.022 -14.110 1.00 0.00 H new ATOM 0 HB3 PRO A 1 34.911 -21.936 -14.562 1.00 0.00 H new ATOM 0 HG2 PRO A 1 32.834 -19.696 -14.585 1.00 0.00 H new ATOM 0 HG3 PRO A 1 34.504 -19.620 -14.060 1.00 0.00 H new ATOM 0 HD2 PRO A 1 33.772 -18.748 -16.550 1.00 0.00 H new ATOM 0 HD3 PRO A 1 35.342 -19.477 -16.272 1.00 0.00 H new ATOM 15 N ALA A 2 31.732 -23.493 -16.884 1.00 0.00 N ATOM 16 CA ALA A 2 30.352 -23.940 -17.041 1.00 0.00 C ATOM 17 C ALA A 2 29.827 -24.461 -15.693 1.00 0.00 C ATOM 18 O ALA A 2 30.556 -24.471 -14.699 1.00 0.00 O ATOM 19 CB ALA A 2 30.294 -25.029 -18.122 1.00 0.00 C ATOM 0 H ALA A 2 32.423 -24.185 -17.172 1.00 0.00 H new ATOM 0 HA ALA A 2 29.718 -23.110 -17.355 1.00 0.00 H new ATOM 0 HB1 ALA A 2 29.265 -25.367 -18.243 1.00 0.00 H new ATOM 0 HB2 ALA A 2 30.657 -24.624 -19.067 1.00 0.00 H new ATOM 0 HB3 ALA A 2 30.919 -25.871 -17.824 1.00 0.00 H new ATOM 25 N ALA A 3 28.558 -24.863 -15.661 1.00 0.00 N ATOM 26 CA ALA A 3 27.854 -25.407 -14.508 1.00 0.00 C ATOM 27 C ALA A 3 26.844 -26.437 -15.028 1.00 0.00 C ATOM 28 O ALA A 3 26.667 -26.573 -16.241 1.00 0.00 O ATOM 29 CB ALA A 3 27.156 -24.276 -13.740 1.00 0.00 C ATOM 0 H ALA A 3 27.962 -24.814 -16.487 1.00 0.00 H new ATOM 0 HA ALA A 3 28.545 -25.888 -13.816 1.00 0.00 H new ATOM 0 HB1 ALA A 3 26.632 -24.690 -12.879 1.00 0.00 H new ATOM 0 HB2 ALA A 3 27.899 -23.555 -13.400 1.00 0.00 H new ATOM 0 HB3 ALA A 3 26.441 -23.778 -14.395 1.00 0.00 H new ATOM 35 N SER A 4 26.163 -27.151 -14.132 1.00 0.00 N ATOM 36 CA SER A 4 25.172 -28.161 -14.493 1.00 0.00 C ATOM 37 C SER A 4 24.002 -28.093 -13.500 1.00 0.00 C ATOM 38 O SER A 4 23.955 -28.884 -12.559 1.00 0.00 O ATOM 39 CB SER A 4 25.845 -29.539 -14.556 1.00 0.00 C ATOM 40 OG SER A 4 26.981 -29.491 -15.406 1.00 0.00 O ATOM 0 H SER A 4 26.286 -27.042 -13.125 1.00 0.00 H new ATOM 0 HA SER A 4 24.759 -27.973 -15.484 1.00 0.00 H new ATOM 0 HB2 SER A 4 26.143 -29.852 -13.556 1.00 0.00 H new ATOM 0 HB3 SER A 4 25.137 -30.281 -14.925 1.00 0.00 H new ATOM 0 HG SER A 4 27.403 -30.375 -15.438 1.00 0.00 H new ATOM 46 N PRO A 5 23.081 -27.124 -13.657 1.00 0.00 N ATOM 47 CA PRO A 5 21.939 -26.974 -12.765 1.00 0.00 C ATOM 48 C PRO A 5 20.995 -28.171 -12.921 1.00 0.00 C ATOM 49 O PRO A 5 20.481 -28.415 -14.015 1.00 0.00 O ATOM 50 CB PRO A 5 21.286 -25.645 -13.163 1.00 0.00 C ATOM 51 CG PRO A 5 21.665 -25.467 -14.631 1.00 0.00 C ATOM 52 CD PRO A 5 23.037 -26.130 -14.723 1.00 0.00 C ATOM 0 HA PRO A 5 22.218 -26.955 -11.712 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.204 -25.678 -13.032 1.00 0.00 H new ATOM 0 HB3 PRO A 5 21.656 -24.821 -12.553 1.00 0.00 H new ATOM 0 HG2 PRO A 5 20.943 -25.944 -15.293 1.00 0.00 H new ATOM 0 HG3 PRO A 5 21.707 -24.414 -14.911 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.179 -26.598 -15.697 1.00 0.00 H new ATOM 0 HD3 PRO A 5 23.833 -25.395 -14.603 1.00 0.00 H new ATOM 60 N SER A 6 20.741 -28.910 -11.840 1.00 0.00 N ATOM 61 CA SER A 6 19.867 -30.081 -11.836 1.00 0.00 C ATOM 62 C SER A 6 18.456 -29.717 -12.323 1.00 0.00 C ATOM 63 O SER A 6 17.968 -28.615 -12.042 1.00 0.00 O ATOM 64 CB SER A 6 19.820 -30.656 -10.413 1.00 0.00 C ATOM 65 OG SER A 6 21.103 -30.635 -9.804 1.00 0.00 O ATOM 0 H SER A 6 21.145 -28.706 -10.926 1.00 0.00 H new ATOM 0 HA SER A 6 20.263 -30.830 -12.521 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.119 -30.080 -9.809 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.447 -31.680 -10.445 1.00 0.00 H new ATOM 0 HG SER A 6 21.042 -31.005 -8.899 1.00 0.00 H new ATOM 71 N ALA A 7 17.802 -30.620 -13.057 1.00 0.00 N ATOM 72 CA ALA A 7 16.458 -30.415 -13.578 1.00 0.00 C ATOM 73 C ALA A 7 15.455 -30.733 -12.470 1.00 0.00 C ATOM 74 O ALA A 7 15.188 -31.907 -12.204 1.00 0.00 O ATOM 75 CB ALA A 7 16.236 -31.302 -14.808 1.00 0.00 C ATOM 0 H ALA A 7 18.201 -31.525 -13.307 1.00 0.00 H new ATOM 0 HA ALA A 7 16.322 -29.380 -13.891 1.00 0.00 H new ATOM 0 HB1 ALA A 7 15.229 -31.144 -15.193 1.00 0.00 H new ATOM 0 HB2 ALA A 7 16.963 -31.045 -15.578 1.00 0.00 H new ATOM 0 HB3 ALA A 7 16.358 -32.349 -14.529 1.00 0.00 H new ATOM 81 N LEU A 8 14.895 -29.711 -11.818 1.00 0.00 N ATOM 82 CA LEU A 8 13.932 -29.870 -10.727 1.00 0.00 C ATOM 83 C LEU A 8 12.723 -28.972 -10.970 1.00 0.00 C ATOM 84 O LEU A 8 12.871 -27.848 -11.465 1.00 0.00 O ATOM 85 CB LEU A 8 14.576 -29.490 -9.380 1.00 0.00 C ATOM 86 CG LEU A 8 15.934 -30.151 -9.075 1.00 0.00 C ATOM 87 CD1 LEU A 8 16.586 -29.419 -7.909 1.00 0.00 C ATOM 88 CD2 LEU A 8 15.802 -31.634 -8.728 1.00 0.00 C ATOM 0 H LEU A 8 15.101 -28.736 -12.037 1.00 0.00 H new ATOM 0 HA LEU A 8 13.619 -30.913 -10.694 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.706 -28.408 -9.353 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.881 -29.747 -8.581 1.00 0.00 H new ATOM 0 HG LEU A 8 16.545 -30.082 -9.975 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.549 -29.878 -7.684 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.736 -28.373 -8.175 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.940 -29.482 -7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.789 -32.049 -8.522 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.170 -31.747 -7.847 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.353 -32.165 -9.567 1.00 0.00 H new ATOM 100 N LYS A 9 11.535 -29.437 -10.580 1.00 0.00 N ATOM 101 CA LYS A 9 10.264 -28.728 -10.719 1.00 0.00 C ATOM 102 C LYS A 9 9.431 -28.865 -9.435 1.00 0.00 C ATOM 103 O LYS A 9 8.223 -29.110 -9.493 1.00 0.00 O ATOM 104 CB LYS A 9 9.520 -29.207 -11.985 1.00 0.00 C ATOM 105 CG LYS A 9 10.093 -28.633 -13.294 1.00 0.00 C ATOM 106 CD LYS A 9 11.091 -29.529 -14.047 1.00 0.00 C ATOM 107 CE LYS A 9 10.423 -30.746 -14.696 1.00 0.00 C ATOM 108 NZ LYS A 9 9.539 -30.404 -15.834 1.00 0.00 N ATOM 0 H LYS A 9 11.429 -30.352 -10.142 1.00 0.00 H new ATOM 0 HA LYS A 9 10.450 -27.662 -10.853 1.00 0.00 H new ATOM 0 HB2 LYS A 9 9.559 -30.295 -12.028 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.469 -28.928 -11.906 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.262 -28.408 -13.963 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.585 -27.687 -13.067 1.00 0.00 H new ATOM 0 HD2 LYS A 9 11.591 -28.941 -14.817 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.861 -29.869 -13.355 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.196 -31.432 -15.042 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.841 -31.275 -13.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.189 -31.278 -16.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.733 -29.843 -15.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.073 -29.851 -16.535 1.00 0.00 H new ATOM 122 N GLY A 10 10.053 -28.727 -8.263 1.00 0.00 N ATOM 123 CA GLY A 10 9.344 -28.837 -6.997 1.00 0.00 C ATOM 124 C GLY A 10 10.248 -28.494 -5.828 1.00 0.00 C ATOM 125 O GLY A 10 11.037 -29.343 -5.417 1.00 0.00 O ATOM 0 H GLY A 10 11.051 -28.538 -8.169 1.00 0.00 H new ATOM 0 HA2 GLY A 10 8.482 -28.170 -7.001 1.00 0.00 H new ATOM 0 HA3 GLY A 10 8.962 -29.851 -6.879 1.00 0.00 H new ATOM 129 N VAL A 11 10.183 -27.265 -5.318 1.00 0.00 N ATOM 130 CA VAL A 11 10.988 -26.814 -4.186 1.00 0.00 C ATOM 131 C VAL A 11 10.293 -25.612 -3.523 1.00 0.00 C ATOM 132 O VAL A 11 9.595 -24.846 -4.191 1.00 0.00 O ATOM 133 CB VAL A 11 12.427 -26.529 -4.679 1.00 0.00 C ATOM 134 CG1 VAL A 11 12.471 -25.594 -5.896 1.00 0.00 C ATOM 135 CG2 VAL A 11 13.340 -26.019 -3.559 1.00 0.00 C ATOM 0 H VAL A 11 9.561 -26.545 -5.685 1.00 0.00 H new ATOM 0 HA VAL A 11 11.073 -27.579 -3.414 1.00 0.00 H new ATOM 0 HB VAL A 11 12.816 -27.493 -5.006 1.00 0.00 H new ATOM 0 HG11 VAL A 11 13.507 -25.433 -6.194 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.922 -26.046 -6.722 1.00 0.00 H new ATOM 0 HG13 VAL A 11 12.015 -24.638 -5.637 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.337 -25.835 -3.958 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.935 -25.092 -3.153 1.00 0.00 H new ATOM 0 HG23 VAL A 11 13.398 -26.767 -2.768 1.00 0.00 H new ATOM 145 N SER A 12 10.487 -25.418 -2.216 1.00 0.00 N ATOM 146 CA SER A 12 9.915 -24.342 -1.398 1.00 0.00 C ATOM 147 C SER A 12 10.712 -23.031 -1.572 1.00 0.00 C ATOM 148 O SER A 12 11.217 -22.445 -0.617 1.00 0.00 O ATOM 149 CB SER A 12 9.921 -24.818 0.061 1.00 0.00 C ATOM 150 OG SER A 12 9.492 -26.164 0.192 1.00 0.00 O ATOM 0 H SER A 12 11.080 -26.041 -1.668 1.00 0.00 H new ATOM 0 HA SER A 12 8.894 -24.124 -1.713 1.00 0.00 H new ATOM 0 HB2 SER A 12 10.927 -24.719 0.469 1.00 0.00 H new ATOM 0 HB3 SER A 12 9.272 -24.173 0.653 1.00 0.00 H new ATOM 0 HG SER A 12 9.514 -26.424 1.137 1.00 0.00 H new ATOM 156 N GLN A 13 10.856 -22.585 -2.812 1.00 0.00 N ATOM 157 CA GLN A 13 11.605 -21.393 -3.214 1.00 0.00 C ATOM 158 C GLN A 13 10.978 -20.077 -2.767 1.00 0.00 C ATOM 159 O GLN A 13 11.632 -19.308 -2.056 1.00 0.00 O ATOM 160 CB GLN A 13 11.878 -21.432 -4.730 1.00 0.00 C ATOM 161 CG GLN A 13 13.196 -22.182 -4.966 1.00 0.00 C ATOM 162 CD GLN A 13 13.561 -22.398 -6.430 1.00 0.00 C ATOM 163 OE1 GLN A 13 12.795 -22.156 -7.358 1.00 0.00 O ATOM 164 NE2 GLN A 13 14.768 -22.858 -6.691 1.00 0.00 N ATOM 0 H GLN A 13 10.435 -23.065 -3.607 1.00 0.00 H new ATOM 0 HA GLN A 13 12.556 -21.423 -2.683 1.00 0.00 H new ATOM 0 HB2 GLN A 13 11.060 -21.930 -5.250 1.00 0.00 H new ATOM 0 HB3 GLN A 13 11.941 -20.420 -5.130 1.00 0.00 H new ATOM 0 HG2 GLN A 13 14.002 -21.629 -4.484 1.00 0.00 H new ATOM 0 HG3 GLN A 13 13.137 -23.153 -4.475 1.00 0.00 H new ATOM 0 HE21 GLN A 13 15.412 -23.062 -5.927 1.00 0.00 H new ATOM 0 HE22 GLN A 13 15.058 -23.010 -7.657 1.00 0.00 H new ATOM 173 N ALA A 14 9.734 -19.787 -3.152 1.00 0.00 N ATOM 174 CA ALA A 14 9.031 -18.555 -2.777 1.00 0.00 C ATOM 175 C ALA A 14 8.816 -18.440 -1.262 1.00 0.00 C ATOM 176 O ALA A 14 8.324 -17.435 -0.759 1.00 0.00 O ATOM 177 CB ALA A 14 7.709 -18.452 -3.536 1.00 0.00 C ATOM 0 H ALA A 14 9.178 -20.408 -3.740 1.00 0.00 H new ATOM 0 HA ALA A 14 9.665 -17.715 -3.060 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.196 -17.534 -3.250 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.905 -18.439 -4.608 1.00 0.00 H new ATOM 0 HB3 ALA A 14 7.082 -19.309 -3.292 1.00 0.00 H new ATOM 183 N LEU A 15 9.105 -19.504 -0.523 1.00 0.00 N ATOM 184 CA LEU A 15 8.992 -19.578 0.915 1.00 0.00 C ATOM 185 C LEU A 15 10.322 -19.151 1.524 1.00 0.00 C ATOM 186 O LEU A 15 10.406 -18.170 2.263 1.00 0.00 O ATOM 187 CB LEU A 15 8.680 -21.034 1.253 1.00 0.00 C ATOM 188 CG LEU A 15 8.527 -21.328 2.745 1.00 0.00 C ATOM 189 CD1 LEU A 15 7.303 -20.603 3.311 1.00 0.00 C ATOM 190 CD2 LEU A 15 8.430 -22.852 2.835 1.00 0.00 C ATOM 0 H LEU A 15 9.439 -20.375 -0.936 1.00 0.00 H new ATOM 0 HA LEU A 15 8.211 -18.927 1.307 1.00 0.00 H new ATOM 0 HB2 LEU A 15 7.760 -21.321 0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.475 -21.663 0.853 1.00 0.00 H new ATOM 0 HG LEU A 15 9.362 -20.966 3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.209 -20.823 4.374 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.420 -19.528 3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.407 -20.941 2.790 1.00 0.00 H new ATOM 0 HD21 LEU A 15 8.318 -23.148 3.878 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.567 -23.196 2.265 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.336 -23.299 2.426 1.00 0.00 H new ATOM 202 N LEU A 16 11.380 -19.890 1.179 1.00 0.00 N ATOM 203 CA LEU A 16 12.731 -19.667 1.662 1.00 0.00 C ATOM 204 C LEU A 16 13.270 -18.286 1.319 1.00 0.00 C ATOM 205 O LEU A 16 14.156 -17.819 2.037 1.00 0.00 O ATOM 206 CB LEU A 16 13.658 -20.773 1.126 1.00 0.00 C ATOM 207 CG LEU A 16 13.880 -21.888 2.163 1.00 0.00 C ATOM 208 CD1 LEU A 16 12.601 -22.649 2.529 1.00 0.00 C ATOM 209 CD2 LEU A 16 14.912 -22.884 1.639 1.00 0.00 C ATOM 0 H LEU A 16 11.310 -20.680 0.538 1.00 0.00 H new ATOM 0 HA LEU A 16 12.700 -19.710 2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 16 13.228 -21.200 0.220 1.00 0.00 H new ATOM 0 HB3 LEU A 16 14.618 -20.339 0.848 1.00 0.00 H new ATOM 0 HG LEU A 16 14.233 -21.394 3.069 1.00 0.00 H new ATOM 0 HD11 LEU A 16 12.834 -23.419 3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 16 11.872 -21.955 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.186 -23.114 1.635 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.065 -23.671 2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 16 14.553 -23.324 0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 16 15.855 -22.369 1.457 1.00 0.00 H new ATOM 221 N GLU A 17 12.742 -17.622 0.287 1.00 0.00 N ATOM 222 CA GLU A 17 13.183 -16.294 -0.132 1.00 0.00 C ATOM 223 C GLU A 17 13.037 -15.278 1.009 1.00 0.00 C ATOM 224 O GLU A 17 13.873 -14.387 1.165 1.00 0.00 O ATOM 225 CB GLU A 17 12.440 -15.891 -1.424 1.00 0.00 C ATOM 226 CG GLU A 17 11.003 -15.357 -1.277 1.00 0.00 C ATOM 227 CD GLU A 17 10.868 -13.830 -1.130 1.00 0.00 C ATOM 228 OE1 GLU A 17 11.884 -13.100 -1.039 1.00 0.00 O ATOM 229 OE2 GLU A 17 9.709 -13.348 -1.133 1.00 0.00 O ATOM 0 H GLU A 17 11.987 -17.999 -0.286 1.00 0.00 H new ATOM 0 HA GLU A 17 14.247 -16.311 -0.366 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.033 -15.129 -1.930 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.411 -16.760 -2.081 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.428 -15.672 -2.148 1.00 0.00 H new ATOM 0 HG3 GLU A 17 10.547 -15.829 -0.406 1.00 0.00 H new ATOM 236 N ARG A 18 12.002 -15.433 1.838 1.00 0.00 N ATOM 237 CA ARG A 18 11.732 -14.550 2.965 1.00 0.00 C ATOM 238 C ARG A 18 12.661 -14.838 4.131 1.00 0.00 C ATOM 239 O ARG A 18 13.156 -13.905 4.764 1.00 0.00 O ATOM 240 CB ARG A 18 10.291 -14.772 3.431 1.00 0.00 C ATOM 241 CG ARG A 18 9.284 -14.264 2.396 1.00 0.00 C ATOM 242 CD ARG A 18 7.857 -14.624 2.794 1.00 0.00 C ATOM 243 NE ARG A 18 7.472 -14.020 4.077 1.00 0.00 N ATOM 244 CZ ARG A 18 6.324 -14.221 4.721 1.00 0.00 C ATOM 245 NH1 ARG A 18 5.315 -14.870 4.136 1.00 0.00 N ATOM 246 NH2 ARG A 18 6.186 -13.786 5.966 1.00 0.00 N ATOM 0 H ARG A 18 11.322 -16.187 1.740 1.00 0.00 H new ATOM 0 HA ARG A 18 11.890 -13.522 2.638 1.00 0.00 H new ATOM 0 HB2 ARG A 18 10.125 -15.834 3.611 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.131 -14.259 4.379 1.00 0.00 H new ATOM 0 HG2 ARG A 18 9.375 -13.182 2.296 1.00 0.00 H new ATOM 0 HG3 ARG A 18 9.512 -14.694 1.421 1.00 0.00 H new ATOM 0 HD2 ARG A 18 7.169 -14.291 2.016 1.00 0.00 H new ATOM 0 HD3 ARG A 18 7.762 -15.708 2.861 1.00 0.00 H new ATOM 0 HE ARG A 18 8.145 -13.390 4.514 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.418 -15.219 3.183 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.441 -15.017 4.642 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.957 -13.301 6.425 1.00 0.00 H new ATOM 0 HH22 ARG A 18 5.309 -13.937 6.465 1.00 0.00 H new ATOM 260 N ILE A 19 12.868 -16.123 4.412 1.00 0.00 N ATOM 261 CA ILE A 19 13.703 -16.625 5.492 1.00 0.00 C ATOM 262 C ILE A 19 15.118 -16.077 5.312 1.00 0.00 C ATOM 263 O ILE A 19 15.585 -15.313 6.155 1.00 0.00 O ATOM 264 CB ILE A 19 13.628 -18.173 5.560 1.00 0.00 C ATOM 265 CG1 ILE A 19 12.156 -18.654 5.593 1.00 0.00 C ATOM 266 CG2 ILE A 19 14.391 -18.674 6.796 1.00 0.00 C ATOM 267 CD1 ILE A 19 11.989 -20.173 5.663 1.00 0.00 C ATOM 0 H ILE A 19 12.439 -16.871 3.868 1.00 0.00 H new ATOM 0 HA ILE A 19 13.343 -16.276 6.460 1.00 0.00 H new ATOM 0 HB ILE A 19 14.092 -18.587 4.665 1.00 0.00 H new ATOM 0 HG12 ILE A 19 11.659 -18.206 6.454 1.00 0.00 H new ATOM 0 HG13 ILE A 19 11.646 -18.285 4.703 1.00 0.00 H new ATOM 0 HG21 ILE A 19 14.337 -19.762 6.841 1.00 0.00 H new ATOM 0 HG22 ILE A 19 15.434 -18.365 6.729 1.00 0.00 H new ATOM 0 HG23 ILE A 19 13.944 -18.251 7.696 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.928 -20.422 5.682 1.00 0.00 H new ATOM 0 HD12 ILE A 19 12.453 -20.631 4.789 1.00 0.00 H new ATOM 0 HD13 ILE A 19 12.467 -20.550 6.567 1.00 0.00 H new ATOM 279 N ARG A 20 15.778 -16.406 4.195 1.00 0.00 N ATOM 280 CA ARG A 20 17.138 -15.936 3.932 1.00 0.00 C ATOM 281 C ARG A 20 17.234 -14.418 3.974 1.00 0.00 C ATOM 282 O ARG A 20 18.220 -13.906 4.493 1.00 0.00 O ATOM 283 CB ARG A 20 17.691 -16.484 2.609 1.00 0.00 C ATOM 284 CG ARG A 20 16.801 -16.188 1.389 1.00 0.00 C ATOM 285 CD ARG A 20 17.553 -15.507 0.254 1.00 0.00 C ATOM 286 NE ARG A 20 18.402 -16.476 -0.456 1.00 0.00 N ATOM 287 CZ ARG A 20 18.882 -16.350 -1.698 1.00 0.00 C ATOM 288 NH1 ARG A 20 18.720 -15.232 -2.396 1.00 0.00 N ATOM 289 NH2 ARG A 20 19.513 -17.372 -2.262 1.00 0.00 N ATOM 0 H ARG A 20 15.389 -16.997 3.460 1.00 0.00 H new ATOM 0 HA ARG A 20 17.760 -16.328 4.736 1.00 0.00 H new ATOM 0 HB2 ARG A 20 18.680 -16.059 2.436 1.00 0.00 H new ATOM 0 HB3 ARG A 20 17.819 -17.563 2.699 1.00 0.00 H new ATOM 0 HG2 ARG A 20 16.372 -17.121 1.024 1.00 0.00 H new ATOM 0 HG3 ARG A 20 15.970 -15.554 1.698 1.00 0.00 H new ATOM 0 HD2 ARG A 20 16.844 -15.057 -0.441 1.00 0.00 H new ATOM 0 HD3 ARG A 20 18.167 -14.698 0.650 1.00 0.00 H new ATOM 0 HE ARG A 20 18.649 -17.328 0.048 1.00 0.00 H new ATOM 0 HH11 ARG A 20 18.219 -14.443 -1.987 1.00 0.00 H new ATOM 0 HH12 ARG A 20 19.096 -15.162 -3.342 1.00 0.00 H new ATOM 0 HH21 ARG A 20 19.629 -18.246 -1.749 1.00 0.00 H new ATOM 0 HH22 ARG A 20 19.882 -17.284 -3.209 1.00 0.00 H new ATOM 303 N ALA A 21 16.223 -13.692 3.481 1.00 0.00 N ATOM 304 CA ALA A 21 16.250 -12.238 3.485 1.00 0.00 C ATOM 305 C ALA A 21 16.476 -11.695 4.898 1.00 0.00 C ATOM 306 O ALA A 21 17.210 -10.729 5.069 1.00 0.00 O ATOM 307 CB ALA A 21 14.978 -11.673 2.850 1.00 0.00 C ATOM 0 H ALA A 21 15.379 -14.095 3.075 1.00 0.00 H new ATOM 0 HA ALA A 21 17.093 -11.907 2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.018 -10.584 2.863 1.00 0.00 H new ATOM 0 HB2 ALA A 21 14.900 -12.021 1.820 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.109 -12.011 3.414 1.00 0.00 H new ATOM 313 N LYS A 22 15.898 -12.322 5.926 1.00 0.00 N ATOM 314 CA LYS A 22 16.090 -11.842 7.301 1.00 0.00 C ATOM 315 C LYS A 22 17.567 -11.880 7.695 1.00 0.00 C ATOM 316 O LYS A 22 18.035 -10.993 8.411 1.00 0.00 O ATOM 317 CB LYS A 22 15.194 -12.576 8.288 1.00 0.00 C ATOM 318 CG LYS A 22 13.779 -11.989 8.194 1.00 0.00 C ATOM 319 CD LYS A 22 12.734 -13.082 8.326 1.00 0.00 C ATOM 320 CE LYS A 22 11.336 -12.524 8.621 1.00 0.00 C ATOM 321 NZ LYS A 22 10.850 -11.554 7.616 1.00 0.00 N ATOM 0 H LYS A 22 15.304 -13.147 5.839 1.00 0.00 H new ATOM 0 HA LYS A 22 15.781 -10.797 7.338 1.00 0.00 H new ATOM 0 HB2 LYS A 22 15.177 -13.642 8.063 1.00 0.00 H new ATOM 0 HB3 LYS A 22 15.581 -12.470 9.301 1.00 0.00 H new ATOM 0 HG2 LYS A 22 13.636 -11.246 8.978 1.00 0.00 H new ATOM 0 HG3 LYS A 22 13.656 -11.475 7.241 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.703 -13.664 7.405 1.00 0.00 H new ATOM 0 HD3 LYS A 22 13.025 -13.765 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.631 -13.353 8.681 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.347 -12.043 9.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 9.901 -11.223 7.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 11.500 -10.744 7.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 10.806 -12.013 6.684 1.00 0.00 H new ATOM 335 N GLU A 23 18.303 -12.894 7.238 1.00 0.00 N ATOM 336 CA GLU A 23 19.728 -13.036 7.509 1.00 0.00 C ATOM 337 C GLU A 23 20.493 -12.023 6.641 1.00 0.00 C ATOM 338 O GLU A 23 21.505 -11.466 7.073 1.00 0.00 O ATOM 339 CB GLU A 23 20.208 -14.464 7.194 1.00 0.00 C ATOM 340 CG GLU A 23 19.429 -15.592 7.878 1.00 0.00 C ATOM 341 CD GLU A 23 19.491 -15.577 9.410 1.00 0.00 C ATOM 342 OE1 GLU A 23 20.491 -15.130 10.024 1.00 0.00 O ATOM 343 OE2 GLU A 23 18.538 -16.095 10.039 1.00 0.00 O ATOM 0 H GLU A 23 17.920 -13.645 6.664 1.00 0.00 H new ATOM 0 HA GLU A 23 19.914 -12.846 8.566 1.00 0.00 H new ATOM 0 HB2 GLU A 23 20.158 -14.615 6.116 1.00 0.00 H new ATOM 0 HB3 GLU A 23 21.257 -14.546 7.479 1.00 0.00 H new ATOM 0 HG2 GLU A 23 18.385 -15.533 7.570 1.00 0.00 H new ATOM 0 HG3 GLU A 23 19.813 -16.548 7.522 1.00 0.00 H new ATOM 350 N VAL A 24 20.013 -11.758 5.422 1.00 0.00 N ATOM 351 CA VAL A 24 20.612 -10.813 4.483 1.00 0.00 C ATOM 352 C VAL A 24 20.589 -9.402 5.040 1.00 0.00 C ATOM 353 O VAL A 24 21.545 -8.659 4.837 1.00 0.00 O ATOM 354 CB VAL A 24 19.998 -10.959 3.078 1.00 0.00 C ATOM 355 CG1 VAL A 24 20.480 -9.885 2.091 1.00 0.00 C ATOM 356 CG2 VAL A 24 20.357 -12.327 2.474 1.00 0.00 C ATOM 0 H VAL A 24 19.175 -12.208 5.054 1.00 0.00 H new ATOM 0 HA VAL A 24 21.668 -11.054 4.358 1.00 0.00 H new ATOM 0 HB VAL A 24 18.922 -10.850 3.218 1.00 0.00 H new ATOM 0 HG11 VAL A 24 20.010 -10.045 1.121 1.00 0.00 H new ATOM 0 HG12 VAL A 24 20.210 -8.898 2.467 1.00 0.00 H new ATOM 0 HG13 VAL A 24 21.563 -9.949 1.984 1.00 0.00 H new ATOM 0 HG21 VAL A 24 19.915 -12.414 1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 24 21.441 -12.418 2.398 1.00 0.00 H new ATOM 0 HG23 VAL A 24 19.970 -13.120 3.114 1.00 0.00 H new ATOM 366 N GLN A 25 19.579 -9.045 5.821 1.00 0.00 N ATOM 367 CA GLN A 25 19.488 -7.714 6.400 1.00 0.00 C ATOM 368 C GLN A 25 20.603 -7.503 7.431 1.00 0.00 C ATOM 369 O GLN A 25 21.016 -6.366 7.666 1.00 0.00 O ATOM 370 CB GLN A 25 18.062 -7.508 6.915 1.00 0.00 C ATOM 371 CG GLN A 25 17.135 -7.531 5.684 1.00 0.00 C ATOM 372 CD GLN A 25 15.655 -7.555 6.071 1.00 0.00 C ATOM 373 OE1 GLN A 25 14.969 -8.571 6.008 1.00 0.00 O ATOM 374 NE2 GLN A 25 15.112 -6.427 6.500 1.00 0.00 N ATOM 0 H GLN A 25 18.807 -9.664 6.069 1.00 0.00 H new ATOM 0 HA GLN A 25 19.661 -6.934 5.659 1.00 0.00 H new ATOM 0 HB2 GLN A 25 17.788 -8.294 7.619 1.00 0.00 H new ATOM 0 HB3 GLN A 25 17.976 -6.560 7.446 1.00 0.00 H new ATOM 0 HG2 GLN A 25 17.333 -6.654 5.067 1.00 0.00 H new ATOM 0 HG3 GLN A 25 17.363 -8.407 5.076 1.00 0.00 H new ATOM 0 HE21 GLN A 25 15.675 -5.578 6.555 1.00 0.00 H new ATOM 0 HE22 GLN A 25 14.130 -6.406 6.775 1.00 0.00 H new ATOM 383 N LYS A 26 21.107 -8.586 8.033 1.00 0.00 N ATOM 384 CA LYS A 26 22.198 -8.540 8.994 1.00 0.00 C ATOM 385 C LYS A 26 23.487 -8.433 8.179 1.00 0.00 C ATOM 386 O LYS A 26 24.244 -7.477 8.334 1.00 0.00 O ATOM 387 CB LYS A 26 22.208 -9.811 9.869 1.00 0.00 C ATOM 388 CG LYS A 26 20.971 -10.009 10.751 1.00 0.00 C ATOM 389 CD LYS A 26 20.811 -8.939 11.838 1.00 0.00 C ATOM 390 CE LYS A 26 21.898 -8.990 12.922 1.00 0.00 C ATOM 391 NZ LYS A 26 23.068 -8.120 12.663 1.00 0.00 N ATOM 0 H LYS A 26 20.759 -9.529 7.859 1.00 0.00 H new ATOM 0 HA LYS A 26 22.090 -7.692 9.671 1.00 0.00 H new ATOM 0 HB2 LYS A 26 22.313 -10.679 9.218 1.00 0.00 H new ATOM 0 HB3 LYS A 26 23.090 -9.784 10.509 1.00 0.00 H new ATOM 0 HG2 LYS A 26 20.082 -10.009 10.120 1.00 0.00 H new ATOM 0 HG3 LYS A 26 21.026 -10.989 11.224 1.00 0.00 H new ATOM 0 HD2 LYS A 26 20.823 -7.954 11.370 1.00 0.00 H new ATOM 0 HD3 LYS A 26 19.835 -9.056 12.309 1.00 0.00 H new ATOM 0 HE2 LYS A 26 21.455 -8.706 13.876 1.00 0.00 H new ATOM 0 HE3 LYS A 26 22.243 -10.019 13.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 23.932 -8.590 13.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 23.148 -7.941 11.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 22.947 -7.217 13.164 1.00 0.00 H new ATOM 405 N GLN A 27 23.706 -9.394 7.281 1.00 0.00 N ATOM 406 CA GLN A 27 24.879 -9.481 6.410 1.00 0.00 C ATOM 407 C GLN A 27 25.041 -8.288 5.456 1.00 0.00 C ATOM 408 O GLN A 27 26.128 -8.113 4.914 1.00 0.00 O ATOM 409 CB GLN A 27 24.817 -10.808 5.634 1.00 0.00 C ATOM 410 CG GLN A 27 25.159 -11.998 6.544 1.00 0.00 C ATOM 411 CD GLN A 27 24.603 -13.315 6.011 1.00 0.00 C ATOM 412 OE1 GLN A 27 25.212 -13.995 5.192 1.00 0.00 O ATOM 413 NE2 GLN A 27 23.433 -13.705 6.483 1.00 0.00 N ATOM 0 H GLN A 27 23.049 -10.160 7.135 1.00 0.00 H new ATOM 0 HA GLN A 27 25.763 -9.449 7.047 1.00 0.00 H new ATOM 0 HB2 GLN A 27 23.820 -10.942 5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 27 25.513 -10.775 4.796 1.00 0.00 H new ATOM 0 HG2 GLN A 27 26.242 -12.077 6.643 1.00 0.00 H new ATOM 0 HG3 GLN A 27 24.760 -11.815 7.542 1.00 0.00 H new ATOM 0 HE21 GLN A 27 22.940 -13.128 7.164 1.00 0.00 H new ATOM 0 HE22 GLN A 27 23.023 -14.584 6.167 1.00 0.00 H new ATOM 422 N LEU A 28 24.018 -7.447 5.272 1.00 0.00 N ATOM 423 CA LEU A 28 24.058 -6.281 4.394 1.00 0.00 C ATOM 424 C LEU A 28 25.158 -5.298 4.789 1.00 0.00 C ATOM 425 O LEU A 28 25.730 -4.672 3.901 1.00 0.00 O ATOM 426 CB LEU A 28 22.694 -5.561 4.395 1.00 0.00 C ATOM 427 CG LEU A 28 22.024 -5.538 3.013 1.00 0.00 C ATOM 428 CD1 LEU A 28 20.616 -4.952 3.155 1.00 0.00 C ATOM 429 CD2 LEU A 28 22.813 -4.706 1.994 1.00 0.00 C ATOM 0 H LEU A 28 23.120 -7.564 5.742 1.00 0.00 H new ATOM 0 HA LEU A 28 24.281 -6.645 3.391 1.00 0.00 H new ATOM 0 HB2 LEU A 28 22.030 -6.054 5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 28 22.831 -4.537 4.743 1.00 0.00 H new ATOM 0 HG LEU A 28 21.989 -6.563 2.643 1.00 0.00 H new ATOM 0 HD11 LEU A 28 20.131 -4.931 2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 28 20.032 -5.569 3.837 1.00 0.00 H new ATOM 0 HD13 LEU A 28 20.682 -3.938 3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 28 22.297 -4.722 1.034 1.00 0.00 H new ATOM 0 HD22 LEU A 28 22.891 -3.678 2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 28 23.812 -5.126 1.876 1.00 0.00 H new ATOM 441 N ALA A 29 25.422 -5.168 6.098 1.00 0.00 N ATOM 442 CA ALA A 29 26.416 -4.306 6.732 1.00 0.00 C ATOM 443 C ALA A 29 26.646 -3.006 5.947 1.00 0.00 C ATOM 444 O ALA A 29 27.745 -2.751 5.437 1.00 0.00 O ATOM 445 CB ALA A 29 27.703 -5.112 6.955 1.00 0.00 C ATOM 0 H ALA A 29 24.902 -5.708 6.790 1.00 0.00 H new ATOM 0 HA ALA A 29 26.043 -3.980 7.703 1.00 0.00 H new ATOM 0 HB1 ALA A 29 28.452 -4.477 7.428 1.00 0.00 H new ATOM 0 HB2 ALA A 29 27.491 -5.965 7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 29 28.081 -5.467 5.996 1.00 0.00 H new ATOM 451 N ARG A 30 25.607 -2.175 5.816 1.00 0.00 N ATOM 452 CA ARG A 30 25.654 -0.910 5.098 1.00 0.00 C ATOM 453 C ARG A 30 24.618 0.023 5.694 1.00 0.00 C ATOM 454 O ARG A 30 23.900 -0.370 6.620 1.00 0.00 O ATOM 455 CB ARG A 30 25.429 -1.155 3.599 1.00 0.00 C ATOM 456 CG ARG A 30 26.193 -0.146 2.727 1.00 0.00 C ATOM 457 CD ARG A 30 26.432 -0.773 1.351 1.00 0.00 C ATOM 458 NE ARG A 30 27.356 0.015 0.520 1.00 0.00 N ATOM 459 CZ ARG A 30 27.582 -0.235 -0.774 1.00 0.00 C ATOM 460 NH1 ARG A 30 27.108 -1.353 -1.320 1.00 0.00 N ATOM 461 NH2 ARG A 30 28.258 0.630 -1.522 1.00 0.00 N ATOM 0 H ARG A 30 24.691 -2.374 6.218 1.00 0.00 H new ATOM 0 HA ARG A 30 26.633 -0.441 5.200 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.747 -2.166 3.346 1.00 0.00 H new ATOM 0 HB3 ARG A 30 24.364 -1.091 3.378 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.622 0.777 2.628 1.00 0.00 H new ATOM 0 HG3 ARG A 30 27.143 0.115 3.194 1.00 0.00 H new ATOM 0 HD2 ARG A 30 26.833 -1.778 1.479 1.00 0.00 H new ATOM 0 HD3 ARG A 30 25.479 -0.874 0.832 1.00 0.00 H new ATOM 0 HE ARG A 30 27.851 0.794 0.954 1.00 0.00 H new ATOM 0 HH11 ARG A 30 26.576 -2.012 -0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 30 27.277 -1.550 -2.306 1.00 0.00 H new ATOM 0 HH21 ARG A 30 28.610 1.494 -1.110 1.00 0.00 H new ATOM 0 HH22 ARG A 30 28.425 0.430 -2.508 1.00 0.00 H new ATOM 475 N MET A 31 24.543 1.239 5.171 1.00 0.00 N ATOM 476 CA MET A 31 23.659 2.310 5.582 1.00 0.00 C ATOM 477 C MET A 31 23.391 3.186 4.348 1.00 0.00 C ATOM 478 O MET A 31 23.761 2.816 3.232 1.00 0.00 O ATOM 479 CB MET A 31 24.408 3.110 6.663 1.00 0.00 C ATOM 480 CG MET A 31 24.756 2.354 7.947 1.00 0.00 C ATOM 481 SD MET A 31 23.347 1.739 8.903 1.00 0.00 S ATOM 482 CE MET A 31 24.130 1.745 10.528 1.00 0.00 C ATOM 0 H MET A 31 25.142 1.518 4.394 1.00 0.00 H new ATOM 0 HA MET A 31 22.709 1.950 5.978 1.00 0.00 H new ATOM 0 HB2 MET A 31 25.333 3.490 6.228 1.00 0.00 H new ATOM 0 HB3 MET A 31 23.802 3.976 6.929 1.00 0.00 H new ATOM 0 HG2 MET A 31 25.392 1.508 7.687 1.00 0.00 H new ATOM 0 HG3 MET A 31 25.345 3.012 8.586 1.00 0.00 H new ATOM 0 HE1 MET A 31 23.419 1.393 11.276 1.00 0.00 H new ATOM 0 HE2 MET A 31 24.999 1.087 10.516 1.00 0.00 H new ATOM 0 HE3 MET A 31 24.446 2.758 10.776 1.00 0.00 H new ATOM 492 N THR A 32 22.771 4.348 4.557 1.00 0.00 N ATOM 493 CA THR A 32 22.434 5.351 3.557 1.00 0.00 C ATOM 494 C THR A 32 21.480 4.825 2.480 1.00 0.00 C ATOM 495 O THR A 32 21.896 4.370 1.410 1.00 0.00 O ATOM 496 CB THR A 32 23.732 5.971 3.002 1.00 0.00 C ATOM 497 OG1 THR A 32 24.510 6.514 4.060 1.00 0.00 O ATOM 498 CG2 THR A 32 23.461 7.092 2.003 1.00 0.00 C ATOM 0 H THR A 32 22.473 4.628 5.492 1.00 0.00 H new ATOM 0 HA THR A 32 21.864 6.149 4.033 1.00 0.00 H new ATOM 0 HB THR A 32 24.264 5.166 2.495 1.00 0.00 H new ATOM 0 HG1 THR A 32 25.332 6.903 3.695 1.00 0.00 H new ATOM 0 HG21 THR A 32 24.408 7.495 1.642 1.00 0.00 H new ATOM 0 HG22 THR A 32 22.890 6.699 1.162 1.00 0.00 H new ATOM 0 HG23 THR A 32 22.892 7.884 2.490 1.00 0.00 H new ATOM 506 N ARG A 33 20.176 4.864 2.766 1.00 0.00 N ATOM 507 CA ARG A 33 19.147 4.426 1.826 1.00 0.00 C ATOM 508 C ARG A 33 19.016 5.436 0.687 1.00 0.00 C ATOM 509 O ARG A 33 19.210 6.634 0.900 1.00 0.00 O ATOM 510 CB ARG A 33 17.791 4.270 2.530 1.00 0.00 C ATOM 511 CG ARG A 33 17.272 5.575 3.160 1.00 0.00 C ATOM 512 CD ARG A 33 15.982 5.351 3.943 1.00 0.00 C ATOM 513 NE ARG A 33 16.241 4.668 5.214 1.00 0.00 N ATOM 514 CZ ARG A 33 15.384 4.601 6.237 1.00 0.00 C ATOM 515 NH1 ARG A 33 14.140 5.053 6.117 1.00 0.00 N ATOM 516 NH2 ARG A 33 15.797 4.067 7.375 1.00 0.00 N ATOM 0 H ARG A 33 19.807 5.200 3.655 1.00 0.00 H new ATOM 0 HA ARG A 33 19.445 3.457 1.424 1.00 0.00 H new ATOM 0 HB2 ARG A 33 17.057 3.906 1.811 1.00 0.00 H new ATOM 0 HB3 ARG A 33 17.879 3.511 3.307 1.00 0.00 H new ATOM 0 HG2 ARG A 33 18.033 5.987 3.823 1.00 0.00 H new ATOM 0 HG3 ARG A 33 17.099 6.313 2.377 1.00 0.00 H new ATOM 0 HD2 ARG A 33 15.500 6.309 4.135 1.00 0.00 H new ATOM 0 HD3 ARG A 33 15.289 4.759 3.345 1.00 0.00 H new ATOM 0 HE ARG A 33 17.145 4.209 5.326 1.00 0.00 H new ATOM 0 HH11 ARG A 33 13.827 5.458 5.235 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.498 4.995 6.907 1.00 0.00 H new ATOM 0 HH21 ARG A 33 16.752 3.717 7.457 1.00 0.00 H new ATOM 0 HH22 ARG A 33 15.161 4.005 8.170 1.00 0.00 H new ATOM 530 N CYS A 34 18.650 4.923 -0.486 1.00 0.00 N ATOM 531 CA CYS A 34 18.415 5.614 -1.747 1.00 0.00 C ATOM 532 C CYS A 34 17.448 4.741 -2.573 1.00 0.00 C ATOM 533 O CYS A 34 16.327 5.184 -2.831 1.00 0.00 O ATOM 534 CB CYS A 34 19.711 5.937 -2.515 1.00 0.00 C ATOM 535 SG CYS A 34 20.637 7.307 -1.766 1.00 0.00 S ATOM 0 H CYS A 34 18.497 3.919 -0.584 1.00 0.00 H new ATOM 0 HA CYS A 34 17.973 6.591 -1.549 1.00 0.00 H new ATOM 0 HB2 CYS A 34 20.343 5.049 -2.546 1.00 0.00 H new ATOM 0 HB3 CYS A 34 19.465 6.189 -3.547 1.00 0.00 H new ATOM 0 HG CYS A 34 20.319 7.410 -0.510 1.00 0.00 H new ATOM 541 N PRO A 35 17.791 3.490 -2.953 1.00 0.00 N ATOM 542 CA PRO A 35 16.895 2.638 -3.730 1.00 0.00 C ATOM 543 C PRO A 35 15.632 2.253 -2.948 1.00 0.00 C ATOM 544 O PRO A 35 14.581 2.096 -3.568 1.00 0.00 O ATOM 545 CB PRO A 35 17.723 1.415 -4.144 1.00 0.00 C ATOM 546 CG PRO A 35 18.835 1.343 -3.104 1.00 0.00 C ATOM 547 CD PRO A 35 19.058 2.807 -2.747 1.00 0.00 C ATOM 0 HA PRO A 35 16.520 3.166 -4.607 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.119 0.507 -4.144 1.00 0.00 H new ATOM 0 HB3 PRO A 35 18.126 1.530 -5.150 1.00 0.00 H new ATOM 0 HG2 PRO A 35 18.539 0.755 -2.235 1.00 0.00 H new ATOM 0 HG3 PRO A 35 19.737 0.883 -3.507 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.386 2.906 -1.712 1.00 0.00 H new ATOM 0 HD3 PRO A 35 19.838 3.242 -3.372 1.00 0.00 H new ATOM 555 N GLU A 36 15.700 2.237 -1.608 1.00 0.00 N ATOM 556 CA GLU A 36 14.605 1.888 -0.695 1.00 0.00 C ATOM 557 C GLU A 36 13.361 2.781 -0.850 1.00 0.00 C ATOM 558 O GLU A 36 12.311 2.482 -0.263 1.00 0.00 O ATOM 559 CB GLU A 36 15.073 1.900 0.772 1.00 0.00 C ATOM 560 CG GLU A 36 16.429 1.233 1.059 1.00 0.00 C ATOM 561 CD GLU A 36 16.527 -0.205 0.544 1.00 0.00 C ATOM 562 OE1 GLU A 36 15.941 -1.130 1.147 1.00 0.00 O ATOM 563 OE2 GLU A 36 17.240 -0.419 -0.461 1.00 0.00 O ATOM 0 H GLU A 36 16.558 2.478 -1.111 1.00 0.00 H new ATOM 0 HA GLU A 36 14.309 0.877 -0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 36 15.123 2.936 1.107 1.00 0.00 H new ATOM 0 HB3 GLU A 36 14.313 1.406 1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 36 17.221 1.828 0.603 1.00 0.00 H new ATOM 0 HG3 GLU A 36 16.606 1.238 2.135 1.00 0.00 H new ATOM 570 N GLN A 37 13.461 3.892 -1.599 1.00 0.00 N ATOM 571 CA GLN A 37 12.317 4.766 -1.845 1.00 0.00 C ATOM 572 C GLN A 37 11.245 3.942 -2.572 1.00 0.00 C ATOM 573 O GLN A 37 10.054 4.194 -2.369 1.00 0.00 O ATOM 574 CB GLN A 37 12.726 6.008 -2.659 1.00 0.00 C ATOM 575 CG GLN A 37 11.551 6.988 -2.865 1.00 0.00 C ATOM 576 CD GLN A 37 11.935 8.241 -3.651 1.00 0.00 C ATOM 577 OE1 GLN A 37 11.043 8.772 -4.467 1.00 0.00 O flip ATOM 578 NE2 GLN A 37 13.029 8.785 -3.502 1.00 0.00 N flip ATOM 0 H GLN A 37 14.326 4.201 -2.042 1.00 0.00 H new ATOM 0 HA GLN A 37 11.920 5.138 -0.901 1.00 0.00 H new ATOM 0 HB2 GLN A 37 13.540 6.523 -2.148 1.00 0.00 H new ATOM 0 HB3 GLN A 37 13.108 5.693 -3.630 1.00 0.00 H new ATOM 0 HG2 GLN A 37 10.746 6.473 -3.388 1.00 0.00 H new ATOM 0 HG3 GLN A 37 11.160 7.284 -1.892 1.00 0.00 H new ATOM 0 HE21 GLN A 37 13.720 8.377 -2.872 1.00 0.00 H new ATOM 0 HE22 GLN A 37 13.245 9.644 -4.008 1.00 0.00 H new ATOM 587 N GLU A 38 11.677 2.948 -3.362 1.00 0.00 N ATOM 588 CA GLU A 38 10.852 2.028 -4.125 1.00 0.00 C ATOM 589 C GLU A 38 9.716 1.526 -3.257 1.00 0.00 C ATOM 590 O GLU A 38 8.577 1.595 -3.678 1.00 0.00 O ATOM 591 CB GLU A 38 11.703 0.834 -4.581 1.00 0.00 C ATOM 592 CG GLU A 38 10.890 -0.291 -5.255 1.00 0.00 C ATOM 593 CD GLU A 38 10.314 0.071 -6.634 1.00 0.00 C ATOM 594 OE1 GLU A 38 10.738 1.105 -7.209 1.00 0.00 O ATOM 595 OE2 GLU A 38 9.491 -0.721 -7.154 1.00 0.00 O ATOM 0 H GLU A 38 12.672 2.762 -3.486 1.00 0.00 H new ATOM 0 HA GLU A 38 10.447 2.544 -4.995 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.463 1.187 -5.278 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.227 0.423 -3.718 1.00 0.00 H new ATOM 0 HG2 GLU A 38 11.528 -1.168 -5.362 1.00 0.00 H new ATOM 0 HG3 GLU A 38 10.069 -0.572 -4.596 1.00 0.00 H new ATOM 602 N LEU A 39 10.000 1.086 -2.030 1.00 0.00 N ATOM 603 CA LEU A 39 9.005 0.556 -1.107 1.00 0.00 C ATOM 604 C LEU A 39 7.799 1.485 -0.878 1.00 0.00 C ATOM 605 O LEU A 39 6.677 1.030 -0.628 1.00 0.00 O ATOM 606 CB LEU A 39 9.718 0.223 0.213 1.00 0.00 C ATOM 607 CG LEU A 39 9.084 -1.019 0.846 1.00 0.00 C ATOM 608 CD1 LEU A 39 9.623 -2.311 0.217 1.00 0.00 C ATOM 609 CD2 LEU A 39 9.350 -1.031 2.354 1.00 0.00 C ATOM 0 H LEU A 39 10.945 1.090 -1.647 1.00 0.00 H new ATOM 0 HA LEU A 39 8.572 -0.339 -1.553 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.778 0.048 0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.648 1.068 0.898 1.00 0.00 H new ATOM 0 HG LEU A 39 8.011 -0.975 0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.151 -3.171 0.691 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.400 -2.317 -0.850 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.702 -2.364 0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.896 -1.918 2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.425 -1.046 2.534 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.919 -0.138 2.807 1.00 0.00 H new ATOM 621 N ARG A 40 8.037 2.799 -0.882 1.00 0.00 N ATOM 622 CA ARG A 40 6.994 3.805 -0.697 1.00 0.00 C ATOM 623 C ARG A 40 6.210 3.881 -1.998 1.00 0.00 C ATOM 624 O ARG A 40 4.983 3.881 -1.953 1.00 0.00 O ATOM 625 CB ARG A 40 7.579 5.176 -0.317 1.00 0.00 C ATOM 626 CG ARG A 40 8.064 5.265 1.138 1.00 0.00 C ATOM 627 CD ARG A 40 9.170 4.268 1.520 1.00 0.00 C ATOM 628 NE ARG A 40 9.742 4.602 2.830 1.00 0.00 N ATOM 629 CZ ARG A 40 10.680 3.915 3.489 1.00 0.00 C ATOM 630 NH1 ARG A 40 11.422 2.992 2.872 1.00 0.00 N ATOM 631 NH2 ARG A 40 10.835 4.165 4.782 1.00 0.00 N ATOM 0 H ARG A 40 8.967 3.195 -1.015 1.00 0.00 H new ATOM 0 HA ARG A 40 6.343 3.521 0.130 1.00 0.00 H new ATOM 0 HB2 ARG A 40 8.413 5.401 -0.982 1.00 0.00 H new ATOM 0 HB3 ARG A 40 6.822 5.942 -0.485 1.00 0.00 H new ATOM 0 HG2 ARG A 40 8.428 6.276 1.322 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.211 5.108 1.799 1.00 0.00 H new ATOM 0 HD2 ARG A 40 8.763 3.257 1.543 1.00 0.00 H new ATOM 0 HD3 ARG A 40 9.954 4.279 0.762 1.00 0.00 H new ATOM 0 HE ARG A 40 9.387 5.444 3.283 1.00 0.00 H new ATOM 0 HH11 ARG A 40 11.278 2.801 1.881 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.133 2.478 3.392 1.00 0.00 H new ATOM 0 HH21 ARG A 40 10.248 4.862 5.241 1.00 0.00 H new ATOM 0 HH22 ARG A 40 11.541 3.660 5.318 1.00 0.00 H new ATOM 645 N LEU A 41 6.905 3.934 -3.135 1.00 0.00 N ATOM 646 CA LEU A 41 6.256 3.989 -4.445 1.00 0.00 C ATOM 647 C LEU A 41 5.365 2.749 -4.595 1.00 0.00 C ATOM 648 O LEU A 41 4.184 2.857 -4.893 1.00 0.00 O ATOM 649 CB LEU A 41 7.288 4.068 -5.587 1.00 0.00 C ATOM 650 CG LEU A 41 8.416 5.098 -5.403 1.00 0.00 C ATOM 651 CD1 LEU A 41 9.368 5.067 -6.598 1.00 0.00 C ATOM 652 CD2 LEU A 41 7.911 6.528 -5.210 1.00 0.00 C ATOM 0 H LEU A 41 7.924 3.940 -3.174 1.00 0.00 H new ATOM 0 HA LEU A 41 5.650 4.893 -4.510 1.00 0.00 H new ATOM 0 HB2 LEU A 41 7.738 3.083 -5.713 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.760 4.297 -6.513 1.00 0.00 H new ATOM 0 HG LEU A 41 8.935 4.809 -4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.160 5.802 -6.452 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.807 4.073 -6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 41 8.817 5.304 -7.508 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.760 7.200 -5.086 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.333 6.831 -6.083 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.280 6.574 -4.323 1.00 0.00 H new ATOM 664 N GLN A 42 5.912 1.578 -4.275 1.00 0.00 N ATOM 665 CA GLN A 42 5.324 0.256 -4.308 1.00 0.00 C ATOM 666 C GLN A 42 3.977 0.276 -3.600 1.00 0.00 C ATOM 667 O GLN A 42 2.968 -0.086 -4.210 1.00 0.00 O ATOM 668 CB GLN A 42 6.328 -0.725 -3.695 1.00 0.00 C ATOM 669 CG GLN A 42 6.060 -2.155 -4.135 1.00 0.00 C ATOM 670 CD GLN A 42 7.135 -3.073 -3.567 1.00 0.00 C ATOM 671 OE1 GLN A 42 8.292 -3.064 -3.984 1.00 0.00 O ATOM 672 NE2 GLN A 42 6.762 -3.864 -2.588 1.00 0.00 N ATOM 0 H GLN A 42 6.879 1.537 -3.954 1.00 0.00 H new ATOM 0 HA GLN A 42 5.121 -0.072 -5.327 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.339 -0.439 -3.985 1.00 0.00 H new ATOM 0 HB3 GLN A 42 6.279 -0.664 -2.608 1.00 0.00 H new ATOM 0 HG2 GLN A 42 5.076 -2.474 -3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.053 -2.216 -5.223 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.796 -3.851 -2.262 1.00 0.00 H new ATOM 0 HE22 GLN A 42 7.439 -4.492 -2.154 1.00 0.00 H new ATOM 681 N ARG A 43 3.931 0.704 -2.327 1.00 0.00 N ATOM 682 CA ARG A 43 2.647 0.736 -1.628 1.00 0.00 C ATOM 683 C ARG A 43 1.695 1.769 -2.225 1.00 0.00 C ATOM 684 O ARG A 43 0.501 1.491 -2.278 1.00 0.00 O ATOM 685 CB ARG A 43 2.789 0.909 -0.106 1.00 0.00 C ATOM 686 CG ARG A 43 3.197 2.324 0.334 1.00 0.00 C ATOM 687 CD ARG A 43 3.411 2.439 1.838 1.00 0.00 C ATOM 688 NE ARG A 43 4.586 1.669 2.262 1.00 0.00 N ATOM 689 CZ ARG A 43 5.083 1.612 3.496 1.00 0.00 C ATOM 690 NH1 ARG A 43 4.595 2.382 4.467 1.00 0.00 N ATOM 691 NH2 ARG A 43 6.084 0.774 3.725 1.00 0.00 N ATOM 0 H ARG A 43 4.735 1.019 -1.784 1.00 0.00 H new ATOM 0 HA ARG A 43 2.203 -0.247 -1.782 1.00 0.00 H new ATOM 0 HB2 ARG A 43 1.841 0.653 0.367 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.530 0.199 0.261 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.114 2.609 -0.181 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.426 3.031 0.027 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.540 3.486 2.112 1.00 0.00 H new ATOM 0 HD3 ARG A 43 2.527 2.079 2.363 1.00 0.00 H new ATOM 0 HE ARG A 43 5.067 1.127 1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.830 3.027 4.270 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.987 2.327 5.407 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.450 0.198 2.967 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.488 0.705 4.659 1.00 0.00 H new ATOM 705 N LEU A 44 2.195 2.930 -2.655 1.00 0.00 N ATOM 706 CA LEU A 44 1.385 3.999 -3.235 1.00 0.00 C ATOM 707 C LEU A 44 0.824 3.612 -4.602 1.00 0.00 C ATOM 708 O LEU A 44 -0.145 4.228 -5.039 1.00 0.00 O ATOM 709 CB LEU A 44 2.209 5.297 -3.324 1.00 0.00 C ATOM 710 CG LEU A 44 2.441 5.947 -1.945 1.00 0.00 C ATOM 711 CD1 LEU A 44 3.572 6.974 -2.017 1.00 0.00 C ATOM 712 CD2 LEU A 44 1.175 6.634 -1.409 1.00 0.00 C ATOM 0 H LEU A 44 3.189 3.155 -2.608 1.00 0.00 H new ATOM 0 HA LEU A 44 0.532 4.167 -2.578 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.172 5.081 -3.786 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.695 6.005 -3.974 1.00 0.00 H new ATOM 0 HG LEU A 44 2.712 5.143 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.720 7.421 -1.034 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.491 6.481 -2.334 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.312 7.752 -2.734 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.386 7.078 -0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.863 7.414 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.377 5.898 -1.307 1.00 0.00 H new ATOM 724 N GLU A 45 1.390 2.598 -5.256 1.00 0.00 N ATOM 725 CA GLU A 45 0.977 2.079 -6.550 1.00 0.00 C ATOM 726 C GLU A 45 0.076 0.847 -6.418 1.00 0.00 C ATOM 727 O GLU A 45 -0.661 0.533 -7.351 1.00 0.00 O ATOM 728 CB GLU A 45 2.223 1.707 -7.370 1.00 0.00 C ATOM 729 CG GLU A 45 3.018 2.910 -7.890 1.00 0.00 C ATOM 730 CD GLU A 45 2.403 3.575 -9.120 1.00 0.00 C ATOM 731 OE1 GLU A 45 1.159 3.641 -9.245 1.00 0.00 O ATOM 732 OE2 GLU A 45 3.168 4.065 -9.981 1.00 0.00 O ATOM 0 H GLU A 45 2.190 2.094 -4.874 1.00 0.00 H new ATOM 0 HA GLU A 45 0.404 2.859 -7.051 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.879 1.092 -6.754 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.916 1.095 -8.218 1.00 0.00 H new ATOM 0 HG2 GLU A 45 3.102 3.649 -7.093 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.030 2.587 -8.132 1.00 0.00 H new ATOM 739 N ARG A 46 0.099 0.144 -5.279 1.00 0.00 N ATOM 740 CA ARG A 46 -0.674 -1.067 -5.004 1.00 0.00 C ATOM 741 C ARG A 46 -2.172 -0.825 -4.791 1.00 0.00 C ATOM 742 O ARG A 46 -2.927 -1.795 -4.759 1.00 0.00 O ATOM 743 CB ARG A 46 -0.030 -1.765 -3.791 1.00 0.00 C ATOM 744 CG ARG A 46 -0.262 -3.276 -3.671 1.00 0.00 C ATOM 745 CD ARG A 46 0.743 -4.107 -4.479 1.00 0.00 C ATOM 746 NE ARG A 46 0.402 -4.242 -5.906 1.00 0.00 N ATOM 747 CZ ARG A 46 1.267 -4.517 -6.893 1.00 0.00 C ATOM 748 NH1 ARG A 46 2.562 -4.677 -6.637 1.00 0.00 N ATOM 749 NH2 ARG A 46 0.830 -4.635 -8.138 1.00 0.00 N ATOM 0 H ARG A 46 0.684 0.419 -4.490 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.637 -1.704 -5.887 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.045 -1.586 -3.825 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.404 -1.289 -2.885 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -0.202 -3.564 -2.622 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.272 -3.510 -4.008 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.729 -3.649 -4.394 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.814 -5.101 -4.038 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.576 -4.115 -6.165 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.907 -4.591 -5.681 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.210 -4.886 -7.397 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.162 -4.517 -8.344 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.486 -4.844 -8.891 1.00 0.00 H new ATOM 763 N LEU A 47 -2.630 0.426 -4.699 1.00 0.00 N ATOM 764 CA LEU A 47 -4.034 0.797 -4.486 1.00 0.00 C ATOM 765 C LEU A 47 -4.996 0.005 -5.401 1.00 0.00 C ATOM 766 O LEU A 47 -5.884 -0.689 -4.890 1.00 0.00 O ATOM 767 CB LEU A 47 -4.286 2.323 -4.597 1.00 0.00 C ATOM 768 CG LEU A 47 -3.111 3.302 -4.430 1.00 0.00 C ATOM 769 CD1 LEU A 47 -3.601 4.733 -4.677 1.00 0.00 C ATOM 770 CD2 LEU A 47 -2.434 3.185 -3.060 1.00 0.00 C ATOM 0 H LEU A 47 -2.015 1.236 -4.773 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.253 0.518 -3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.730 2.510 -5.575 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.037 2.585 -3.851 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.352 3.041 -5.168 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.769 5.428 -4.559 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.999 4.812 -5.689 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.384 4.979 -3.959 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.612 3.899 -2.998 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.160 3.399 -2.276 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.047 2.174 -2.931 1.00 0.00 H new ATOM 782 N PRO A 48 -4.867 0.062 -6.745 1.00 0.00 N ATOM 783 CA PRO A 48 -5.730 -0.664 -7.679 1.00 0.00 C ATOM 784 C PRO A 48 -5.666 -2.186 -7.502 1.00 0.00 C ATOM 785 O PRO A 48 -6.581 -2.887 -7.934 1.00 0.00 O ATOM 786 CB PRO A 48 -5.293 -0.193 -9.067 1.00 0.00 C ATOM 787 CG PRO A 48 -3.838 0.209 -8.890 1.00 0.00 C ATOM 788 CD PRO A 48 -3.894 0.833 -7.505 1.00 0.00 C ATOM 0 HA PRO A 48 -6.783 -0.447 -7.502 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.399 -0.986 -9.807 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.898 0.646 -9.410 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.163 -0.646 -8.933 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.507 0.916 -9.651 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.915 0.803 -7.026 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -4.189 1.881 -7.563 1.00 0.00 H new ATOM 796 N GLU A 49 -4.601 -2.718 -6.904 1.00 0.00 N ATOM 797 CA GLU A 49 -4.454 -4.145 -6.653 1.00 0.00 C ATOM 798 C GLU A 49 -5.349 -4.508 -5.467 1.00 0.00 C ATOM 799 O GLU A 49 -6.080 -5.494 -5.524 1.00 0.00 O ATOM 800 CB GLU A 49 -2.991 -4.498 -6.340 1.00 0.00 C ATOM 801 CG GLU A 49 -2.650 -5.925 -6.780 1.00 0.00 C ATOM 802 CD GLU A 49 -2.657 -6.010 -8.304 1.00 0.00 C ATOM 803 OE1 GLU A 49 -1.816 -5.335 -8.944 1.00 0.00 O ATOM 804 OE2 GLU A 49 -3.548 -6.664 -8.886 1.00 0.00 O ATOM 0 H GLU A 49 -3.810 -2.162 -6.578 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.746 -4.708 -7.539 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.330 -3.793 -6.844 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.812 -4.394 -5.270 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.671 -6.210 -6.395 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.373 -6.627 -6.364 1.00 0.00 H new ATOM 811 N LEU A 50 -5.323 -3.693 -4.402 1.00 0.00 N ATOM 812 CA LEU A 50 -6.130 -3.910 -3.204 1.00 0.00 C ATOM 813 C LEU A 50 -7.597 -3.989 -3.604 1.00 0.00 C ATOM 814 O LEU A 50 -8.275 -4.936 -3.201 1.00 0.00 O ATOM 815 CB LEU A 50 -5.888 -2.821 -2.138 1.00 0.00 C ATOM 816 CG LEU A 50 -4.840 -3.174 -1.062 1.00 0.00 C ATOM 817 CD1 LEU A 50 -5.304 -4.326 -0.159 1.00 0.00 C ATOM 818 CD2 LEU A 50 -3.461 -3.478 -1.659 1.00 0.00 C ATOM 0 H LEU A 50 -4.736 -2.861 -4.353 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.832 -4.852 -2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.574 -1.906 -2.641 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.834 -2.604 -1.643 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.738 -2.282 -0.444 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.534 -4.539 0.583 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.227 -4.043 0.347 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.480 -5.215 -0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.763 -3.720 -0.858 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.538 -4.325 -2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.100 -2.606 -2.204 1.00 0.00 H new ATOM 830 N ALA A 51 -8.090 -3.041 -4.419 1.00 0.00 N ATOM 831 CA ALA A 51 -9.492 -3.105 -4.842 1.00 0.00 C ATOM 832 C ALA A 51 -9.742 -4.355 -5.672 1.00 0.00 C ATOM 833 O ALA A 51 -10.757 -5.019 -5.463 1.00 0.00 O ATOM 834 CB ALA A 51 -9.920 -1.909 -5.671 1.00 0.00 C ATOM 0 H ALA A 51 -7.559 -2.251 -4.785 1.00 0.00 H new ATOM 0 HA ALA A 51 -10.076 -3.117 -3.922 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.968 -2.017 -5.952 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.793 -0.997 -5.087 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.307 -1.852 -6.570 1.00 0.00 H new ATOM 840 N ARG A 52 -8.845 -4.670 -6.614 1.00 0.00 N ATOM 841 CA ARG A 52 -8.995 -5.870 -7.445 1.00 0.00 C ATOM 842 C ARG A 52 -9.208 -7.098 -6.565 1.00 0.00 C ATOM 843 O ARG A 52 -10.163 -7.847 -6.797 1.00 0.00 O ATOM 844 CB ARG A 52 -7.771 -6.108 -8.346 1.00 0.00 C ATOM 845 CG ARG A 52 -7.957 -5.561 -9.764 1.00 0.00 C ATOM 846 CD ARG A 52 -6.798 -5.990 -10.685 1.00 0.00 C ATOM 847 NE ARG A 52 -6.606 -7.445 -10.737 1.00 0.00 N ATOM 848 CZ ARG A 52 -7.401 -8.373 -11.267 1.00 0.00 C ATOM 849 NH1 ARG A 52 -8.488 -8.024 -11.952 1.00 0.00 N ATOM 850 NH2 ARG A 52 -7.100 -9.650 -11.069 1.00 0.00 N ATOM 0 H ARG A 52 -8.014 -4.115 -6.819 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.863 -5.708 -8.083 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.897 -5.640 -7.893 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.568 -7.178 -8.399 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.902 -5.919 -10.173 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.016 -4.473 -9.732 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.987 -5.619 -11.692 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.876 -5.521 -10.340 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.747 -7.792 -10.309 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.719 -7.038 -12.075 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.090 -8.743 -12.354 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.276 -9.901 -10.522 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -7.692 -10.381 -11.464 1.00 0.00 H new ATOM 864 N VAL A 53 -8.339 -7.318 -5.579 1.00 0.00 N ATOM 865 CA VAL A 53 -8.447 -8.461 -4.687 1.00 0.00 C ATOM 866 C VAL A 53 -9.752 -8.377 -3.895 1.00 0.00 C ATOM 867 O VAL A 53 -10.504 -9.346 -3.922 1.00 0.00 O ATOM 868 CB VAL A 53 -7.195 -8.590 -3.800 1.00 0.00 C ATOM 869 CG1 VAL A 53 -7.358 -9.783 -2.853 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.940 -8.829 -4.657 1.00 0.00 C ATOM 0 H VAL A 53 -7.545 -6.709 -5.380 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.488 -9.381 -5.271 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.082 -7.663 -3.238 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.471 -9.873 -2.226 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.234 -9.630 -2.223 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.485 -10.695 -3.436 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -5.068 -8.917 -4.009 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -6.060 -9.748 -5.230 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.801 -7.991 -5.340 1.00 0.00 H new ATOM 880 N LEU A 54 -10.059 -7.252 -3.243 1.00 0.00 N ATOM 881 CA LEU A 54 -11.280 -7.044 -2.456 1.00 0.00 C ATOM 882 C LEU A 54 -12.522 -7.447 -3.260 1.00 0.00 C ATOM 883 O LEU A 54 -13.353 -8.239 -2.804 1.00 0.00 O ATOM 884 CB LEU A 54 -11.301 -5.573 -1.997 1.00 0.00 C ATOM 885 CG LEU A 54 -12.645 -5.016 -1.491 1.00 0.00 C ATOM 886 CD1 LEU A 54 -13.246 -5.841 -0.354 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.416 -3.580 -1.008 1.00 0.00 C ATOM 0 H LEU A 54 -9.447 -6.436 -3.248 1.00 0.00 H new ATOM 0 HA LEU A 54 -11.290 -7.681 -1.572 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.565 -5.456 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.970 -4.954 -2.831 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.355 -5.056 -2.317 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -14.191 -5.397 -0.042 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -13.420 -6.861 -0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.556 -5.855 0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.356 -3.164 -0.644 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.683 -3.580 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -12.046 -2.973 -1.834 1.00 0.00 H new ATOM 899 N ARG A 55 -12.640 -6.934 -4.486 1.00 0.00 N ATOM 900 CA ARG A 55 -13.756 -7.235 -5.376 1.00 0.00 C ATOM 901 C ARG A 55 -13.813 -8.743 -5.623 1.00 0.00 C ATOM 902 O ARG A 55 -14.912 -9.294 -5.645 1.00 0.00 O ATOM 903 CB ARG A 55 -13.592 -6.399 -6.660 1.00 0.00 C ATOM 904 CG ARG A 55 -14.889 -6.160 -7.446 1.00 0.00 C ATOM 905 CD ARG A 55 -15.272 -7.304 -8.385 1.00 0.00 C ATOM 906 NE ARG A 55 -16.453 -6.936 -9.182 1.00 0.00 N ATOM 907 CZ ARG A 55 -16.750 -7.358 -10.416 1.00 0.00 C ATOM 908 NH1 ARG A 55 -15.980 -8.235 -11.056 1.00 0.00 N ATOM 909 NH2 ARG A 55 -17.850 -6.889 -10.985 1.00 0.00 N ATOM 0 H ARG A 55 -11.957 -6.293 -4.890 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.714 -6.962 -4.934 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.162 -5.433 -6.395 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.876 -6.899 -7.312 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.703 -5.996 -6.740 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.784 -5.245 -8.030 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.437 -7.536 -9.046 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -15.481 -8.204 -7.807 1.00 0.00 H new ATOM 0 HE ARG A 55 -17.114 -6.292 -8.748 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.141 -8.601 -10.606 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -16.229 -8.541 -11.997 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -18.441 -6.227 -10.483 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.106 -7.190 -11.925 1.00 0.00 H new ATOM 923 N ASN A 56 -12.665 -9.407 -5.805 1.00 0.00 N ATOM 924 CA ASN A 56 -12.577 -10.846 -6.032 1.00 0.00 C ATOM 925 C ASN A 56 -13.147 -11.614 -4.830 1.00 0.00 C ATOM 926 O ASN A 56 -13.895 -12.574 -5.021 1.00 0.00 O ATOM 927 CB ASN A 56 -11.130 -11.274 -6.357 1.00 0.00 C ATOM 928 CG ASN A 56 -10.619 -12.409 -5.476 1.00 0.00 C ATOM 929 OD1 ASN A 56 -10.908 -13.579 -5.710 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.899 -12.082 -4.423 1.00 0.00 N ATOM 0 H ASN A 56 -11.756 -8.945 -5.798 1.00 0.00 H new ATOM 0 HA ASN A 56 -13.183 -11.096 -6.903 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -11.077 -11.583 -7.401 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.471 -10.413 -6.245 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.571 -12.807 -3.785 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.669 -11.104 -4.246 1.00 0.00 H new ATOM 937 N VAL A 57 -12.832 -11.192 -3.604 1.00 0.00 N ATOM 938 CA VAL A 57 -13.312 -11.861 -2.402 1.00 0.00 C ATOM 939 C VAL A 57 -14.835 -11.744 -2.313 1.00 0.00 C ATOM 940 O VAL A 57 -15.527 -12.758 -2.195 1.00 0.00 O ATOM 941 CB VAL A 57 -12.599 -11.319 -1.143 1.00 0.00 C ATOM 942 CG1 VAL A 57 -13.059 -12.106 0.085 1.00 0.00 C ATOM 943 CG2 VAL A 57 -11.069 -11.444 -1.216 1.00 0.00 C ATOM 0 H VAL A 57 -12.240 -10.382 -3.421 1.00 0.00 H new ATOM 0 HA VAL A 57 -13.067 -12.922 -2.459 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.859 -10.263 -1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.555 -11.723 0.972 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -14.137 -11.997 0.204 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.813 -13.160 -0.045 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.627 -11.046 -0.302 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.794 -12.493 -1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.698 -10.881 -2.073 1.00 0.00 H new ATOM 953 N PHE A 58 -15.379 -10.528 -2.416 1.00 0.00 N ATOM 954 CA PHE A 58 -16.818 -10.293 -2.320 1.00 0.00 C ATOM 955 C PHE A 58 -17.583 -10.997 -3.435 1.00 0.00 C ATOM 956 O PHE A 58 -18.656 -11.555 -3.199 1.00 0.00 O ATOM 957 CB PHE A 58 -17.108 -8.787 -2.334 1.00 0.00 C ATOM 958 CG PHE A 58 -16.974 -8.105 -0.986 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.809 -8.245 -0.205 1.00 0.00 C ATOM 960 CD2 PHE A 58 -18.029 -7.306 -0.509 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.701 -7.587 1.029 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.910 -6.626 0.713 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.743 -6.766 1.483 1.00 0.00 C ATOM 0 H PHE A 58 -14.832 -9.681 -2.568 1.00 0.00 H new ATOM 0 HA PHE A 58 -17.162 -10.714 -1.375 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -16.429 -8.306 -3.039 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -18.120 -8.629 -2.707 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.996 -8.862 -0.558 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.937 -7.215 -1.087 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.813 -7.713 1.631 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.715 -5.996 1.061 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.649 -6.242 2.423 1.00 0.00 H new ATOM 973 N VAL A 59 -17.062 -10.972 -4.665 1.00 0.00 N ATOM 974 CA VAL A 59 -17.752 -11.638 -5.765 1.00 0.00 C ATOM 975 C VAL A 59 -17.739 -13.154 -5.524 1.00 0.00 C ATOM 976 O VAL A 59 -18.766 -13.797 -5.740 1.00 0.00 O ATOM 977 CB VAL A 59 -17.242 -11.135 -7.133 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.941 -11.769 -7.613 1.00 0.00 C ATOM 979 CG2 VAL A 59 -18.281 -11.324 -8.238 1.00 0.00 C ATOM 0 H VAL A 59 -16.188 -10.510 -4.917 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.808 -11.371 -5.797 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.050 -10.078 -6.948 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.668 -11.350 -8.581 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -15.149 -11.565 -6.892 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -16.075 -12.846 -7.709 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.879 -10.956 -9.182 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.522 -12.383 -8.334 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -19.184 -10.768 -7.987 1.00 0.00 H new ATOM 989 N SER A 60 -16.639 -13.729 -5.022 1.00 0.00 N ATOM 990 CA SER A 60 -16.546 -15.158 -4.743 1.00 0.00 C ATOM 991 C SER A 60 -17.557 -15.520 -3.649 1.00 0.00 C ATOM 992 O SER A 60 -18.258 -16.525 -3.762 1.00 0.00 O ATOM 993 CB SER A 60 -15.105 -15.509 -4.343 1.00 0.00 C ATOM 994 OG SER A 60 -14.944 -16.903 -4.185 1.00 0.00 O ATOM 0 H SER A 60 -15.789 -13.211 -4.799 1.00 0.00 H new ATOM 0 HA SER A 60 -16.790 -15.742 -5.631 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.415 -15.144 -5.104 1.00 0.00 H new ATOM 0 HB3 SER A 60 -14.850 -15.003 -3.412 1.00 0.00 H new ATOM 0 HG SER A 60 -14.018 -17.099 -3.932 1.00 0.00 H new ATOM 1000 N GLU A 61 -17.704 -14.652 -2.643 1.00 0.00 N ATOM 1001 CA GLU A 61 -18.612 -14.834 -1.517 1.00 0.00 C ATOM 1002 C GLU A 61 -20.093 -14.810 -1.929 1.00 0.00 C ATOM 1003 O GLU A 61 -20.978 -15.062 -1.109 1.00 0.00 O ATOM 1004 CB GLU A 61 -18.356 -13.717 -0.493 1.00 0.00 C ATOM 1005 CG GLU A 61 -18.751 -14.164 0.922 1.00 0.00 C ATOM 1006 CD GLU A 61 -17.740 -15.118 1.574 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -16.688 -15.444 0.969 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.985 -15.517 2.733 1.00 0.00 O ATOM 0 H GLU A 61 -17.177 -13.780 -2.593 1.00 0.00 H new ATOM 0 HA GLU A 61 -18.415 -15.818 -1.093 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.302 -13.439 -0.509 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.924 -12.829 -0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -18.864 -13.283 1.553 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -19.724 -14.654 0.880 1.00 0.00 H new ATOM 1015 N ARG A 62 -20.406 -14.468 -3.185 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.780 -14.408 -3.684 1.00 0.00 C ATOM 1017 C ARG A 62 -22.642 -13.412 -2.894 1.00 0.00 C ATOM 1018 O ARG A 62 -23.870 -13.439 -3.022 1.00 0.00 O ATOM 1019 CB ARG A 62 -22.384 -15.833 -3.635 1.00 0.00 C ATOM 1020 CG ARG A 62 -23.330 -16.125 -4.800 1.00 0.00 C ATOM 1021 CD ARG A 62 -22.517 -16.468 -6.050 1.00 0.00 C ATOM 1022 NE ARG A 62 -23.313 -17.105 -7.111 1.00 0.00 N ATOM 1023 CZ ARG A 62 -22.784 -17.862 -8.083 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -21.474 -18.053 -8.167 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -23.560 -18.431 -8.990 1.00 0.00 N ATOM 0 H ARG A 62 -19.706 -14.224 -3.886 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.766 -14.046 -4.712 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -21.575 -16.564 -3.640 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -22.923 -15.960 -2.696 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.991 -16.953 -4.546 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.964 -15.259 -4.993 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -22.067 -15.556 -6.442 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -21.700 -17.133 -5.771 1.00 0.00 H new ATOM 0 HE ARG A 62 -24.323 -16.963 -7.107 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -20.851 -17.621 -7.485 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -21.090 -18.632 -8.914 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -24.570 -18.296 -8.954 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -23.148 -19.005 -9.726 1.00 0.00 H new ATOM 1039 N LYS A 63 -22.058 -12.509 -2.102 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.810 -11.552 -1.309 1.00 0.00 C ATOM 1041 C LYS A 63 -22.107 -10.198 -1.256 1.00 0.00 C ATOM 1042 O LYS A 63 -20.908 -10.150 -1.000 1.00 0.00 O ATOM 1043 CB LYS A 63 -23.101 -12.168 0.073 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.875 -12.215 0.977 1.00 0.00 C ATOM 1045 CD LYS A 63 -22.048 -12.991 2.284 1.00 0.00 C ATOM 1046 CE LYS A 63 -23.317 -12.628 3.068 1.00 0.00 C ATOM 1047 NZ LYS A 63 -23.335 -13.274 4.394 1.00 0.00 N ATOM 0 H LYS A 63 -21.047 -12.426 -1.997 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.771 -11.343 -1.779 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -23.885 -11.591 0.564 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -23.486 -13.179 -0.060 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -21.050 -12.658 0.418 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -21.584 -11.193 1.218 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -22.065 -14.058 2.061 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -21.179 -12.812 2.918 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -23.375 -11.546 3.188 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -24.196 -12.933 2.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -24.205 -13.008 4.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -23.304 -14.307 4.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -22.508 -12.963 4.943 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.815 -9.084 -1.505 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.228 -7.754 -1.446 1.00 0.00 C ATOM 1063 C PRO A 64 -22.034 -7.273 0.009 1.00 0.00 C ATOM 1064 O PRO A 64 -21.561 -6.153 0.208 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.214 -6.859 -2.205 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.561 -7.501 -1.877 1.00 0.00 C ATOM 1067 CD PRO A 64 -24.225 -8.988 -1.851 1.00 0.00 C ATOM 0 HA PRO A 64 -21.231 -7.734 -1.886 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.165 -5.824 -1.868 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.016 -6.855 -3.277 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.951 -7.157 -0.919 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.314 -7.269 -2.630 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.841 -9.513 -1.121 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.419 -9.447 -2.820 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.419 -8.059 1.029 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.271 -7.702 2.434 1.00 0.00 C ATOM 1077 C ALA A 65 -21.443 -8.762 3.150 1.00 0.00 C ATOM 1078 O ALA A 65 -21.871 -9.908 3.239 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.641 -7.564 3.098 1.00 0.00 C ATOM 0 H ALA A 65 -22.848 -8.974 0.889 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.758 -6.742 2.502 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.512 -7.297 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -24.213 -6.786 2.593 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.176 -8.511 3.028 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.289 -8.380 3.692 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.369 -9.269 4.402 1.00 0.00 C ATOM 1087 C LEU A 66 -19.221 -8.781 5.831 1.00 0.00 C ATOM 1088 O LEU A 66 -19.242 -7.573 6.068 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.984 -9.229 3.728 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.741 -10.234 2.585 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -17.537 -11.627 3.181 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.846 -10.278 1.516 1.00 0.00 C ATOM 0 H LEU A 66 -19.958 -7.416 3.649 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.760 -10.286 4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.825 -8.224 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.228 -9.396 4.495 1.00 0.00 H new ATOM 0 HG LEU A 66 -16.850 -9.889 2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.364 -12.344 2.379 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -16.675 -11.615 3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -18.426 -11.917 3.742 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.586 -11.013 0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -19.792 -10.556 1.981 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -18.944 -9.296 1.054 1.00 0.00 H new ATOM 1104 N THR A 67 -19.078 -9.693 6.787 1.00 0.00 N ATOM 1105 CA THR A 67 -18.905 -9.325 8.185 1.00 0.00 C ATOM 1106 C THR A 67 -17.532 -8.679 8.334 1.00 0.00 C ATOM 1107 O THR A 67 -16.609 -9.045 7.605 1.00 0.00 O ATOM 1108 CB THR A 67 -19.010 -10.569 9.073 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.973 -11.472 8.558 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.372 -10.193 10.508 1.00 0.00 C ATOM 0 H THR A 67 -19.079 -10.699 6.616 1.00 0.00 H new ATOM 0 HA THR A 67 -19.683 -8.626 8.493 1.00 0.00 H new ATOM 0 HB THR A 67 -18.034 -11.054 9.077 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.862 -11.063 8.603 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.439 -11.096 11.115 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.603 -9.537 10.917 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.332 -9.677 10.518 1.00 0.00 H new ATOM 1118 N MET A 68 -17.399 -7.751 9.283 1.00 0.00 N ATOM 1119 CA MET A 68 -16.165 -7.034 9.572 1.00 0.00 C ATOM 1120 C MET A 68 -15.053 -8.048 9.820 1.00 0.00 C ATOM 1121 O MET A 68 -13.982 -7.933 9.246 1.00 0.00 O ATOM 1122 CB MET A 68 -16.363 -6.075 10.752 1.00 0.00 C ATOM 1123 CG MET A 68 -15.141 -5.177 10.974 1.00 0.00 C ATOM 1124 SD MET A 68 -14.665 -4.150 9.552 1.00 0.00 S ATOM 1125 CE MET A 68 -16.072 -3.015 9.442 1.00 0.00 C ATOM 0 H MET A 68 -18.172 -7.472 9.887 1.00 0.00 H new ATOM 0 HA MET A 68 -15.878 -6.417 8.721 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.241 -5.454 10.571 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.560 -6.650 11.657 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.340 -4.523 11.823 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.293 -5.805 11.248 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.879 -2.270 8.671 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.972 -3.575 9.188 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.213 -2.516 10.401 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.346 -9.077 10.615 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.428 -10.150 10.951 1.00 0.00 C ATOM 1137 C GLU A 69 -13.879 -10.797 9.679 1.00 0.00 C ATOM 1138 O GLU A 69 -12.672 -10.855 9.467 1.00 0.00 O ATOM 1139 CB GLU A 69 -15.216 -11.164 11.794 1.00 0.00 C ATOM 1140 CG GLU A 69 -14.426 -12.447 12.071 1.00 0.00 C ATOM 1141 CD GLU A 69 -15.165 -13.319 13.082 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -16.165 -13.966 12.712 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.767 -13.308 14.273 1.00 0.00 O ATOM 0 H GLU A 69 -16.260 -9.184 11.054 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.572 -9.775 11.511 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.495 -10.703 12.741 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -16.142 -11.417 11.278 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.280 -12.999 11.143 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.436 -12.197 12.452 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.787 -11.252 8.818 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.471 -11.921 7.574 1.00 0.00 C ATOM 1152 C VAL A 70 -13.664 -11.021 6.628 1.00 0.00 C ATOM 1153 O VAL A 70 -12.674 -11.489 6.069 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.769 -12.494 6.964 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.459 -13.362 5.742 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.544 -13.383 7.960 1.00 0.00 C ATOM 0 H VAL A 70 -15.790 -11.159 8.979 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.807 -12.765 7.763 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.375 -11.629 6.693 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.388 -13.755 5.329 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.953 -12.760 4.987 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.815 -14.190 6.038 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.448 -13.761 7.483 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.917 -14.221 8.264 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.815 -12.796 8.837 1.00 0.00 H new ATOM 1166 N VAL A 71 -14.049 -9.757 6.404 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.290 -8.870 5.513 1.00 0.00 C ATOM 1168 C VAL A 71 -11.921 -8.516 6.125 1.00 0.00 C ATOM 1169 O VAL A 71 -10.959 -8.312 5.389 1.00 0.00 O ATOM 1170 CB VAL A 71 -14.141 -7.635 5.112 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.530 -6.721 6.276 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.473 -6.725 4.075 1.00 0.00 C ATOM 0 H VAL A 71 -14.874 -9.329 6.824 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.070 -9.395 4.584 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.027 -8.115 4.696 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.122 -5.886 5.901 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -15.116 -7.285 7.001 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.629 -6.340 6.756 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.132 -5.886 3.849 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.531 -6.349 4.474 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.281 -7.291 3.164 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.835 -8.458 7.452 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.649 -8.120 8.230 1.00 0.00 C ATOM 1184 C CYS A 72 -9.638 -9.241 8.096 1.00 0.00 C ATOM 1185 O CYS A 72 -8.499 -8.972 7.714 1.00 0.00 O ATOM 1186 CB CYS A 72 -11.004 -7.830 9.698 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.547 -7.296 10.647 1.00 0.00 S ATOM 0 H CYS A 72 -12.640 -8.658 8.046 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.207 -7.203 7.840 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.771 -7.056 9.741 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.428 -8.725 10.154 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.893 -7.061 11.878 1.00 0.00 H new ATOM 1193 N ALA A 73 -10.048 -10.483 8.387 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.192 -11.657 8.270 1.00 0.00 C ATOM 1195 C ALA A 73 -8.643 -11.686 6.841 1.00 0.00 C ATOM 1196 O ALA A 73 -7.448 -11.851 6.614 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.984 -12.927 8.591 1.00 0.00 C ATOM 0 H ALA A 73 -10.991 -10.696 8.712 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.367 -11.609 8.981 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.332 -13.795 8.499 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.369 -12.868 9.609 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.816 -13.023 7.893 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.525 -11.443 5.872 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.191 -11.407 4.461 1.00 0.00 C ATOM 1205 C ARG A 74 -8.233 -10.273 4.101 1.00 0.00 C ATOM 1206 O ARG A 74 -7.510 -10.414 3.114 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.506 -11.320 3.679 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.057 -12.731 3.395 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.167 -13.537 2.426 1.00 0.00 C ATOM 1210 NE ARG A 74 -9.390 -14.575 3.124 1.00 0.00 N ATOM 1211 CZ ARG A 74 -9.794 -15.820 3.392 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -10.982 -16.272 2.999 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -8.990 -16.586 4.105 1.00 0.00 N ATOM 0 H ARG A 74 -10.512 -11.263 6.057 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.650 -12.315 4.195 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.237 -10.745 4.247 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.344 -10.790 2.740 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.149 -13.276 4.335 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.060 -12.647 2.975 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.791 -14.003 1.663 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.486 -12.860 1.911 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.452 -14.319 3.433 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.613 -15.663 2.478 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.262 -17.228 3.219 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.095 -16.222 4.431 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.264 -17.542 4.330 1.00 0.00 H new ATOM 1227 N MET A 75 -8.228 -9.154 4.829 1.00 0.00 N ATOM 1228 CA MET A 75 -7.330 -8.045 4.560 1.00 0.00 C ATOM 1229 C MET A 75 -5.954 -8.422 5.108 1.00 0.00 C ATOM 1230 O MET A 75 -4.983 -8.425 4.354 1.00 0.00 O ATOM 1231 CB MET A 75 -7.860 -6.742 5.191 1.00 0.00 C ATOM 1232 CG MET A 75 -7.718 -5.544 4.246 1.00 0.00 C ATOM 1233 SD MET A 75 -8.632 -5.616 2.677 1.00 0.00 S ATOM 1234 CE MET A 75 -10.316 -5.576 3.330 1.00 0.00 C ATOM 0 H MET A 75 -8.851 -8.998 5.622 1.00 0.00 H new ATOM 0 HA MET A 75 -7.260 -7.859 3.488 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.909 -6.870 5.458 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.318 -6.541 6.115 1.00 0.00 H new ATOM 0 HG2 MET A 75 -8.036 -4.650 4.782 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.660 -5.418 4.016 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.787 -6.548 3.181 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.288 -5.345 4.395 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.891 -4.811 2.808 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.867 -8.788 6.396 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.603 -9.159 7.027 1.00 0.00 C ATOM 1246 C VAL A 76 -3.953 -10.342 6.319 1.00 0.00 C ATOM 1247 O VAL A 76 -2.730 -10.406 6.248 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.780 -9.370 8.540 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.569 -10.616 8.936 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.425 -9.361 9.254 1.00 0.00 C ATOM 0 H VAL A 76 -6.671 -8.833 7.022 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.905 -8.329 6.917 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.387 -8.525 8.865 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.637 -10.673 10.022 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.572 -10.562 8.512 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.062 -11.503 8.557 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.576 -9.512 10.323 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.800 -10.162 8.859 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.933 -8.402 9.089 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.739 -11.231 5.710 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.247 -12.395 4.972 1.00 0.00 C ATOM 1262 C ASP A 77 -3.342 -11.965 3.806 1.00 0.00 C ATOM 1263 O ASP A 77 -2.588 -12.779 3.264 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.435 -13.202 4.422 1.00 0.00 C ATOM 1265 CG ASP A 77 -5.937 -14.335 5.315 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -5.293 -14.682 6.333 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -6.960 -14.949 4.937 1.00 0.00 O ATOM 0 H ASP A 77 -5.757 -11.160 5.716 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.665 -13.011 5.657 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.262 -12.516 4.237 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.149 -13.623 3.458 1.00 0.00 H new ATOM 1272 N SER A 78 -3.417 -10.701 3.378 1.00 0.00 N ATOM 1273 CA SER A 78 -2.617 -10.133 2.305 1.00 0.00 C ATOM 1274 C SER A 78 -1.235 -9.689 2.826 1.00 0.00 C ATOM 1275 O SER A 78 -0.391 -9.260 2.036 1.00 0.00 O ATOM 1276 CB SER A 78 -3.404 -8.976 1.661 1.00 0.00 C ATOM 1277 OG SER A 78 -3.175 -8.922 0.264 1.00 0.00 O ATOM 0 H SER A 78 -4.062 -10.026 3.789 1.00 0.00 H new ATOM 0 HA SER A 78 -2.425 -10.886 1.541 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.469 -9.104 1.854 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.109 -8.032 2.118 1.00 0.00 H new ATOM 0 HG SER A 78 -3.686 -8.181 -0.123 1.00 0.00 H new ATOM 1283 N CYS A 79 -0.949 -9.796 4.133 1.00 0.00 N ATOM 1284 CA CYS A 79 0.335 -9.393 4.705 1.00 0.00 C ATOM 1285 C CYS A 79 1.497 -10.308 4.310 1.00 0.00 C ATOM 1286 O CYS A 79 2.631 -10.027 4.691 1.00 0.00 O ATOM 1287 CB CYS A 79 0.256 -9.212 6.233 1.00 0.00 C ATOM 1288 SG CYS A 79 0.145 -10.789 7.127 1.00 0.00 S ATOM 0 H CYS A 79 -1.606 -10.166 4.820 1.00 0.00 H new ATOM 0 HA CYS A 79 0.554 -8.420 4.264 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.136 -8.667 6.575 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.612 -8.600 6.477 1.00 0.00 H new ATOM 0 HG CYS A 79 -1.086 -11.207 7.118 1.00 0.00 H new ATOM 1294 N GLN A 80 1.262 -11.359 3.516 1.00 0.00 N ATOM 1295 CA GLN A 80 2.254 -12.332 3.041 1.00 0.00 C ATOM 1296 C GLN A 80 3.293 -11.755 2.055 1.00 0.00 C ATOM 1297 O GLN A 80 4.001 -12.491 1.367 1.00 0.00 O ATOM 1298 CB GLN A 80 1.521 -13.555 2.465 1.00 0.00 C ATOM 1299 CG GLN A 80 0.689 -14.310 3.511 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.064 -15.464 2.856 1.00 0.00 C ATOM 1301 OE1 GLN A 80 0.498 -16.529 2.619 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -1.334 -15.277 2.540 1.00 0.00 N ATOM 0 H GLN A 80 0.325 -11.565 3.169 1.00 0.00 H new ATOM 0 HA GLN A 80 2.852 -12.633 3.901 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.867 -13.230 1.656 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.252 -14.237 2.030 1.00 0.00 H new ATOM 0 HG2 GLN A 80 1.340 -14.692 4.297 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -0.017 -13.628 3.985 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -1.784 -14.385 2.745 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.863 -16.025 2.092 1.00 0.00 H new ATOM 1311 N THR A 81 3.368 -10.433 2.013 1.00 0.00 N ATOM 1312 CA THR A 81 4.223 -9.542 1.234 1.00 0.00 C ATOM 1313 C THR A 81 5.214 -8.812 2.163 1.00 0.00 C ATOM 1314 O THR A 81 6.139 -8.125 1.733 1.00 0.00 O ATOM 1315 CB THR A 81 3.280 -8.630 0.446 1.00 0.00 C ATOM 1316 OG1 THR A 81 3.864 -8.244 -0.776 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.754 -7.418 1.193 1.00 0.00 C ATOM 0 H THR A 81 2.745 -9.884 2.606 1.00 0.00 H new ATOM 0 HA THR A 81 4.862 -10.067 0.524 1.00 0.00 H new ATOM 0 HB THR A 81 2.398 -9.244 0.266 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.245 -7.663 -1.265 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.097 -6.845 0.539 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.197 -7.745 2.071 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.590 -6.793 1.506 1.00 0.00 H new ATOM 1325 N ALA A 82 5.035 -9.032 3.466 1.00 0.00 N ATOM 1326 CA ALA A 82 5.799 -8.513 4.592 1.00 0.00 C ATOM 1327 C ALA A 82 5.755 -6.986 4.624 1.00 0.00 C ATOM 1328 O ALA A 82 6.731 -6.294 4.334 1.00 0.00 O ATOM 1329 CB ALA A 82 7.214 -9.108 4.593 1.00 0.00 C ATOM 0 H ALA A 82 4.278 -9.636 3.786 1.00 0.00 H new ATOM 0 HA ALA A 82 5.340 -8.831 5.528 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.775 -8.712 5.440 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.152 -10.193 4.674 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.721 -8.842 3.666 1.00 0.00 H new ATOM 1335 N LEU A 83 4.595 -6.465 4.999 1.00 0.00 N ATOM 1336 CA LEU A 83 4.277 -5.045 5.115 1.00 0.00 C ATOM 1337 C LEU A 83 3.904 -4.717 6.556 1.00 0.00 C ATOM 1338 O LEU A 83 3.691 -5.626 7.363 1.00 0.00 O ATOM 1339 CB LEU A 83 3.145 -4.673 4.136 1.00 0.00 C ATOM 1340 CG LEU A 83 1.963 -5.652 4.021 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.152 -5.860 5.292 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.020 -5.185 2.915 1.00 0.00 C ATOM 0 H LEU A 83 3.802 -7.057 5.246 1.00 0.00 H new ATOM 0 HA LEU A 83 5.152 -4.451 4.849 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.750 -3.700 4.430 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.582 -4.553 3.145 1.00 0.00 H new ATOM 0 HG LEU A 83 2.421 -6.616 3.799 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.346 -6.567 5.098 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.799 -6.253 6.076 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.730 -4.908 5.614 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.183 -5.878 2.834 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.645 -4.190 3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.558 -5.153 1.968 1.00 0.00 H new ATOM 1354 N SER A 84 3.855 -3.434 6.897 1.00 0.00 N ATOM 1355 CA SER A 84 3.485 -3.003 8.234 1.00 0.00 C ATOM 1356 C SER A 84 1.957 -3.098 8.373 1.00 0.00 C ATOM 1357 O SER A 84 1.251 -2.904 7.380 1.00 0.00 O ATOM 1358 CB SER A 84 3.970 -1.569 8.443 1.00 0.00 C ATOM 1359 OG SER A 84 5.383 -1.493 8.352 1.00 0.00 O ATOM 0 H SER A 84 4.070 -2.670 6.256 1.00 0.00 H new ATOM 0 HA SER A 84 3.946 -3.637 8.992 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.518 -0.916 7.696 1.00 0.00 H new ATOM 0 HB3 SER A 84 3.645 -1.210 9.419 1.00 0.00 H new ATOM 0 HG SER A 84 5.670 -0.566 8.487 1.00 0.00 H new ATOM 1365 N PRO A 85 1.415 -3.322 9.582 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.027 -3.432 9.795 1.00 0.00 C ATOM 1367 C PRO A 85 -0.760 -2.139 9.420 1.00 0.00 C ATOM 1368 O PRO A 85 -1.911 -2.169 8.977 1.00 0.00 O ATOM 1369 CB PRO A 85 -0.188 -3.792 11.275 1.00 0.00 C ATOM 1370 CG PRO A 85 1.112 -3.335 11.931 1.00 0.00 C ATOM 1371 CD PRO A 85 2.135 -3.556 10.821 1.00 0.00 C ATOM 0 HA PRO A 85 -0.475 -4.192 9.155 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.050 -3.289 11.713 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -0.343 -4.863 11.407 1.00 0.00 H new ATOM 0 HG2 PRO A 85 1.066 -2.290 12.239 1.00 0.00 H new ATOM 0 HG3 PRO A 85 1.345 -3.920 12.821 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.978 -2.872 10.921 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.540 -4.567 10.855 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.086 -0.998 9.551 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.622 0.309 9.228 1.00 0.00 C ATOM 1381 C GLY A 86 -0.795 0.464 7.724 1.00 0.00 C ATOM 1382 O GLY A 86 -1.579 1.311 7.318 1.00 0.00 O ATOM 0 H GLY A 86 0.874 -0.964 9.895 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.582 0.447 9.725 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.046 1.084 9.604 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.074 -0.298 6.887 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.244 -0.201 5.440 1.00 0.00 C ATOM 1388 C GLU A 87 -1.644 -0.739 5.143 1.00 0.00 C ATOM 1389 O GLU A 87 -2.416 -0.101 4.440 1.00 0.00 O ATOM 1390 CB GLU A 87 0.822 -0.998 4.660 1.00 0.00 C ATOM 1391 CG GLU A 87 2.219 -0.367 4.734 1.00 0.00 C ATOM 1392 CD GLU A 87 3.277 -1.179 3.973 1.00 0.00 C ATOM 1393 OE1 GLU A 87 3.186 -1.315 2.726 1.00 0.00 O ATOM 1394 OE2 GLU A 87 4.240 -1.663 4.608 1.00 0.00 O ATOM 0 H GLU A 87 0.623 -0.979 7.188 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.124 0.833 5.118 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.867 -2.014 5.053 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.519 -1.073 3.616 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.179 0.643 4.326 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.518 -0.277 5.778 1.00 0.00 H new ATOM 1401 N MET A 88 -1.996 -1.888 5.734 1.00 0.00 N ATOM 1402 CA MET A 88 -3.295 -2.524 5.555 1.00 0.00 C ATOM 1403 C MET A 88 -4.422 -1.558 5.934 1.00 0.00 C ATOM 1404 O MET A 88 -5.412 -1.438 5.205 1.00 0.00 O ATOM 1405 CB MET A 88 -3.354 -3.817 6.392 1.00 0.00 C ATOM 1406 CG MET A 88 -4.393 -4.800 5.822 1.00 0.00 C ATOM 1407 SD MET A 88 -4.054 -5.351 4.125 1.00 0.00 S ATOM 1408 CE MET A 88 -2.484 -6.224 4.363 1.00 0.00 C ATOM 0 H MET A 88 -1.374 -2.404 6.357 1.00 0.00 H new ATOM 0 HA MET A 88 -3.430 -2.786 4.506 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.372 -4.289 6.407 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.606 -3.574 7.424 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.443 -5.674 6.472 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.375 -4.327 5.848 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.115 -6.577 3.400 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.754 -5.546 4.805 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.638 -7.075 5.027 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.256 -0.874 7.070 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.194 0.100 7.610 1.00 0.00 C ATOM 1420 C GLU A 89 -5.322 1.280 6.657 1.00 0.00 C ATOM 1421 O GLU A 89 -6.424 1.634 6.243 1.00 0.00 O ATOM 1422 CB GLU A 89 -4.681 0.569 8.976 1.00 0.00 C ATOM 1423 CG GLU A 89 -5.627 1.546 9.690 1.00 0.00 C ATOM 1424 CD GLU A 89 -4.981 2.068 10.975 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -4.144 3.002 10.908 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -5.228 1.510 12.067 1.00 0.00 O ATOM 0 H GLU A 89 -3.431 -0.992 7.657 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.178 -0.354 7.726 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.524 -0.301 9.613 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.711 1.048 8.845 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.865 2.380 9.030 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.567 1.047 9.924 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.192 1.889 6.297 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.158 3.026 5.393 1.00 0.00 C ATOM 1435 C LYS A 90 -4.786 2.670 4.061 1.00 0.00 C ATOM 1436 O LYS A 90 -5.437 3.519 3.469 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.734 3.551 5.245 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.441 4.352 6.519 1.00 0.00 C ATOM 1439 CD LYS A 90 -1.027 4.903 6.509 1.00 0.00 C ATOM 1440 CE LYS A 90 -0.777 5.767 7.750 1.00 0.00 C ATOM 1441 NZ LYS A 90 -1.597 6.996 7.766 1.00 0.00 N ATOM 0 H LYS A 90 -3.272 1.601 6.630 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.753 3.834 5.818 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.026 2.730 5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.641 4.180 4.359 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.153 5.173 6.607 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.579 3.714 7.392 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.311 4.082 6.481 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.868 5.496 5.608 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.991 5.181 8.644 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.278 6.039 7.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.249 7.636 8.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.531 7.469 6.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.589 6.749 7.959 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.644 1.429 3.598 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.209 1.037 2.318 1.00 0.00 C ATOM 1457 C HIS A 91 -6.726 0.902 2.382 1.00 0.00 C ATOM 1458 O HIS A 91 -7.389 1.215 1.393 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.584 -0.268 1.820 1.00 0.00 C ATOM 1460 CG HIS A 91 -3.108 -0.217 1.525 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -2.264 -1.304 1.537 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -2.354 0.890 1.243 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -1.028 -0.867 1.270 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -1.031 0.458 1.062 1.00 0.00 N ATOM 0 H HIS A 91 -4.146 0.687 4.089 1.00 0.00 H new ATOM 0 HA HIS A 91 -4.975 1.832 1.610 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.759 -1.041 2.568 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.106 -0.576 0.914 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -2.533 -2.271 1.717 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.711 1.907 1.173 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -0.150 -1.494 1.228 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.299 0.383 3.476 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.747 0.247 3.565 1.00 0.00 C ATOM 1474 C LEU A 92 -9.389 1.615 3.780 1.00 0.00 C ATOM 1475 O LEU A 92 -10.403 1.887 3.139 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.178 -0.858 4.545 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.716 -0.764 6.010 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -9.691 0.018 6.898 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -8.513 -2.166 6.587 1.00 0.00 C ATOM 0 H LEU A 92 -6.787 0.057 4.296 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.136 -0.114 2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.267 -0.896 4.543 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -8.825 -1.810 4.147 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.774 -0.216 6.005 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.309 0.049 7.918 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -9.794 1.035 6.518 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.664 -0.473 6.890 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -8.186 -2.089 7.624 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -9.452 -2.717 6.543 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -7.756 -2.692 6.006 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.805 2.495 4.607 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.400 3.815 4.807 1.00 0.00 C ATOM 1493 C VAL A 93 -9.257 4.612 3.506 1.00 0.00 C ATOM 1494 O VAL A 93 -10.214 5.256 3.110 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.855 4.523 6.067 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.367 4.866 5.983 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -9.636 5.809 6.372 1.00 0.00 C ATOM 0 H VAL A 93 -7.948 2.321 5.132 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.465 3.721 5.019 1.00 0.00 H new ATOM 0 HB VAL A 93 -8.988 3.800 6.872 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.055 5.361 6.903 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -6.790 3.951 5.849 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.194 5.531 5.137 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.226 6.281 7.265 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.552 6.494 5.528 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -10.685 5.566 6.540 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.123 4.530 2.800 1.00 0.00 N ATOM 1508 CA LEU A 94 -7.867 5.226 1.538 1.00 0.00 C ATOM 1509 C LEU A 94 -8.973 4.939 0.527 1.00 0.00 C ATOM 1510 O LEU A 94 -9.579 5.847 -0.041 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.513 4.733 0.996 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.247 4.960 -0.497 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.216 6.441 -0.884 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.890 4.342 -0.828 1.00 0.00 C ATOM 0 H LEU A 94 -7.334 3.958 3.103 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.845 6.303 1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.721 5.223 1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.434 3.665 1.197 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.062 4.500 -1.056 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.024 6.534 -1.953 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.176 6.899 -0.647 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.426 6.946 -0.328 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.672 4.488 -1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.116 4.821 -0.229 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.912 3.275 -0.606 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.211 3.656 0.275 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.219 3.226 -0.676 1.00 0.00 C ATOM 1528 C LEU A 95 -11.609 3.673 -0.227 1.00 0.00 C ATOM 1529 O LEU A 95 -12.388 4.105 -1.070 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.078 1.711 -0.878 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.426 1.312 -2.217 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -8.078 2.010 -2.475 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.187 -0.203 -2.211 1.00 0.00 C ATOM 0 H LEU A 95 -8.710 2.890 0.725 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.072 3.699 -1.647 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.485 1.300 -0.061 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.066 1.254 -0.817 1.00 0.00 H new ATOM 0 HG LEU A 95 -10.109 1.621 -3.008 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.676 1.683 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -8.225 3.090 -2.493 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.377 1.752 -1.681 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.726 -0.502 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -8.527 -0.464 -1.384 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.139 -0.721 -2.093 1.00 0.00 H new ATOM 1545 N ALA A 96 -11.926 3.597 1.066 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.223 4.015 1.590 1.00 0.00 C ATOM 1547 C ALA A 96 -13.375 5.542 1.657 1.00 0.00 C ATOM 1548 O ALA A 96 -14.505 6.036 1.696 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.407 3.396 2.976 1.00 0.00 C ATOM 0 H ALA A 96 -11.288 3.243 1.779 1.00 0.00 H new ATOM 0 HA ALA A 96 -13.997 3.665 0.907 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.372 3.698 3.384 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.370 2.309 2.897 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.611 3.739 3.636 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.274 6.289 1.650 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.215 7.740 1.713 1.00 0.00 C ATOM 1557 C GLU A 97 -12.534 8.314 0.335 1.00 0.00 C ATOM 1558 O GLU A 97 -13.417 9.164 0.198 1.00 0.00 O ATOM 1559 CB GLU A 97 -10.819 8.173 2.202 1.00 0.00 C ATOM 1560 CG GLU A 97 -10.587 9.686 2.291 1.00 0.00 C ATOM 1561 CD GLU A 97 -11.373 10.343 3.428 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -12.559 10.694 3.217 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -10.788 10.545 4.521 1.00 0.00 O ATOM 0 H GLU A 97 -11.346 5.869 1.597 1.00 0.00 H new ATOM 0 HA GLU A 97 -12.952 8.123 2.419 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -10.648 7.739 3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.071 7.748 1.532 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -9.523 9.878 2.433 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.871 10.148 1.345 1.00 0.00 H new ATOM 1570 N LEU A 98 -11.830 7.839 -0.694 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.018 8.307 -2.058 1.00 0.00 C ATOM 1572 C LEU A 98 -13.251 7.673 -2.700 1.00 0.00 C ATOM 1573 O LEU A 98 -13.837 8.255 -3.619 1.00 0.00 O ATOM 1574 CB LEU A 98 -10.786 7.933 -2.904 1.00 0.00 C ATOM 1575 CG LEU A 98 -9.420 8.422 -2.376 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.326 7.853 -3.282 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.281 9.941 -2.317 1.00 0.00 C ATOM 0 H LEU A 98 -11.114 7.119 -0.599 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.153 9.388 -2.023 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.749 6.847 -2.994 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.927 8.331 -3.909 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.330 8.070 -1.348 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.350 8.186 -2.928 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.367 6.764 -3.262 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.480 8.203 -4.303 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.294 10.201 -1.936 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.405 10.357 -3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.045 10.351 -1.656 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.643 6.475 -2.252 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.771 5.721 -2.789 1.00 0.00 C ATOM 1591 C LEU A 99 -15.770 5.347 -1.674 1.00 0.00 C ATOM 1592 O LEU A 99 -15.995 4.156 -1.438 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.254 4.480 -3.569 1.00 0.00 C ATOM 1594 CG LEU A 99 -12.917 4.586 -4.340 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.547 3.204 -4.889 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -12.947 5.597 -5.489 1.00 0.00 C ATOM 0 H LEU A 99 -13.170 5.995 -1.487 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.319 6.348 -3.493 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.160 3.659 -2.858 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.025 4.195 -4.284 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.171 4.946 -3.631 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -11.605 3.269 -5.434 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.440 2.501 -4.063 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.332 2.857 -5.561 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.975 5.616 -5.982 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -13.714 5.308 -6.208 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -13.174 6.588 -5.096 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.414 6.315 -0.991 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.374 6.014 0.074 1.00 0.00 C ATOM 1610 C PRO A 100 -18.608 5.301 -0.483 1.00 0.00 C ATOM 1611 O PRO A 100 -19.267 4.509 0.197 1.00 0.00 O ATOM 1612 CB PRO A 100 -17.710 7.359 0.726 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.444 8.372 -0.387 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.277 7.753 -1.153 1.00 0.00 C ATOM 0 HA PRO A 100 -16.962 5.328 0.814 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.746 7.394 1.062 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.086 7.549 1.599 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.317 8.507 -1.025 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.187 9.352 0.014 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.309 8.032 -2.206 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.322 8.102 -0.759 1.00 0.00 H new ATOM 1622 N ASP A 101 -18.920 5.576 -1.747 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.035 4.965 -2.434 1.00 0.00 C ATOM 1624 C ASP A 101 -19.731 3.499 -2.730 1.00 0.00 C ATOM 1625 O ASP A 101 -20.664 2.698 -2.812 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.318 5.701 -3.740 1.00 0.00 C ATOM 1627 CG ASP A 101 -19.286 5.402 -4.819 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -18.191 6.015 -4.801 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -19.580 4.557 -5.697 1.00 0.00 O ATOM 0 H ASP A 101 -18.396 6.236 -2.321 1.00 0.00 H new ATOM 0 HA ASP A 101 -20.913 5.027 -1.791 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -21.308 5.422 -4.102 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -20.339 6.774 -3.550 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.452 3.139 -2.879 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.058 1.778 -3.173 1.00 0.00 C ATOM 1636 C TRP A 102 -17.874 0.960 -1.900 1.00 0.00 C ATOM 1637 O TRP A 102 -18.334 -0.177 -1.867 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.777 1.751 -4.017 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.440 0.396 -4.557 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.325 -0.418 -5.166 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.205 -0.377 -4.460 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.724 -1.601 -5.515 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.413 -1.639 -5.096 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -13.948 -0.167 -3.854 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.424 -2.633 -5.138 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.958 -1.167 -3.864 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.198 -2.403 -4.494 1.00 0.00 C ATOM 0 H TRP A 102 -17.670 3.789 -2.797 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.864 1.323 -3.749 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.886 2.447 -4.849 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -15.945 2.108 -3.410 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.360 -0.174 -5.353 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.189 -2.356 -6.020 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.742 0.778 -3.374 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.603 -3.562 -5.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.007 -0.985 -3.385 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.440 -3.173 -4.482 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.198 1.501 -0.881 1.00 0.00 N ATOM 1659 CA LEU A 103 -16.939 0.833 0.391 1.00 0.00 C ATOM 1660 C LEU A 103 -17.588 1.645 1.494 1.00 0.00 C ATOM 1661 O LEU A 103 -17.314 2.833 1.638 1.00 0.00 O ATOM 1662 CB LEU A 103 -15.431 0.764 0.662 1.00 0.00 C ATOM 1663 CG LEU A 103 -14.959 0.078 1.954 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -15.625 -1.275 2.190 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -13.441 -0.166 1.878 1.00 0.00 C ATOM 0 H LEU A 103 -16.807 2.442 -0.923 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.342 -0.179 0.356 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -14.964 0.250 -0.178 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -15.046 1.784 0.666 1.00 0.00 H new ATOM 0 HG LEU A 103 -15.229 0.745 2.773 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -15.250 -1.708 3.117 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -16.704 -1.142 2.262 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -15.397 -1.943 1.359 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.104 -0.652 2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.218 -0.805 1.024 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.925 0.787 1.763 1.00 0.00 H new ATOM 1677 N SER A 104 -18.418 0.985 2.277 1.00 0.00 N ATOM 1678 CA SER A 104 -19.147 1.545 3.401 1.00 0.00 C ATOM 1679 C SER A 104 -19.382 0.427 4.422 1.00 0.00 C ATOM 1680 O SER A 104 -19.288 -0.759 4.086 1.00 0.00 O ATOM 1681 CB SER A 104 -20.445 2.145 2.860 1.00 0.00 C ATOM 1682 OG SER A 104 -20.290 3.528 2.609 1.00 0.00 O ATOM 0 H SER A 104 -18.613 -0.007 2.141 1.00 0.00 H new ATOM 0 HA SER A 104 -18.598 2.339 3.908 1.00 0.00 H new ATOM 0 HB2 SER A 104 -20.733 1.634 1.941 1.00 0.00 H new ATOM 0 HB3 SER A 104 -21.251 1.989 3.577 1.00 0.00 H new ATOM 0 HG SER A 104 -19.902 3.657 1.718 1.00 0.00 H new ATOM 1688 N LEU A 105 -19.696 0.767 5.674 1.00 0.00 N ATOM 1689 CA LEU A 105 -19.930 -0.210 6.735 1.00 0.00 C ATOM 1690 C LEU A 105 -21.186 0.134 7.518 1.00 0.00 C ATOM 1691 O LEU A 105 -21.587 1.291 7.602 1.00 0.00 O ATOM 1692 CB LEU A 105 -18.674 -0.364 7.612 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.419 0.817 8.573 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -18.951 0.516 9.983 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -16.922 1.110 8.667 1.00 0.00 C ATOM 0 H LEU A 105 -19.795 1.735 5.980 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.114 -1.189 6.293 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -18.764 -1.280 8.197 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -17.806 -0.484 6.964 1.00 0.00 H new ATOM 0 HG LEU A 105 -18.946 1.683 8.172 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -18.756 1.367 10.635 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.025 0.334 9.936 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -18.451 -0.367 10.380 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.757 1.945 9.348 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -16.401 0.228 9.041 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -16.539 1.366 7.679 1.00 0.00 H new ATOM 1707 N HIS A 106 -21.820 -0.880 8.096 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.045 -0.757 8.865 1.00 0.00 C ATOM 1709 C HIS A 106 -22.933 -1.640 10.107 1.00 0.00 C ATOM 1710 O HIS A 106 -22.943 -2.873 10.006 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.244 -1.147 7.981 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.659 -0.099 6.967 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.849 0.597 6.972 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.962 0.299 5.856 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.864 1.403 5.896 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.730 1.259 5.189 1.00 0.00 N ATOM 0 H HIS A 106 -21.481 -1.840 8.038 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.201 0.271 9.192 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -24.001 -2.068 7.451 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.096 -1.365 8.625 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -22.992 -0.064 5.550 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -26.672 2.071 5.637 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -24.479 1.753 4.333 1.00 0.00 H new ATOM 1724 N ARG A 107 -22.751 -1.022 11.280 1.00 0.00 N ATOM 1725 CA ARG A 107 -22.656 -1.747 12.546 1.00 0.00 C ATOM 1726 C ARG A 107 -24.077 -2.083 12.987 1.00 0.00 C ATOM 1727 O ARG A 107 -24.943 -1.206 12.963 1.00 0.00 O ATOM 1728 CB ARG A 107 -21.852 -0.953 13.589 1.00 0.00 C ATOM 1729 CG ARG A 107 -21.356 -1.878 14.716 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.126 -1.759 16.026 1.00 0.00 C ATOM 1731 NE ARG A 107 -21.725 -0.578 16.807 1.00 0.00 N ATOM 1732 CZ ARG A 107 -21.080 -0.599 17.979 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -20.471 -1.686 18.439 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -21.048 0.494 18.720 1.00 0.00 N ATOM 0 H ARG A 107 -22.666 -0.010 11.375 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.100 -2.677 12.427 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -21.002 -0.469 13.108 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -22.473 -0.162 14.009 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.412 -2.910 14.371 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -20.305 -1.662 14.908 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -23.194 -1.705 15.813 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -21.965 -2.657 16.622 1.00 0.00 H new ATOM 0 HE ARG A 107 -21.959 0.337 16.421 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -20.484 -2.547 17.893 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -19.990 -1.659 19.338 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -21.512 1.343 18.397 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.559 0.489 19.615 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.320 -3.327 13.391 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.611 -3.858 13.813 1.00 0.00 C ATOM 1750 C ILE A 108 -25.490 -4.400 15.234 1.00 0.00 C ATOM 1751 O ILE A 108 -24.405 -4.768 15.690 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.038 -4.992 12.833 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.732 -4.698 11.347 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.519 -5.394 12.972 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.531 -3.514 10.775 1.00 0.00 C ATOM 0 H ILE A 108 -23.581 -4.029 13.435 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.366 -3.072 13.799 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.414 -5.830 13.142 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.667 -4.493 11.238 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.947 -5.589 10.757 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.749 -6.188 12.261 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.706 -5.749 13.985 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.151 -4.530 12.768 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.264 -3.367 9.728 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.598 -3.724 10.851 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.298 -2.611 11.339 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.635 -4.553 15.902 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.802 -5.065 17.266 1.00 0.00 C ATOM 1769 C ARG A 109 -26.246 -6.474 17.502 1.00 0.00 C ATOM 1770 O ARG A 109 -26.362 -6.996 18.609 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.300 -5.054 17.605 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.132 -6.123 16.862 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.618 -6.062 17.227 1.00 0.00 C ATOM 1774 NE ARG A 109 -30.825 -6.140 18.683 1.00 0.00 N ATOM 1775 CZ ARG A 109 -31.930 -5.819 19.360 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -33.096 -5.714 18.725 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -31.848 -5.581 20.665 1.00 0.00 N ATOM 0 H ARG A 109 -27.529 -4.307 15.478 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.221 -4.409 17.914 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.418 -5.201 18.679 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.705 -4.069 17.372 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.019 -5.985 15.787 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.742 -7.113 17.100 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -31.048 -5.135 16.847 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -31.146 -6.882 16.740 1.00 0.00 H new ATOM 0 HE ARG A 109 -30.037 -6.477 19.236 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -33.146 -5.879 17.720 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -33.939 -5.469 19.244 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -30.947 -5.644 21.139 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -32.686 -5.335 21.192 1.00 0.00 H new ATOM 1791 N THR A 110 -25.717 -7.114 16.468 1.00 0.00 N ATOM 1792 CA THR A 110 -25.176 -8.451 16.522 1.00 0.00 C ATOM 1793 C THR A 110 -23.760 -8.549 15.975 1.00 0.00 C ATOM 1794 O THR A 110 -23.089 -9.521 16.314 1.00 0.00 O ATOM 1795 CB THR A 110 -26.168 -9.333 15.745 1.00 0.00 C ATOM 1796 OG1 THR A 110 -26.008 -10.696 16.056 1.00 0.00 O ATOM 1797 CG2 THR A 110 -26.150 -9.156 14.224 1.00 0.00 C ATOM 0 H THR A 110 -25.654 -6.696 15.540 1.00 0.00 H new ATOM 0 HA THR A 110 -25.074 -8.782 17.556 1.00 0.00 H new ATOM 0 HB THR A 110 -27.142 -8.979 16.083 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.655 -11.226 15.546 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.885 -9.822 13.771 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.394 -8.123 13.975 1.00 0.00 H new ATOM 0 HG23 THR A 110 -25.158 -9.396 13.841 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.336 -7.631 15.102 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.005 -7.635 14.482 1.00 0.00 C ATOM 1807 C ASP A 111 -21.899 -6.426 13.550 1.00 0.00 C ATOM 1808 O ASP A 111 -22.882 -5.716 13.323 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.773 -8.913 13.633 1.00 0.00 C ATOM 1810 CG ASP A 111 -20.321 -9.401 13.653 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.392 -8.560 13.653 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -20.126 -10.640 13.641 1.00 0.00 O ATOM 0 H ASP A 111 -23.918 -6.849 14.800 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.260 -7.602 15.277 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.421 -9.708 14.002 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -22.068 -8.714 12.603 1.00 0.00 H new ATOM 1817 N THR A 112 -20.726 -6.189 12.985 1.00 0.00 N ATOM 1818 CA THR A 112 -20.429 -5.111 12.062 1.00 0.00 C ATOM 1819 C THR A 112 -20.231 -5.748 10.694 1.00 0.00 C ATOM 1820 O THR A 112 -19.669 -6.838 10.596 1.00 0.00 O ATOM 1821 CB THR A 112 -19.174 -4.356 12.531 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.282 -4.016 13.892 1.00 0.00 O ATOM 1823 CG2 THR A 112 -18.941 -3.061 11.744 1.00 0.00 C ATOM 0 H THR A 112 -19.913 -6.777 13.170 1.00 0.00 H new ATOM 0 HA THR A 112 -21.236 -4.380 12.015 1.00 0.00 H new ATOM 0 HB THR A 112 -18.335 -5.031 12.362 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.475 -3.538 14.175 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.043 -2.567 12.114 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.816 -3.295 10.687 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.798 -2.399 11.871 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.664 -5.087 9.620 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.504 -5.625 8.277 1.00 0.00 C ATOM 1833 C TYR A 113 -20.181 -4.490 7.315 1.00 0.00 C ATOM 1834 O TYR A 113 -20.536 -3.337 7.567 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.803 -6.305 7.823 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.382 -7.389 8.715 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -23.134 -7.041 9.854 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.227 -8.746 8.376 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.698 -8.037 10.669 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.781 -9.748 9.191 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.506 -9.399 10.351 1.00 0.00 C ATOM 1842 OH TYR A 113 -24.032 -10.364 11.149 1.00 0.00 O ATOM 0 H TYR A 113 -21.127 -4.179 9.658 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.695 -6.356 8.282 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.561 -5.532 7.700 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.628 -6.739 6.839 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -23.278 -6.000 10.103 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.680 -9.019 7.486 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -24.278 -7.761 11.538 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.652 -10.788 8.929 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.808 -11.246 10.786 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.541 -4.815 6.202 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.164 -3.902 5.137 1.00 0.00 C ATOM 1854 C VAL A 114 -20.097 -4.215 3.975 1.00 0.00 C ATOM 1855 O VAL A 114 -20.420 -5.376 3.724 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.673 -4.081 4.758 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.396 -3.812 3.274 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -16.784 -3.113 5.551 1.00 0.00 C ATOM 0 H VAL A 114 -19.256 -5.775 6.009 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.263 -2.859 5.439 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.444 -5.121 4.991 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.335 -3.954 3.071 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.978 -4.503 2.664 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.679 -2.788 3.031 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -15.742 -3.259 5.266 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.079 -2.087 5.333 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -16.899 -3.305 6.618 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.593 -3.178 3.313 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.450 -3.188 2.162 1.00 0.00 C ATOM 1870 C LYS A 115 -20.542 -2.714 1.040 1.00 0.00 C ATOM 1871 O LYS A 115 -19.919 -1.658 1.188 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.584 -2.176 2.371 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.884 -2.837 2.789 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.111 -3.131 4.269 1.00 0.00 C ATOM 1875 CE LYS A 115 -23.249 -4.327 4.652 1.00 0.00 C ATOM 1876 NZ LYS A 115 -23.959 -5.258 5.544 1.00 0.00 N ATOM 0 H LYS A 115 -20.378 -2.225 3.606 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.902 -4.160 1.964 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.287 -1.454 3.132 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.744 -1.619 1.448 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.702 -2.203 2.448 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -23.965 -3.780 2.248 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -23.848 -2.263 4.874 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.163 -3.344 4.458 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -22.940 -4.855 3.750 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -22.341 -3.977 5.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -23.348 -6.073 5.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -24.202 -4.772 6.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.830 -5.587 5.080 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.442 -3.483 -0.040 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.610 -3.112 -1.165 1.00 0.00 C ATOM 1892 C LEU A 116 -20.323 -3.435 -2.461 1.00 0.00 C ATOM 1893 O LEU A 116 -20.695 -4.587 -2.711 1.00 0.00 O ATOM 1894 CB LEU A 116 -18.255 -3.813 -1.096 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.324 -3.330 -2.224 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.017 -2.821 -1.623 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -17.091 -4.435 -3.263 1.00 0.00 C ATOM 0 H LEU A 116 -20.932 -4.370 -0.154 1.00 0.00 H new ATOM 0 HA LEU A 116 -19.427 -2.038 -1.126 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.791 -3.620 -0.129 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.395 -4.891 -1.172 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.800 -2.505 -2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.358 -2.479 -2.421 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.226 -1.993 -0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -15.532 -3.627 -1.072 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.430 -4.064 -4.047 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.633 -5.298 -2.780 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -18.045 -4.729 -3.702 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.501 -2.412 -3.288 1.00 0.00 N ATOM 1910 CA ASP A 117 -21.160 -2.554 -4.573 1.00 0.00 C ATOM 1911 C ASP A 117 -20.188 -3.219 -5.537 1.00 0.00 C ATOM 1912 O ASP A 117 -19.376 -2.572 -6.199 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.669 -1.199 -5.096 1.00 0.00 C ATOM 1914 CG ASP A 117 -23.141 -0.991 -4.765 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.556 -1.304 -3.630 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -23.887 -0.567 -5.676 1.00 0.00 O ATOM 0 H ASP A 117 -20.191 -1.462 -3.083 1.00 0.00 H new ATOM 0 HA ASP A 117 -22.045 -3.182 -4.471 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.079 -0.394 -4.658 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.527 -1.148 -6.175 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.282 -4.542 -5.666 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.423 -5.312 -6.576 1.00 0.00 C ATOM 1923 C LYS A 118 -19.698 -4.912 -8.038 1.00 0.00 C ATOM 1924 O LYS A 118 -18.921 -5.258 -8.931 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.632 -6.829 -6.397 1.00 0.00 C ATOM 1926 CG LYS A 118 -20.075 -7.272 -4.987 1.00 0.00 C ATOM 1927 CD LYS A 118 -20.196 -8.794 -4.850 1.00 0.00 C ATOM 1928 CE LYS A 118 -21.115 -9.480 -5.880 1.00 0.00 C ATOM 1929 NZ LYS A 118 -22.452 -8.858 -6.032 1.00 0.00 N ATOM 0 H LYS A 118 -20.951 -5.111 -5.147 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.387 -5.081 -6.330 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.379 -7.163 -7.116 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.701 -7.339 -6.644 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -19.358 -6.902 -4.254 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -21.036 -6.814 -4.753 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.200 -9.229 -4.931 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -20.564 -9.024 -3.850 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.616 -9.477 -6.849 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -21.246 -10.523 -5.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -23.000 -9.383 -6.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -22.952 -8.883 -5.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -22.343 -7.871 -6.339 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.819 -4.222 -8.259 1.00 0.00 N ATOM 1944 CA ALA A 119 -21.325 -3.715 -9.512 1.00 0.00 C ATOM 1945 C ALA A 119 -20.563 -2.497 -10.024 1.00 0.00 C ATOM 1946 O ALA A 119 -20.634 -2.240 -11.225 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.791 -3.328 -9.293 1.00 0.00 C ATOM 0 H ALA A 119 -21.444 -3.989 -7.487 1.00 0.00 H new ATOM 0 HA ALA A 119 -21.206 -4.495 -10.264 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -23.207 -2.939 -10.222 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -23.356 -4.206 -8.981 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.854 -2.563 -8.519 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.868 -1.736 -9.169 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.145 -0.563 -9.651 1.00 0.00 C ATOM 1955 C VAL A 120 -18.040 -1.040 -10.588 1.00 0.00 C ATOM 1956 O VAL A 120 -17.369 -2.043 -10.308 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.607 0.315 -8.505 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.138 1.670 -9.031 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -19.680 0.612 -7.457 1.00 0.00 C ATOM 0 H VAL A 120 -19.794 -1.908 -8.166 1.00 0.00 H new ATOM 0 HA VAL A 120 -19.831 0.085 -10.196 1.00 0.00 H new ATOM 0 HB VAL A 120 -17.787 -0.249 -8.061 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.763 2.272 -8.203 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.343 1.521 -9.761 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -18.974 2.186 -9.504 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.256 1.234 -6.668 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.511 1.138 -7.926 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.039 -0.324 -7.028 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.891 -0.362 -11.722 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.896 -0.659 -12.740 1.00 0.00 C ATOM 1971 C ASP A 121 -15.520 -0.393 -12.154 1.00 0.00 C ATOM 1972 O ASP A 121 -15.093 0.755 -12.025 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.144 0.166 -14.009 1.00 0.00 C ATOM 1974 CG ASP A 121 -17.804 -0.652 -15.115 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -18.606 -1.569 -14.813 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -17.519 -0.351 -16.299 1.00 0.00 O ATOM 0 H ASP A 121 -18.480 0.435 -11.963 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.964 -1.706 -13.035 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.776 1.020 -13.766 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.196 0.564 -14.371 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.804 -1.466 -11.811 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.471 -1.359 -11.228 1.00 0.00 C ATOM 1983 C LEU A 122 -12.523 -0.586 -12.149 1.00 0.00 C ATOM 1984 O LEU A 122 -11.582 0.032 -11.671 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.929 -2.755 -10.884 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.117 -2.828 -9.579 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.846 -1.995 -9.573 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.971 -2.503 -8.350 1.00 0.00 C ATOM 0 H LEU A 122 -15.131 -2.425 -11.929 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.540 -0.790 -10.301 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.768 -3.448 -10.813 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -12.301 -3.098 -11.706 1.00 0.00 H new ATOM 0 HG LEU A 122 -11.796 -3.868 -9.525 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.341 -2.109 -8.614 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.186 -2.332 -10.373 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.098 -0.946 -9.728 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.356 -2.567 -7.452 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.373 -1.494 -8.443 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.792 -3.216 -8.279 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.769 -0.602 -13.461 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.970 0.112 -14.441 1.00 0.00 C ATOM 2002 C ALA A 123 -11.970 1.606 -14.094 1.00 0.00 C ATOM 2003 O ALA A 123 -10.910 2.186 -13.874 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.544 -0.140 -15.838 1.00 0.00 C ATOM 0 H ALA A 123 -13.544 -1.122 -13.872 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.939 -0.242 -14.428 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.948 0.394 -16.578 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -12.519 -1.208 -16.054 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.574 0.215 -15.878 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.159 2.215 -13.994 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.314 3.628 -13.669 1.00 0.00 C ATOM 2012 C GLY A 124 -12.732 3.946 -12.295 1.00 0.00 C ATOM 2013 O GLY A 124 -12.164 5.022 -12.097 1.00 0.00 O ATOM 0 H GLY A 124 -14.045 1.731 -14.139 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.817 4.234 -14.426 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.371 3.895 -13.690 1.00 0.00 H new ATOM 2017 N LEU A 125 -12.855 3.015 -11.339 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.318 3.194 -9.994 1.00 0.00 C ATOM 2019 C LEU A 125 -10.794 3.233 -10.082 1.00 0.00 C ATOM 2020 O LEU A 125 -10.190 4.215 -9.656 1.00 0.00 O ATOM 2021 CB LEU A 125 -12.840 2.130 -9.017 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.366 2.196 -8.795 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.808 1.131 -7.787 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -14.817 3.588 -8.326 1.00 0.00 C ATOM 0 H LEU A 125 -13.328 2.123 -11.481 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.666 4.141 -9.582 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.578 1.142 -9.394 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.336 2.249 -8.058 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.842 1.999 -9.755 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.887 1.192 -7.643 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.548 0.142 -8.165 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.304 1.300 -6.835 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -15.897 3.591 -8.182 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.325 3.832 -7.385 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.549 4.330 -9.078 1.00 0.00 H new ATOM 2036 N THR A 126 -10.160 2.211 -10.660 1.00 0.00 N ATOM 2037 CA THR A 126 -8.713 2.169 -10.825 1.00 0.00 C ATOM 2038 C THR A 126 -8.214 3.406 -11.593 1.00 0.00 C ATOM 2039 O THR A 126 -7.178 3.953 -11.218 1.00 0.00 O ATOM 2040 CB THR A 126 -8.355 0.848 -11.524 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.440 -0.202 -10.574 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.962 0.825 -12.165 1.00 0.00 C ATOM 0 H THR A 126 -10.640 1.389 -11.026 1.00 0.00 H new ATOM 0 HA THR A 126 -8.211 2.200 -9.858 1.00 0.00 H new ATOM 0 HB THR A 126 -9.067 0.727 -12.341 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.216 -1.053 -11.006 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.794 -0.144 -12.635 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.895 1.610 -12.918 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.206 0.993 -11.398 1.00 0.00 H new ATOM 2050 N ALA A 127 -8.938 3.870 -12.617 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.571 5.025 -13.424 1.00 0.00 C ATOM 2052 C ALA A 127 -8.470 6.292 -12.571 1.00 0.00 C ATOM 2053 O ALA A 127 -7.402 6.915 -12.489 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.596 5.200 -14.552 1.00 0.00 C ATOM 0 H ALA A 127 -9.815 3.439 -12.910 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.586 4.854 -13.858 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.325 6.064 -15.159 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.606 4.307 -15.176 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.586 5.354 -14.123 1.00 0.00 H new ATOM 2060 N ARG A 128 -9.584 6.691 -11.944 1.00 0.00 N ATOM 2061 CA ARG A 128 -9.632 7.890 -11.106 1.00 0.00 C ATOM 2062 C ARG A 128 -8.619 7.797 -9.967 1.00 0.00 C ATOM 2063 O ARG A 128 -7.930 8.771 -9.667 1.00 0.00 O ATOM 2064 CB ARG A 128 -11.072 8.154 -10.604 1.00 0.00 C ATOM 2065 CG ARG A 128 -11.580 7.167 -9.541 1.00 0.00 C ATOM 2066 CD ARG A 128 -12.939 7.541 -8.961 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.086 7.099 -9.768 1.00 0.00 N ATOM 2068 CZ ARG A 128 -15.341 7.100 -9.292 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -15.615 7.589 -8.088 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.333 6.607 -10.019 1.00 0.00 N ATOM 0 H ARG A 128 -10.472 6.193 -12.004 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.348 8.751 -11.710 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -11.118 9.163 -10.193 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -11.749 8.126 -11.458 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -11.644 6.172 -9.982 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -10.852 7.111 -8.732 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -13.025 7.111 -7.963 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -12.986 8.624 -8.847 1.00 0.00 H new ATOM 0 HE ARG A 128 -13.922 6.780 -10.723 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -14.866 7.971 -7.510 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -16.574 7.582 -7.741 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -16.145 6.224 -10.945 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.285 6.610 -9.652 1.00 0.00 H new ATOM 2084 N LEU A 129 -8.501 6.611 -9.369 1.00 0.00 N ATOM 2085 CA LEU A 129 -7.615 6.336 -8.258 1.00 0.00 C ATOM 2086 C LEU A 129 -6.168 6.570 -8.653 1.00 0.00 C ATOM 2087 O LEU A 129 -5.517 7.399 -8.035 1.00 0.00 O ATOM 2088 CB LEU A 129 -7.868 4.904 -7.769 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.007 4.457 -6.583 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -7.267 5.296 -5.332 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -7.382 3.005 -6.290 1.00 0.00 C ATOM 0 H LEU A 129 -9.040 5.796 -9.660 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.820 7.020 -7.435 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.918 4.813 -7.490 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.698 4.218 -8.599 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.954 4.575 -6.837 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.634 4.942 -4.518 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -7.039 6.341 -5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -8.314 5.204 -5.043 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.793 2.640 -5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.442 2.946 -6.043 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.179 2.392 -7.168 1.00 0.00 H new ATOM 2103 N ALA A 130 -5.679 5.866 -9.676 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.310 5.966 -10.161 1.00 0.00 C ATOM 2105 C ALA A 130 -3.960 7.368 -10.659 1.00 0.00 C ATOM 2106 O ALA A 130 -2.784 7.720 -10.699 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.109 4.929 -11.270 1.00 0.00 C ATOM 0 H ALA A 130 -6.242 5.195 -10.200 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.636 5.767 -9.328 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.087 4.991 -11.645 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.290 3.931 -10.872 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.807 5.127 -12.084 1.00 0.00 H new ATOM 2113 N HIS A 131 -4.950 8.157 -11.092 1.00 0.00 N ATOM 2114 CA HIS A 131 -4.677 9.508 -11.553 1.00 0.00 C ATOM 2115 C HIS A 131 -4.502 10.462 -10.357 1.00 0.00 C ATOM 2116 O HIS A 131 -4.020 11.577 -10.538 1.00 0.00 O ATOM 2117 CB HIS A 131 -5.798 9.959 -12.497 1.00 0.00 C ATOM 2118 CG HIS A 131 -5.423 11.097 -13.420 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -4.774 12.263 -13.081 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -5.663 11.146 -14.764 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -4.651 13.011 -14.185 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -5.162 12.365 -15.251 1.00 0.00 N ATOM 0 H HIS A 131 -5.931 7.882 -11.130 1.00 0.00 H new ATOM 0 HA HIS A 131 -3.740 9.527 -12.110 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.112 9.107 -13.100 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -6.659 10.261 -11.900 1.00 0.00 H new ATOM 0 HD1 HIS A 131 -4.444 12.514 -12.149 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -6.152 10.382 -15.350 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -4.205 13.994 -14.216 1.00 0.00 H new ATOM 2130 N HIS A 132 -4.901 10.059 -9.142 1.00 0.00 N ATOM 2131 CA HIS A 132 -4.798 10.851 -7.916 1.00 0.00 C ATOM 2132 C HIS A 132 -5.397 12.261 -8.076 1.00 0.00 C ATOM 2133 O HIS A 132 -4.918 13.214 -7.461 1.00 0.00 O ATOM 2134 CB HIS A 132 -3.339 10.839 -7.418 1.00 0.00 C ATOM 2135 CG HIS A 132 -2.769 9.445 -7.291 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -1.780 8.889 -8.072 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -3.255 8.449 -6.486 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -1.691 7.588 -7.759 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -2.540 7.281 -6.766 1.00 0.00 N ATOM 0 H HIS A 132 -5.318 9.141 -8.985 1.00 0.00 H new ATOM 0 HA HIS A 132 -5.409 10.391 -7.139 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -2.722 11.417 -8.106 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -3.288 11.336 -6.449 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -1.215 9.380 -8.765 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -4.051 8.549 -5.762 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.028 6.884 -8.240 1.00 0.00 H new ATOM 2147 N VAL A 133 -6.468 12.385 -8.874 1.00 0.00 N ATOM 2148 CA VAL A 133 -7.173 13.633 -9.170 1.00 0.00 C ATOM 2149 C VAL A 133 -7.582 14.388 -7.901 1.00 0.00 C ATOM 2150 O VAL A 133 -7.281 15.574 -7.777 1.00 0.00 O ATOM 2151 CB VAL A 133 -8.355 13.397 -10.138 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -7.856 13.346 -11.587 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -9.154 12.107 -9.867 1.00 0.00 C ATOM 0 H VAL A 133 -6.881 11.582 -9.349 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.471 14.288 -9.686 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.026 14.239 -9.970 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -8.700 13.179 -12.257 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.374 14.290 -11.839 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.139 12.532 -11.697 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -9.963 12.021 -10.592 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.494 11.244 -9.957 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -9.571 12.142 -8.860 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.329 13.744 -7.002 1.00 0.00 N ATOM 2164 CA HIS A 134 -8.788 14.304 -5.728 1.00 0.00 C ATOM 2165 C HIS A 134 -8.150 13.558 -4.545 1.00 0.00 C ATOM 2166 O HIS A 134 -8.681 13.596 -3.436 1.00 0.00 O ATOM 2167 CB HIS A 134 -10.324 14.318 -5.676 1.00 0.00 C ATOM 2168 CG HIS A 134 -10.957 12.949 -5.666 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -11.201 12.172 -4.557 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -11.437 12.273 -6.755 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -11.826 11.060 -4.967 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -11.972 11.056 -6.309 1.00 0.00 N ATOM 0 H HIS A 134 -8.642 12.784 -7.146 1.00 0.00 H new ATOM 0 HA HIS A 134 -8.461 15.341 -5.648 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -10.641 14.858 -4.784 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -10.700 14.873 -6.535 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -11.409 12.617 -7.778 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -12.167 10.272 -4.312 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -12.386 10.320 -6.881 1.00 0.00 H new ATOM 2180 N ALA A 135 -7.111 12.756 -4.807 1.00 0.00 N ATOM 2181 CA ALA A 135 -6.412 11.984 -3.796 1.00 0.00 C ATOM 2182 C ALA A 135 -5.125 12.701 -3.417 1.00 0.00 C ATOM 2183 O ALA A 135 -4.598 13.519 -4.170 1.00 0.00 O ATOM 2184 CB ALA A 135 -6.112 10.574 -4.311 1.00 0.00 C ATOM 0 H ALA A 135 -6.733 12.629 -5.746 1.00 0.00 H new ATOM 0 HA ALA A 135 -7.044 11.891 -2.913 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -5.588 10.009 -3.540 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -7.047 10.070 -4.558 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -5.488 10.637 -5.202 1.00 0.00 H new ATOM 2190 N GLU A 136 -4.581 12.279 -2.287 1.00 0.00 N ATOM 2191 CA GLU A 136 -3.375 12.782 -1.663 1.00 0.00 C ATOM 2192 C GLU A 136 -2.395 11.635 -1.396 1.00 0.00 C ATOM 2193 O GLU A 136 -1.183 11.826 -1.507 1.00 0.00 O ATOM 2194 CB GLU A 136 -3.750 13.584 -0.396 1.00 0.00 C ATOM 2195 CG GLU A 136 -4.547 12.825 0.683 1.00 0.00 C ATOM 2196 CD GLU A 136 -5.962 12.406 0.248 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -6.912 13.211 0.422 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -6.095 11.285 -0.297 1.00 0.00 O ATOM 0 H GLU A 136 -5.002 11.523 -1.747 1.00 0.00 H new ATOM 0 HA GLU A 136 -2.857 13.468 -2.333 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -2.831 13.957 0.057 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.331 14.454 -0.702 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.989 11.934 0.970 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -4.624 13.453 1.571 1.00 0.00 H new ATOM 2205 N GLY A 137 -2.906 10.425 -1.141 1.00 0.00 N ATOM 2206 CA GLY A 137 -2.096 9.244 -0.887 1.00 0.00 C ATOM 2207 C GLY A 137 -2.065 8.905 0.595 1.00 0.00 C ATOM 2208 O GLY A 137 -1.063 9.155 1.273 1.00 0.00 O ATOM 0 H GLY A 137 -3.909 10.244 -1.106 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.495 8.399 -1.448 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.080 9.413 -1.245 1.00 0.00 H new ATOM 2212 N LEU A 138 -3.188 8.400 1.109 1.00 0.00 N ATOM 2213 CA LEU A 138 -3.329 7.988 2.502 1.00 0.00 C ATOM 2214 C LEU A 138 -2.402 6.801 2.698 1.00 0.00 C ATOM 2215 O LEU A 138 -1.529 6.871 3.591 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.795 7.633 2.832 1.00 0.00 C ATOM 2217 CG LEU A 138 -5.559 8.791 3.493 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -5.834 9.891 2.473 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -6.886 8.315 4.086 1.00 0.00 C ATOM 0 H LEU A 138 -4.036 8.265 0.559 1.00 0.00 H new ATOM 0 HA LEU A 138 -3.060 8.797 3.181 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.308 7.343 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.813 6.768 3.495 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.935 9.180 4.298 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.376 10.706 2.954 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.890 10.266 2.079 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.434 9.488 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.402 9.158 4.546 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.508 7.896 3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.695 7.551 4.840 1.00 0.00 H new TER 2231 LEU A 138