USER MOD reduce.3.24.130724 H: found=0, std=0, add=1113, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1113 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 HIS : no HE2:sc= -1.04 X(o=-0.13,f=-0.52) USER MOD Set 1.2: A 128 THR OG1 : rot 82:sc= 0.913 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0687 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 90:sc= 0.506 USER MOD Single : A 21 CYS SG : rot 180:sc= 0.601 USER MOD Single : A 25 MET CE :methyl 169:sc= -0.256 (180deg=-0.395) USER MOD Single : A 28 THR OG1 : rot -26:sc= -0.502 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.186 K(o=-0.19,f=-1) USER MOD Single : A 38 LYS NZ :NH3+ -146:sc= -0.268 (180deg=-1.09) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot -13:sc= 0.748 USER MOD Single : A 44 ASN : amide:sc= 0.463 K(o=0.46,f=-6.5!) USER MOD Single : A 45 LYS NZ :NH3+ -157:sc= -0.0182 (180deg=-0.278) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 HIS : no HD1:sc= -0.431 K(o=-0.43,f=-3.2) USER MOD Single : A 57 MET CE :methyl 180:sc= -1.27 (180deg=-1.27) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 63 HIS : no HD1:sc= -0.0232 X(o=-0.023,f=-0.023) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -103:sc= 0.463 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 HIS : no HD1:sc= -0.451 K(o=-0.45,f=-1.2) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -170:sc= -0.28 USER MOD Single : A 96 ASN : amide:sc= -0.362 K(o=-0.36,f=-2.4!) USER MOD Single : A 101 GLN : amide:sc= -0.67 X(o=-0.67,f=-0.57) USER MOD Single : A 103 CYS SG : rot 160:sc= -0.911 USER MOD Single : A 105 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.052) USER MOD Single : A 107 ASN :FLIP amide:sc= 1.15 F(o=-0.29,f=1.1) USER MOD Single : A 111 THR OG1 : rot 11:sc= 0.814 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot 70:sc= -0.75 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -176:sc= 0.115 (180deg=0.11) USER MOD Single : A 131 TYR OH : rot -50:sc= -1.04! USER MOD Single : A 132 THR OG1 : rot -87:sc= 0.00543 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 31:sc= 0.678 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= -0.669 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.448 12.777 -6.111 1.00 0.00 N ATOM 2 CA GLY A 1 -13.437 14.053 -6.878 1.00 0.00 C ATOM 3 C GLY A 1 -13.390 13.828 -8.377 1.00 0.00 C ATOM 4 O GLY A 1 -13.071 12.733 -8.838 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.358 12.676 -5.617 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.318 11.978 -6.764 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.675 12.784 -5.415 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.327 14.631 -6.628 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.575 14.648 -6.576 1.00 0.00 H new ATOM 10 N SER A 2 -13.711 14.869 -9.139 1.00 0.00 N ATOM 11 CA SER A 2 -13.705 14.780 -10.595 1.00 0.00 C ATOM 12 C SER A 2 -12.860 15.894 -11.204 1.00 0.00 C ATOM 13 O SER A 2 -13.144 16.372 -12.303 1.00 0.00 O ATOM 14 CB SER A 2 -15.132 14.852 -11.138 1.00 0.00 C ATOM 15 OG SER A 2 -15.767 16.058 -10.745 1.00 0.00 O ATOM 0 H SER A 2 -13.978 15.783 -8.773 1.00 0.00 H new ATOM 0 HA SER A 2 -13.267 13.822 -10.873 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.114 14.784 -12.226 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.706 14.000 -10.775 1.00 0.00 H new ATOM 0 HG SER A 2 -16.678 16.081 -11.106 1.00 0.00 H new ATOM 21 N SER A 3 -11.822 16.305 -10.482 1.00 0.00 N ATOM 22 CA SER A 3 -10.936 17.363 -10.952 1.00 0.00 C ATOM 23 C SER A 3 -9.555 16.808 -11.290 1.00 0.00 C ATOM 24 O SER A 3 -8.918 17.243 -12.249 1.00 0.00 O ATOM 25 CB SER A 3 -10.810 18.459 -9.892 1.00 0.00 C ATOM 26 OG SER A 3 -10.640 19.733 -10.492 1.00 0.00 O ATOM 0 H SER A 3 -11.574 15.921 -9.570 1.00 0.00 H new ATOM 0 HA SER A 3 -11.369 17.788 -11.857 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.701 18.466 -9.264 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.962 18.244 -9.241 1.00 0.00 H new ATOM 0 HG SER A 3 -10.564 20.416 -9.793 1.00 0.00 H new ATOM 32 N GLY A 4 -9.101 15.843 -10.496 1.00 0.00 N ATOM 33 CA GLY A 4 -7.800 15.243 -10.729 1.00 0.00 C ATOM 34 C GLY A 4 -7.128 14.799 -9.445 1.00 0.00 C ATOM 35 O GLY A 4 -7.060 13.604 -9.153 1.00 0.00 O ATOM 0 H GLY A 4 -9.610 15.466 -9.696 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.912 14.385 -11.392 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.159 15.960 -11.242 1.00 0.00 H new ATOM 39 N SER A 5 -6.629 15.760 -8.676 1.00 0.00 N ATOM 40 CA SER A 5 -5.957 15.462 -7.416 1.00 0.00 C ATOM 41 C SER A 5 -6.955 14.979 -6.368 1.00 0.00 C ATOM 42 O SER A 5 -8.036 15.550 -6.217 1.00 0.00 O ATOM 43 CB SER A 5 -5.218 16.699 -6.903 1.00 0.00 C ATOM 44 OG SER A 5 -6.126 17.662 -6.395 1.00 0.00 O ATOM 0 H SER A 5 -6.677 16.753 -8.903 1.00 0.00 H new ATOM 0 HA SER A 5 -5.235 14.666 -7.597 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.516 16.409 -6.121 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.632 17.138 -7.711 1.00 0.00 H new ATOM 0 HG SER A 5 -5.629 18.442 -6.072 1.00 0.00 H new ATOM 50 N SER A 6 -6.585 13.926 -5.646 1.00 0.00 N ATOM 51 CA SER A 6 -7.448 13.367 -4.613 1.00 0.00 C ATOM 52 C SER A 6 -6.659 12.453 -3.681 1.00 0.00 C ATOM 53 O SER A 6 -6.637 11.235 -3.863 1.00 0.00 O ATOM 54 CB SER A 6 -8.605 12.593 -5.247 1.00 0.00 C ATOM 55 OG SER A 6 -9.803 12.773 -4.514 1.00 0.00 O ATOM 0 H SER A 6 -5.693 13.443 -5.758 1.00 0.00 H new ATOM 0 HA SER A 6 -7.852 14.193 -4.027 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.750 12.927 -6.274 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.357 11.532 -5.289 1.00 0.00 H new ATOM 0 HG SER A 6 -10.527 12.269 -4.941 1.00 0.00 H new ATOM 61 N GLY A 7 -6.012 13.046 -2.684 1.00 0.00 N ATOM 62 CA GLY A 7 -5.231 12.270 -1.740 1.00 0.00 C ATOM 63 C GLY A 7 -3.874 11.878 -2.292 1.00 0.00 C ATOM 64 O GLY A 7 -3.256 12.639 -3.036 1.00 0.00 O ATOM 0 H GLY A 7 -6.015 14.052 -2.513 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -5.095 12.847 -0.825 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.783 11.370 -1.470 1.00 0.00 H new ATOM 68 N GLU A 8 -3.412 10.685 -1.929 1.00 0.00 N ATOM 69 CA GLU A 8 -2.121 10.193 -2.393 1.00 0.00 C ATOM 70 C GLU A 8 -2.049 8.672 -2.291 1.00 0.00 C ATOM 71 O GLU A 8 -2.604 8.075 -1.368 1.00 0.00 O ATOM 72 CB GLU A 8 -0.988 10.826 -1.581 1.00 0.00 C ATOM 73 CG GLU A 8 -0.305 11.984 -2.291 1.00 0.00 C ATOM 74 CD GLU A 8 0.482 11.537 -3.508 1.00 0.00 C ATOM 75 OE1 GLU A 8 -0.149 11.165 -4.518 1.00 0.00 O ATOM 76 OE2 GLU A 8 1.730 11.562 -3.450 1.00 0.00 O ATOM 0 H GLU A 8 -3.913 10.042 -1.315 1.00 0.00 H new ATOM 0 HA GLU A 8 -2.008 10.474 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -1.387 11.178 -0.630 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -0.245 10.062 -1.352 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -1.056 12.713 -2.596 1.00 0.00 H new ATOM 0 HG3 GLU A 8 0.365 12.489 -1.595 1.00 0.00 H new ATOM 83 N ALA A 9 -1.365 8.051 -3.246 1.00 0.00 N ATOM 84 CA ALA A 9 -1.221 6.600 -3.264 1.00 0.00 C ATOM 85 C ALA A 9 0.248 6.193 -3.205 1.00 0.00 C ATOM 86 O ALA A 9 1.140 7.036 -3.289 1.00 0.00 O ATOM 87 CB ALA A 9 -1.882 6.021 -4.506 1.00 0.00 C ATOM 0 H ALA A 9 -0.901 8.530 -4.018 1.00 0.00 H new ATOM 0 HA ALA A 9 -1.717 6.199 -2.380 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.767 4.937 -4.507 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.942 6.274 -4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.411 6.437 -5.396 1.00 0.00 H new ATOM 93 N LEU A 10 0.490 4.894 -3.061 1.00 0.00 N ATOM 94 CA LEU A 10 1.851 4.372 -2.991 1.00 0.00 C ATOM 95 C LEU A 10 2.614 4.668 -4.278 1.00 0.00 C ATOM 96 O LEU A 10 2.082 5.290 -5.198 1.00 0.00 O ATOM 97 CB LEU A 10 1.830 2.865 -2.733 1.00 0.00 C ATOM 98 CG LEU A 10 1.376 2.452 -1.333 1.00 0.00 C ATOM 99 CD1 LEU A 10 0.845 1.027 -1.342 1.00 0.00 C ATOM 100 CD2 LEU A 10 2.521 2.590 -0.340 1.00 0.00 C ATOM 0 H LEU A 10 -0.238 4.183 -2.990 1.00 0.00 H new ATOM 0 HA LEU A 10 2.361 4.868 -2.165 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.172 2.396 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.831 2.469 -2.905 1.00 0.00 H new ATOM 0 HG LEU A 10 0.569 3.116 -1.023 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.527 0.751 -0.337 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.004 0.959 -2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.631 0.348 -1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.181 2.292 0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.348 1.950 -0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.856 3.627 -0.312 1.00 0.00 H new ATOM 112 N ASP A 11 3.863 4.219 -4.335 1.00 0.00 N ATOM 113 CA ASP A 11 4.700 4.435 -5.509 1.00 0.00 C ATOM 114 C ASP A 11 4.531 3.298 -6.513 1.00 0.00 C ATOM 115 O ASP A 11 3.618 2.481 -6.393 1.00 0.00 O ATOM 116 CB ASP A 11 6.169 4.558 -5.099 1.00 0.00 C ATOM 117 CG ASP A 11 6.880 5.683 -5.825 1.00 0.00 C ATOM 118 OD1 ASP A 11 6.310 6.791 -5.905 1.00 0.00 O ATOM 119 OD2 ASP A 11 8.006 5.456 -6.312 1.00 0.00 O ATOM 0 H ASP A 11 4.318 3.703 -3.582 1.00 0.00 H new ATOM 0 HA ASP A 11 4.385 5.364 -5.984 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.230 4.727 -4.024 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.680 3.617 -5.303 1.00 0.00 H new ATOM 124 N ALA A 12 5.417 3.251 -7.503 1.00 0.00 N ATOM 125 CA ALA A 12 5.367 2.216 -8.528 1.00 0.00 C ATOM 126 C ALA A 12 6.046 0.936 -8.049 1.00 0.00 C ATOM 127 O ALA A 12 5.681 -0.164 -8.464 1.00 0.00 O ATOM 128 CB ALA A 12 6.014 2.713 -9.811 1.00 0.00 C ATOM 0 H ALA A 12 6.179 3.919 -7.617 1.00 0.00 H new ATOM 0 HA ALA A 12 4.320 1.987 -8.728 1.00 0.00 H new ATOM 0 HB1 ALA A 12 5.970 1.930 -10.568 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.482 3.594 -10.169 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.055 2.972 -9.617 1.00 0.00 H new ATOM 134 N ALA A 13 7.037 1.088 -7.177 1.00 0.00 N ATOM 135 CA ALA A 13 7.768 -0.057 -6.643 1.00 0.00 C ATOM 136 C ALA A 13 7.070 -0.632 -5.417 1.00 0.00 C ATOM 137 O ALA A 13 6.918 -1.848 -5.290 1.00 0.00 O ATOM 138 CB ALA A 13 9.195 0.344 -6.302 1.00 0.00 C ATOM 0 H ALA A 13 7.353 1.992 -6.825 1.00 0.00 H new ATOM 0 HA ALA A 13 7.792 -0.832 -7.409 1.00 0.00 H new ATOM 0 HB1 ALA A 13 9.730 -0.518 -5.905 1.00 0.00 H new ATOM 0 HB2 ALA A 13 9.698 0.700 -7.201 1.00 0.00 H new ATOM 0 HB3 ALA A 13 9.181 1.138 -5.555 1.00 0.00 H new ATOM 144 N ALA A 14 6.648 0.247 -4.513 1.00 0.00 N ATOM 145 CA ALA A 14 5.968 -0.175 -3.295 1.00 0.00 C ATOM 146 C ALA A 14 4.698 -0.957 -3.615 1.00 0.00 C ATOM 147 O ALA A 14 4.498 -2.065 -3.118 1.00 0.00 O ATOM 148 CB ALA A 14 5.642 1.032 -2.430 1.00 0.00 C ATOM 0 H ALA A 14 6.766 1.256 -4.602 1.00 0.00 H new ATOM 0 HA ALA A 14 6.639 -0.835 -2.744 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.134 0.703 -1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 14 6.564 1.548 -2.163 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.993 1.711 -2.983 1.00 0.00 H new ATOM 154 N ALA A 15 3.842 -0.372 -4.447 1.00 0.00 N ATOM 155 CA ALA A 15 2.591 -1.013 -4.832 1.00 0.00 C ATOM 156 C ALA A 15 2.848 -2.300 -5.609 1.00 0.00 C ATOM 157 O ALA A 15 2.116 -3.279 -5.466 1.00 0.00 O ATOM 158 CB ALA A 15 1.742 -0.058 -5.657 1.00 0.00 C ATOM 0 H ALA A 15 3.993 0.545 -4.867 1.00 0.00 H new ATOM 0 HA ALA A 15 2.050 -1.272 -3.922 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.810 -0.549 -5.938 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.520 0.832 -5.069 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.287 0.229 -6.557 1.00 0.00 H new ATOM 164 N LEU A 16 3.892 -2.290 -6.432 1.00 0.00 N ATOM 165 CA LEU A 16 4.244 -3.458 -7.233 1.00 0.00 C ATOM 166 C LEU A 16 4.571 -4.652 -6.341 1.00 0.00 C ATOM 167 O LEU A 16 4.318 -5.800 -6.707 1.00 0.00 O ATOM 168 CB LEU A 16 5.436 -3.139 -8.140 1.00 0.00 C ATOM 169 CG LEU A 16 5.076 -2.834 -9.595 1.00 0.00 C ATOM 170 CD1 LEU A 16 6.323 -2.480 -10.390 1.00 0.00 C ATOM 171 CD2 LEU A 16 4.358 -4.019 -10.225 1.00 0.00 C ATOM 0 H LEU A 16 4.508 -1.488 -6.562 1.00 0.00 H new ATOM 0 HA LEU A 16 3.385 -3.717 -7.852 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.970 -2.283 -7.726 1.00 0.00 H new ATOM 0 HB3 LEU A 16 6.124 -3.984 -8.121 1.00 0.00 H new ATOM 0 HG LEU A 16 4.404 -1.976 -9.612 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.048 -2.266 -11.423 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.797 -1.602 -9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.020 -3.318 -10.366 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.109 -3.785 -11.260 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.007 -4.894 -10.197 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.443 -4.227 -9.670 1.00 0.00 H new ATOM 183 N SER A 17 5.135 -4.374 -5.170 1.00 0.00 N ATOM 184 CA SER A 17 5.497 -5.426 -4.226 1.00 0.00 C ATOM 185 C SER A 17 4.267 -6.217 -3.794 1.00 0.00 C ATOM 186 O SER A 17 4.333 -7.431 -3.600 1.00 0.00 O ATOM 187 CB SER A 17 6.188 -4.825 -3.001 1.00 0.00 C ATOM 188 OG SER A 17 6.777 -3.574 -3.311 1.00 0.00 O ATOM 0 H SER A 17 5.351 -3.429 -4.852 1.00 0.00 H new ATOM 0 HA SER A 17 6.186 -6.106 -4.726 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.464 -4.700 -2.196 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.953 -5.511 -2.638 1.00 0.00 H new ATOM 0 HG SER A 17 6.126 -2.858 -3.154 1.00 0.00 H new ATOM 194 N VAL A 18 3.145 -5.521 -3.642 1.00 0.00 N ATOM 195 CA VAL A 18 1.900 -6.158 -3.231 1.00 0.00 C ATOM 196 C VAL A 18 1.236 -6.879 -4.401 1.00 0.00 C ATOM 197 O VAL A 18 0.655 -7.950 -4.232 1.00 0.00 O ATOM 198 CB VAL A 18 0.910 -5.133 -2.648 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.296 -5.836 -2.043 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.598 -4.253 -1.616 1.00 0.00 C ATOM 0 H VAL A 18 3.073 -4.515 -3.797 1.00 0.00 H new ATOM 0 HA VAL A 18 2.158 -6.884 -2.460 1.00 0.00 H new ATOM 0 HB VAL A 18 0.558 -4.495 -3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.983 -5.094 -1.637 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.803 -6.417 -2.814 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.033 -6.501 -1.245 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.883 -3.535 -1.215 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.982 -4.874 -0.806 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.424 -3.719 -2.086 1.00 0.00 H new ATOM 210 N ALA A 19 1.327 -6.282 -5.584 1.00 0.00 N ATOM 211 CA ALA A 19 0.733 -6.865 -6.782 1.00 0.00 C ATOM 212 C ALA A 19 1.414 -8.179 -7.151 1.00 0.00 C ATOM 213 O ALA A 19 0.794 -9.068 -7.735 1.00 0.00 O ATOM 214 CB ALA A 19 0.813 -5.884 -7.940 1.00 0.00 C ATOM 0 H ALA A 19 1.806 -5.395 -5.739 1.00 0.00 H new ATOM 0 HA ALA A 19 -0.315 -7.077 -6.571 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.366 -6.332 -8.828 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.273 -4.973 -7.683 1.00 0.00 H new ATOM 0 HB3 ALA A 19 1.857 -5.643 -8.141 1.00 0.00 H new ATOM 220 N GLU A 20 2.694 -8.295 -6.810 1.00 0.00 N ATOM 221 CA GLU A 20 3.458 -9.501 -7.110 1.00 0.00 C ATOM 222 C GLU A 20 3.259 -10.558 -6.028 1.00 0.00 C ATOM 223 O GLU A 20 3.322 -11.757 -6.299 1.00 0.00 O ATOM 224 CB GLU A 20 4.944 -9.168 -7.247 1.00 0.00 C ATOM 225 CG GLU A 20 5.311 -8.571 -8.597 1.00 0.00 C ATOM 226 CD GLU A 20 6.407 -9.348 -9.301 1.00 0.00 C ATOM 227 OE1 GLU A 20 7.268 -9.924 -8.603 1.00 0.00 O ATOM 228 OE2 GLU A 20 6.403 -9.381 -10.550 1.00 0.00 O ATOM 0 H GLU A 20 3.223 -7.569 -6.326 1.00 0.00 H new ATOM 0 HA GLU A 20 3.094 -9.904 -8.055 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.225 -8.468 -6.461 1.00 0.00 H new ATOM 0 HB3 GLU A 20 5.527 -10.075 -7.089 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.425 -8.545 -9.231 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.634 -7.539 -8.458 1.00 0.00 H new ATOM 235 N CYS A 21 3.019 -10.106 -4.800 1.00 0.00 N ATOM 236 CA CYS A 21 2.813 -11.015 -3.679 1.00 0.00 C ATOM 237 C CYS A 21 1.382 -11.545 -3.662 1.00 0.00 C ATOM 238 O CYS A 21 1.154 -12.743 -3.496 1.00 0.00 O ATOM 239 CB CYS A 21 3.127 -10.309 -2.358 1.00 0.00 C ATOM 240 SG CYS A 21 4.213 -11.249 -1.259 1.00 0.00 S ATOM 0 H CYS A 21 2.963 -9.117 -4.557 1.00 0.00 H new ATOM 0 HA CYS A 21 3.491 -11.860 -3.800 1.00 0.00 H new ATOM 0 HB2 CYS A 21 3.591 -9.347 -2.574 1.00 0.00 H new ATOM 0 HB3 CYS A 21 2.192 -10.102 -1.838 1.00 0.00 H new ATOM 0 HG CYS A 21 4.430 -10.566 -0.175 1.00 0.00 H new ATOM 246 N VAL A 22 0.420 -10.643 -3.835 1.00 0.00 N ATOM 247 CA VAL A 22 -0.990 -11.016 -3.839 1.00 0.00 C ATOM 248 C VAL A 22 -1.274 -12.098 -4.878 1.00 0.00 C ATOM 249 O VAL A 22 -2.192 -12.902 -4.717 1.00 0.00 O ATOM 250 CB VAL A 22 -1.891 -9.796 -4.120 1.00 0.00 C ATOM 251 CG1 VAL A 22 -1.591 -9.213 -5.493 1.00 0.00 C ATOM 252 CG2 VAL A 22 -3.362 -10.174 -4.000 1.00 0.00 C ATOM 0 H VAL A 22 0.592 -9.647 -3.974 1.00 0.00 H new ATOM 0 HA VAL A 22 -1.217 -11.406 -2.847 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.676 -9.032 -3.373 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.237 -8.353 -5.672 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.548 -8.898 -5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -1.773 -9.969 -6.257 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.980 -9.299 -4.202 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.596 -10.958 -4.720 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.564 -10.536 -2.992 1.00 0.00 H new ATOM 262 N GLU A 23 -0.481 -12.112 -5.944 1.00 0.00 N ATOM 263 CA GLU A 23 -0.648 -13.093 -7.010 1.00 0.00 C ATOM 264 C GLU A 23 0.002 -14.425 -6.639 1.00 0.00 C ATOM 265 O GLU A 23 -0.376 -15.475 -7.158 1.00 0.00 O ATOM 266 CB GLU A 23 -0.050 -12.563 -8.315 1.00 0.00 C ATOM 267 CG GLU A 23 -1.088 -12.289 -9.392 1.00 0.00 C ATOM 268 CD GLU A 23 -1.130 -13.373 -10.451 1.00 0.00 C ATOM 269 OE1 GLU A 23 -1.066 -14.565 -10.084 1.00 0.00 O ATOM 270 OE2 GLU A 23 -1.226 -13.030 -11.648 1.00 0.00 O ATOM 0 H GLU A 23 0.284 -11.454 -6.093 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.716 -13.262 -7.149 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.497 -11.644 -8.107 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.673 -13.286 -8.694 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -2.071 -12.200 -8.930 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.871 -11.332 -9.866 1.00 0.00 H new ATOM 277 N ARG A 24 0.984 -14.375 -5.743 1.00 0.00 N ATOM 278 CA ARG A 24 1.684 -15.580 -5.311 1.00 0.00 C ATOM 279 C ARG A 24 1.003 -16.205 -4.097 1.00 0.00 C ATOM 280 O ARG A 24 1.001 -17.425 -3.935 1.00 0.00 O ATOM 281 CB ARG A 24 3.143 -15.256 -4.982 1.00 0.00 C ATOM 282 CG ARG A 24 3.989 -14.954 -6.208 1.00 0.00 C ATOM 283 CD ARG A 24 5.468 -15.165 -5.930 1.00 0.00 C ATOM 284 NE ARG A 24 6.213 -15.480 -7.148 1.00 0.00 N ATOM 285 CZ ARG A 24 7.534 -15.364 -7.258 1.00 0.00 C ATOM 286 NH1 ARG A 24 8.260 -14.943 -6.230 1.00 0.00 N ATOM 287 NH2 ARG A 24 8.133 -15.671 -8.402 1.00 0.00 N ATOM 0 H ARG A 24 1.312 -13.515 -5.303 1.00 0.00 H new ATOM 0 HA ARG A 24 1.653 -16.299 -6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 24 3.174 -14.399 -4.309 1.00 0.00 H new ATOM 0 HB3 ARG A 24 3.582 -16.098 -4.446 1.00 0.00 H new ATOM 0 HG2 ARG A 24 3.678 -15.595 -7.033 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.820 -13.924 -6.523 1.00 0.00 H new ATOM 0 HD2 ARG A 24 5.883 -14.267 -5.473 1.00 0.00 H new ATOM 0 HD3 ARG A 24 5.590 -15.974 -5.210 1.00 0.00 H new ATOM 0 HE ARG A 24 5.690 -15.808 -7.960 1.00 0.00 H new ATOM 0 HH11 ARG A 24 7.806 -14.706 -5.348 1.00 0.00 H new ATOM 0 HH12 ARG A 24 9.272 -14.857 -6.322 1.00 0.00 H new ATOM 0 HH21 ARG A 24 7.581 -15.995 -9.196 1.00 0.00 H new ATOM 0 HH22 ARG A 24 9.146 -15.582 -8.487 1.00 0.00 H new ATOM 301 N MET A 25 0.426 -15.362 -3.245 1.00 0.00 N ATOM 302 CA MET A 25 -0.255 -15.837 -2.047 1.00 0.00 C ATOM 303 C MET A 25 -1.701 -16.220 -2.352 1.00 0.00 C ATOM 304 O MET A 25 -2.289 -17.059 -1.669 1.00 0.00 O ATOM 305 CB MET A 25 -0.220 -14.764 -0.956 1.00 0.00 C ATOM 306 CG MET A 25 -0.983 -13.500 -1.318 1.00 0.00 C ATOM 307 SD MET A 25 -1.694 -12.683 0.123 1.00 0.00 S ATOM 308 CE MET A 25 -0.225 -12.388 1.104 1.00 0.00 C ATOM 0 H MET A 25 0.417 -14.349 -3.363 1.00 0.00 H new ATOM 0 HA MET A 25 0.268 -16.725 -1.693 1.00 0.00 H new ATOM 0 HB2 MET A 25 -0.636 -15.178 -0.038 1.00 0.00 H new ATOM 0 HB3 MET A 25 0.818 -14.504 -0.747 1.00 0.00 H new ATOM 0 HG2 MET A 25 -0.312 -12.809 -1.829 1.00 0.00 H new ATOM 0 HG3 MET A 25 -1.779 -13.749 -2.020 1.00 0.00 H new ATOM 0 HE1 MET A 25 -0.468 -11.720 1.931 1.00 0.00 H new ATOM 0 HE2 MET A 25 0.145 -13.334 1.498 1.00 0.00 H new ATOM 0 HE3 MET A 25 0.543 -11.929 0.481 1.00 0.00 H new ATOM 318 N ALA A 26 -2.270 -15.598 -3.381 1.00 0.00 N ATOM 319 CA ALA A 26 -3.647 -15.870 -3.775 1.00 0.00 C ATOM 320 C ALA A 26 -3.856 -17.350 -4.097 1.00 0.00 C ATOM 321 O ALA A 26 -4.652 -18.026 -3.445 1.00 0.00 O ATOM 322 CB ALA A 26 -4.032 -15.011 -4.970 1.00 0.00 C ATOM 0 H ALA A 26 -1.797 -14.902 -3.957 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.291 -15.618 -2.932 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -5.063 -15.224 -5.254 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.939 -13.958 -4.706 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.371 -15.235 -5.807 1.00 0.00 H new ATOM 328 N PRO A 27 -3.147 -17.874 -5.113 1.00 0.00 N ATOM 329 CA PRO A 27 -3.268 -19.280 -5.519 1.00 0.00 C ATOM 330 C PRO A 27 -2.847 -20.246 -4.415 1.00 0.00 C ATOM 331 O PRO A 27 -3.463 -21.296 -4.231 1.00 0.00 O ATOM 332 CB PRO A 27 -2.325 -19.397 -6.722 1.00 0.00 C ATOM 333 CG PRO A 27 -1.391 -18.244 -6.597 1.00 0.00 C ATOM 334 CD PRO A 27 -2.179 -17.142 -5.949 1.00 0.00 C ATOM 0 HA PRO A 27 -4.301 -19.543 -5.747 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -1.786 -20.344 -6.709 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -2.877 -19.357 -7.661 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.522 -18.509 -5.994 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.019 -17.935 -7.574 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.543 -16.488 -5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.677 -16.514 -6.688 1.00 0.00 H new ATOM 342 N THR A 28 -1.795 -19.889 -3.686 1.00 0.00 N ATOM 343 CA THR A 28 -1.297 -20.730 -2.604 1.00 0.00 C ATOM 344 C THR A 28 -2.265 -20.730 -1.426 1.00 0.00 C ATOM 345 O THR A 28 -2.366 -21.713 -0.692 1.00 0.00 O ATOM 346 CB THR A 28 0.081 -20.248 -2.146 1.00 0.00 C ATOM 347 OG1 THR A 28 -0.018 -19.001 -1.482 1.00 0.00 O ATOM 348 CG2 THR A 28 1.065 -20.086 -3.284 1.00 0.00 C ATOM 0 H THR A 28 -1.272 -19.025 -3.824 1.00 0.00 H new ATOM 0 HA THR A 28 -1.210 -21.749 -2.981 1.00 0.00 H new ATOM 0 HB THR A 28 0.450 -21.023 -1.474 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.808 -18.520 -1.806 1.00 0.00 H new ATOM 0 HG21 THR A 28 2.022 -19.742 -2.891 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.202 -21.044 -3.786 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.681 -19.355 -3.996 1.00 0.00 H new ATOM 356 N LEU A 29 -2.976 -19.621 -1.250 1.00 0.00 N ATOM 357 CA LEU A 29 -3.936 -19.493 -0.161 1.00 0.00 C ATOM 358 C LEU A 29 -5.218 -20.265 -0.470 1.00 0.00 C ATOM 359 O LEU A 29 -5.644 -20.339 -1.623 1.00 0.00 O ATOM 360 CB LEU A 29 -4.263 -18.019 0.085 1.00 0.00 C ATOM 361 CG LEU A 29 -3.242 -17.263 0.938 1.00 0.00 C ATOM 362 CD1 LEU A 29 -3.509 -15.767 0.888 1.00 0.00 C ATOM 363 CD2 LEU A 29 -3.273 -17.764 2.374 1.00 0.00 C ATOM 0 H LEU A 29 -2.905 -18.798 -1.848 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.487 -19.915 0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -4.352 -17.517 -0.878 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.237 -17.955 0.569 1.00 0.00 H new ATOM 0 HG LEU A 29 -2.248 -17.448 0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.773 -15.245 1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.436 -15.419 -0.142 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -4.509 -15.563 1.270 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.541 -17.216 2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.268 -17.609 2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.033 -18.827 2.394 1.00 0.00 H new ATOM 375 N PRO A 30 -5.851 -20.854 0.560 1.00 0.00 N ATOM 376 CA PRO A 30 -7.088 -21.622 0.389 1.00 0.00 C ATOM 377 C PRO A 30 -8.293 -20.727 0.117 1.00 0.00 C ATOM 378 O PRO A 30 -8.374 -19.608 0.622 1.00 0.00 O ATOM 379 CB PRO A 30 -7.246 -22.337 1.731 1.00 0.00 C ATOM 380 CG PRO A 30 -6.558 -21.451 2.711 1.00 0.00 C ATOM 381 CD PRO A 30 -5.413 -20.818 1.969 1.00 0.00 C ATOM 0 HA PRO A 30 -7.036 -22.296 -0.466 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -8.297 -22.471 1.987 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -6.794 -23.329 1.708 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.240 -20.693 3.096 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -6.199 -22.022 3.568 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.232 -19.798 2.307 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.486 -21.372 2.115 1.00 0.00 H new ATOM 389 N LYS A 31 -9.227 -21.229 -0.684 1.00 0.00 N ATOM 390 CA LYS A 31 -10.429 -20.474 -1.023 1.00 0.00 C ATOM 391 C LYS A 31 -11.368 -20.381 0.175 1.00 0.00 C ATOM 392 O LYS A 31 -11.272 -21.171 1.114 1.00 0.00 O ATOM 393 CB LYS A 31 -11.150 -21.128 -2.203 1.00 0.00 C ATOM 394 CG LYS A 31 -11.843 -20.131 -3.119 1.00 0.00 C ATOM 395 CD LYS A 31 -12.735 -20.832 -4.132 1.00 0.00 C ATOM 396 CE LYS A 31 -11.954 -21.258 -5.365 1.00 0.00 C ATOM 397 NZ LYS A 31 -11.741 -22.731 -5.405 1.00 0.00 N ATOM 0 H LYS A 31 -9.175 -22.154 -1.110 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.128 -19.465 -1.304 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.430 -21.704 -2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -11.889 -21.833 -1.822 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -12.440 -19.441 -2.523 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.095 -19.535 -3.642 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -13.193 -21.707 -3.670 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -13.546 -20.166 -4.426 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.490 -20.944 -6.261 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -10.989 -20.751 -5.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.205 -22.981 -6.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.207 -23.028 -4.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -12.662 -23.215 -5.420 1.00 0.00 H new ATOM 411 N SER A 32 -12.276 -19.412 0.136 1.00 0.00 N ATOM 412 CA SER A 32 -13.232 -19.215 1.218 1.00 0.00 C ATOM 413 C SER A 32 -14.644 -19.577 0.768 1.00 0.00 C ATOM 414 O SER A 32 -14.899 -19.760 -0.422 1.00 0.00 O ATOM 415 CB SER A 32 -13.192 -17.764 1.704 1.00 0.00 C ATOM 416 OG SER A 32 -13.079 -17.701 3.115 1.00 0.00 O ATOM 0 H SER A 32 -12.370 -18.750 -0.635 1.00 0.00 H new ATOM 0 HA SER A 32 -12.954 -19.873 2.041 1.00 0.00 H new ATOM 0 HB2 SER A 32 -12.349 -17.247 1.245 1.00 0.00 H new ATOM 0 HB3 SER A 32 -14.096 -17.245 1.385 1.00 0.00 H new ATOM 0 HG SER A 32 -13.054 -16.764 3.400 1.00 0.00 H new ATOM 422 N ASP A 33 -15.557 -19.677 1.728 1.00 0.00 N ATOM 423 CA ASP A 33 -16.944 -20.016 1.432 1.00 0.00 C ATOM 424 C ASP A 33 -17.612 -18.911 0.622 1.00 0.00 C ATOM 425 O ASP A 33 -17.883 -17.826 1.138 1.00 0.00 O ATOM 426 CB ASP A 33 -17.720 -20.256 2.728 1.00 0.00 C ATOM 427 CG ASP A 33 -17.627 -19.083 3.683 1.00 0.00 C ATOM 428 OD1 ASP A 33 -16.614 -18.984 4.405 1.00 0.00 O ATOM 429 OD2 ASP A 33 -18.569 -18.262 3.708 1.00 0.00 O ATOM 0 H ASP A 33 -15.361 -19.528 2.718 1.00 0.00 H new ATOM 0 HA ASP A 33 -16.950 -20.931 0.839 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -18.767 -20.446 2.491 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -17.336 -21.151 3.218 1.00 0.00 H new ATOM 434 N LEU A 34 -17.876 -19.193 -0.650 1.00 0.00 N ATOM 435 CA LEU A 34 -18.512 -18.221 -1.531 1.00 0.00 C ATOM 436 C LEU A 34 -20.010 -18.489 -1.649 1.00 0.00 C ATOM 437 O LEU A 34 -20.796 -17.574 -1.892 1.00 0.00 O ATOM 438 CB LEU A 34 -17.865 -18.260 -2.917 1.00 0.00 C ATOM 439 CG LEU A 34 -16.557 -17.477 -3.042 1.00 0.00 C ATOM 440 CD1 LEU A 34 -15.749 -17.973 -4.232 1.00 0.00 C ATOM 441 CD2 LEU A 34 -16.839 -15.987 -3.171 1.00 0.00 C ATOM 0 H LEU A 34 -17.659 -20.086 -1.093 1.00 0.00 H new ATOM 0 HA LEU A 34 -18.372 -17.230 -1.098 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -17.675 -19.300 -3.184 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -18.576 -17.869 -3.645 1.00 0.00 H new ATOM 0 HG LEU A 34 -15.970 -17.640 -2.138 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -14.822 -17.404 -4.305 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -15.517 -19.030 -4.099 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -16.328 -17.841 -5.146 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -15.898 -15.445 -3.259 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -17.446 -15.807 -4.058 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -17.376 -15.641 -2.288 1.00 0.00 H new ATOM 453 N ASN A 35 -20.398 -19.748 -1.476 1.00 0.00 N ATOM 454 CA ASN A 35 -21.801 -20.135 -1.563 1.00 0.00 C ATOM 455 C ASN A 35 -22.558 -19.724 -0.304 1.00 0.00 C ATOM 456 O ASN A 35 -23.661 -19.180 -0.379 1.00 0.00 O ATOM 457 CB ASN A 35 -21.923 -21.645 -1.777 1.00 0.00 C ATOM 458 CG ASN A 35 -23.001 -22.001 -2.783 1.00 0.00 C ATOM 459 OD1 ASN A 35 -23.206 -21.291 -3.768 1.00 0.00 O ATOM 460 ND2 ASN A 35 -23.697 -23.104 -2.537 1.00 0.00 N ATOM 0 H ASN A 35 -19.760 -20.518 -1.275 1.00 0.00 H new ATOM 0 HA ASN A 35 -22.243 -19.618 -2.415 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -20.966 -22.039 -2.119 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -22.145 -22.127 -0.825 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -24.436 -23.394 -3.177 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -23.492 -23.662 -1.708 1.00 0.00 H new ATOM 467 N GLU A 36 -21.959 -19.988 0.853 1.00 0.00 N ATOM 468 CA GLU A 36 -22.576 -19.646 2.129 1.00 0.00 C ATOM 469 C GLU A 36 -22.820 -18.144 2.232 1.00 0.00 C ATOM 470 O GLU A 36 -23.906 -17.706 2.613 1.00 0.00 O ATOM 471 CB GLU A 36 -21.691 -20.111 3.286 1.00 0.00 C ATOM 472 CG GLU A 36 -22.476 -20.610 4.490 1.00 0.00 C ATOM 473 CD GLU A 36 -22.157 -22.051 4.838 1.00 0.00 C ATOM 474 OE1 GLU A 36 -22.389 -22.934 3.985 1.00 0.00 O ATOM 475 OE2 GLU A 36 -21.676 -22.298 5.965 1.00 0.00 O ATOM 0 H GLU A 36 -21.047 -20.438 0.933 1.00 0.00 H new ATOM 0 HA GLU A 36 -23.538 -20.156 2.187 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -21.036 -20.908 2.934 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -21.050 -19.286 3.597 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -22.258 -19.976 5.349 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -23.543 -20.517 4.287 1.00 0.00 H new ATOM 482 N VAL A 37 -21.802 -17.360 1.893 1.00 0.00 N ATOM 483 CA VAL A 37 -21.905 -15.907 1.947 1.00 0.00 C ATOM 484 C VAL A 37 -23.026 -15.398 1.047 1.00 0.00 C ATOM 485 O VAL A 37 -23.644 -14.372 1.329 1.00 0.00 O ATOM 486 CB VAL A 37 -20.584 -15.233 1.530 1.00 0.00 C ATOM 487 CG1 VAL A 37 -19.521 -15.434 2.599 1.00 0.00 C ATOM 488 CG2 VAL A 37 -20.111 -15.773 0.188 1.00 0.00 C ATOM 0 H VAL A 37 -20.896 -17.707 1.578 1.00 0.00 H new ATOM 0 HA VAL A 37 -22.128 -15.647 2.982 1.00 0.00 H new ATOM 0 HB VAL A 37 -20.760 -14.163 1.424 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -18.595 -14.951 2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -19.861 -14.995 3.537 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -19.344 -16.500 2.740 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -19.177 -15.286 -0.091 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -19.951 -16.848 0.265 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -20.866 -15.572 -0.572 1.00 0.00 H new ATOM 498 N LYS A 38 -23.285 -16.124 -0.036 1.00 0.00 N ATOM 499 CA LYS A 38 -24.332 -15.745 -0.977 1.00 0.00 C ATOM 500 C LYS A 38 -25.694 -15.709 -0.289 1.00 0.00 C ATOM 501 O LYS A 38 -26.511 -14.828 -0.555 1.00 0.00 O ATOM 502 CB LYS A 38 -24.364 -16.721 -2.157 1.00 0.00 C ATOM 503 CG LYS A 38 -24.024 -16.073 -3.489 1.00 0.00 C ATOM 504 CD LYS A 38 -23.754 -17.115 -4.563 1.00 0.00 C ATOM 505 CE LYS A 38 -22.263 -17.308 -4.790 1.00 0.00 C ATOM 506 NZ LYS A 38 -21.586 -16.033 -5.153 1.00 0.00 N ATOM 0 H LYS A 38 -22.784 -16.978 -0.283 1.00 0.00 H new ATOM 0 HA LYS A 38 -24.109 -14.745 -1.350 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -23.661 -17.532 -1.967 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -25.356 -17.168 -2.222 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -24.847 -15.430 -3.803 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -23.148 -15.435 -3.371 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -24.205 -18.064 -4.272 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -24.228 -16.809 -5.495 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -21.808 -17.716 -3.887 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -22.108 -18.039 -5.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -20.812 -16.229 -5.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -22.272 -15.390 -5.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -21.201 -15.588 -4.296 1.00 0.00 H new ATOM 520 N GLU A 39 -25.930 -16.672 0.597 1.00 0.00 N ATOM 521 CA GLU A 39 -27.193 -16.750 1.322 1.00 0.00 C ATOM 522 C GLU A 39 -27.319 -15.605 2.321 1.00 0.00 C ATOM 523 O GLU A 39 -28.422 -15.142 2.614 1.00 0.00 O ATOM 524 CB GLU A 39 -27.303 -18.091 2.052 1.00 0.00 C ATOM 525 CG GLU A 39 -27.783 -19.228 1.165 1.00 0.00 C ATOM 526 CD GLU A 39 -28.619 -20.244 1.919 1.00 0.00 C ATOM 527 OE1 GLU A 39 -29.475 -19.825 2.726 1.00 0.00 O ATOM 528 OE2 GLU A 39 -28.416 -21.457 1.703 1.00 0.00 O ATOM 0 H GLU A 39 -25.264 -17.408 0.830 1.00 0.00 H new ATOM 0 HA GLU A 39 -28.004 -16.668 0.598 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -26.329 -18.351 2.466 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -27.988 -17.983 2.893 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -28.370 -18.819 0.342 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -26.921 -19.728 0.724 1.00 0.00 H new ATOM 535 N LEU A 40 -26.183 -15.152 2.842 1.00 0.00 N ATOM 536 CA LEU A 40 -26.167 -14.061 3.810 1.00 0.00 C ATOM 537 C LEU A 40 -26.760 -12.789 3.209 1.00 0.00 C ATOM 538 O LEU A 40 -27.395 -12.000 3.908 1.00 0.00 O ATOM 539 CB LEU A 40 -24.736 -13.798 4.286 1.00 0.00 C ATOM 540 CG LEU A 40 -24.574 -13.656 5.801 1.00 0.00 C ATOM 541 CD1 LEU A 40 -23.226 -14.199 6.248 1.00 0.00 C ATOM 542 CD2 LEU A 40 -24.729 -12.201 6.218 1.00 0.00 C ATOM 0 H LEU A 40 -25.262 -15.523 2.610 1.00 0.00 H new ATOM 0 HA LEU A 40 -26.779 -14.355 4.663 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -24.099 -14.613 3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -24.372 -12.887 3.810 1.00 0.00 H new ATOM 0 HG LEU A 40 -25.356 -14.239 6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -23.130 -14.089 7.328 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -23.152 -15.254 5.982 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -22.428 -13.644 5.754 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -24.611 -12.118 7.298 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -23.969 -11.597 5.722 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -25.719 -11.844 5.933 1.00 0.00 H new ATOM 554 N LEU A 41 -26.547 -12.598 1.912 1.00 0.00 N ATOM 555 CA LEU A 41 -27.060 -11.421 1.219 1.00 0.00 C ATOM 556 C LEU A 41 -28.577 -11.493 1.074 1.00 0.00 C ATOM 557 O LEU A 41 -29.278 -10.507 1.299 1.00 0.00 O ATOM 558 CB LEU A 41 -26.409 -11.292 -0.159 1.00 0.00 C ATOM 559 CG LEU A 41 -24.919 -10.947 -0.142 1.00 0.00 C ATOM 560 CD1 LEU A 41 -24.337 -11.025 -1.544 1.00 0.00 C ATOM 561 CD2 LEU A 41 -24.700 -9.564 0.453 1.00 0.00 C ATOM 0 H LEU A 41 -26.023 -13.242 1.319 1.00 0.00 H new ATOM 0 HA LEU A 41 -26.812 -10.542 1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -26.543 -12.231 -0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -26.938 -10.524 -0.723 1.00 0.00 H new ATOM 0 HG LEU A 41 -24.403 -11.676 0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -23.276 -10.776 -1.512 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -24.461 -12.035 -1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -24.856 -10.319 -2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -23.634 -9.334 0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -25.228 -8.822 -0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -25.080 -9.543 1.474 1.00 0.00 H new ATOM 573 N LYS A 42 -29.076 -12.664 0.695 1.00 0.00 N ATOM 574 CA LYS A 42 -30.510 -12.863 0.520 1.00 0.00 C ATOM 575 C LYS A 42 -31.259 -12.628 1.828 1.00 0.00 C ATOM 576 O LYS A 42 -32.430 -12.249 1.824 1.00 0.00 O ATOM 577 CB LYS A 42 -30.791 -14.275 0.005 1.00 0.00 C ATOM 578 CG LYS A 42 -30.442 -14.469 -1.463 1.00 0.00 C ATOM 579 CD LYS A 42 -29.337 -15.497 -1.645 1.00 0.00 C ATOM 580 CE LYS A 42 -28.570 -15.267 -2.937 1.00 0.00 C ATOM 581 NZ LYS A 42 -28.120 -16.547 -3.551 1.00 0.00 N ATOM 0 H LYS A 42 -28.509 -13.490 0.503 1.00 0.00 H new ATOM 0 HA LYS A 42 -30.863 -12.138 -0.214 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -30.225 -14.990 0.602 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -31.847 -14.503 0.152 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -31.330 -14.788 -2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -30.128 -13.517 -1.892 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -28.651 -15.449 -0.800 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -29.767 -16.498 -1.649 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -29.202 -14.728 -3.643 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -27.704 -14.636 -2.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -27.601 -16.347 -4.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -27.497 -17.050 -2.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -28.948 -17.139 -3.765 1.00 0.00 H new ATOM 595 N THR A 43 -30.578 -12.857 2.946 1.00 0.00 N ATOM 596 CA THR A 43 -31.182 -12.671 4.261 1.00 0.00 C ATOM 597 C THR A 43 -31.001 -11.238 4.748 1.00 0.00 C ATOM 598 O THR A 43 -31.863 -10.693 5.439 1.00 0.00 O ATOM 599 CB THR A 43 -30.571 -13.646 5.269 1.00 0.00 C ATOM 600 OG1 THR A 43 -29.175 -13.433 5.388 1.00 0.00 O ATOM 601 CG2 THR A 43 -30.784 -15.099 4.900 1.00 0.00 C ATOM 0 H THR A 43 -29.608 -13.172 2.968 1.00 0.00 H new ATOM 0 HA THR A 43 -32.250 -12.872 4.173 1.00 0.00 H new ATOM 0 HB THR A 43 -31.083 -13.448 6.211 1.00 0.00 H new ATOM 0 HG1 THR A 43 -28.870 -12.852 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 43 -30.326 -15.737 5.656 1.00 0.00 H new ATOM 0 HG22 THR A 43 -31.852 -15.308 4.847 1.00 0.00 H new ATOM 0 HG23 THR A 43 -30.327 -15.299 3.931 1.00 0.00 H new ATOM 609 N ASN A 44 -29.876 -10.632 4.386 1.00 0.00 N ATOM 610 CA ASN A 44 -29.583 -9.260 4.789 1.00 0.00 C ATOM 611 C ASN A 44 -29.966 -8.275 3.690 1.00 0.00 C ATOM 612 O ASN A 44 -30.362 -8.673 2.595 1.00 0.00 O ATOM 613 CB ASN A 44 -28.098 -9.113 5.127 1.00 0.00 C ATOM 614 CG ASN A 44 -27.862 -8.165 6.286 1.00 0.00 C ATOM 615 OD1 ASN A 44 -28.281 -7.008 6.253 1.00 0.00 O ATOM 616 ND2 ASN A 44 -27.186 -8.651 7.321 1.00 0.00 N ATOM 0 H ASN A 44 -29.152 -11.068 3.815 1.00 0.00 H new ATOM 0 HA ASN A 44 -30.176 -9.034 5.676 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -27.685 -10.092 5.371 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -27.562 -8.751 4.250 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -26.996 -8.059 8.130 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -26.857 -9.616 7.307 1.00 0.00 H new ATOM 623 N LYS A 45 -29.846 -6.986 3.992 1.00 0.00 N ATOM 624 CA LYS A 45 -30.179 -5.942 3.030 1.00 0.00 C ATOM 625 C LYS A 45 -29.077 -4.888 2.967 1.00 0.00 C ATOM 626 O LYS A 45 -28.652 -4.484 1.886 1.00 0.00 O ATOM 627 CB LYS A 45 -31.510 -5.285 3.400 1.00 0.00 C ATOM 628 CG LYS A 45 -32.393 -4.980 2.200 1.00 0.00 C ATOM 629 CD LYS A 45 -33.572 -4.099 2.583 1.00 0.00 C ATOM 630 CE LYS A 45 -34.872 -4.617 1.987 1.00 0.00 C ATOM 631 NZ LYS A 45 -34.778 -4.783 0.510 1.00 0.00 N ATOM 0 H LYS A 45 -29.521 -6.640 4.895 1.00 0.00 H new ATOM 0 HA LYS A 45 -30.271 -6.404 2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -32.052 -5.940 4.082 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -31.311 -4.359 3.939 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -31.803 -4.484 1.430 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -32.759 -5.912 1.770 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -33.659 -4.058 3.669 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -33.393 -3.080 2.239 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -35.126 -5.573 2.444 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -35.681 -3.926 2.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -35.731 -4.752 0.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -34.202 -4.015 0.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -34.335 -5.698 0.291 1.00 0.00 H new ATOM 645 N LYS A 46 -28.619 -4.448 4.135 1.00 0.00 N ATOM 646 CA LYS A 46 -27.567 -3.442 4.213 1.00 0.00 C ATOM 647 C LYS A 46 -26.293 -3.935 3.535 1.00 0.00 C ATOM 648 O LYS A 46 -25.722 -3.247 2.689 1.00 0.00 O ATOM 649 CB LYS A 46 -27.278 -3.087 5.673 1.00 0.00 C ATOM 650 CG LYS A 46 -28.112 -1.926 6.193 1.00 0.00 C ATOM 651 CD LYS A 46 -27.834 -1.655 7.662 1.00 0.00 C ATOM 652 CE LYS A 46 -26.470 -1.015 7.862 1.00 0.00 C ATOM 653 NZ LYS A 46 -26.065 -1.006 9.296 1.00 0.00 N ATOM 0 H LYS A 46 -28.960 -4.773 5.040 1.00 0.00 H new ATOM 0 HA LYS A 46 -27.913 -2.549 3.692 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -27.462 -3.963 6.295 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -26.221 -2.840 5.776 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -27.896 -1.031 5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -29.171 -2.147 6.057 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -28.607 -1.000 8.065 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -27.884 -2.589 8.221 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -25.726 -1.557 7.278 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -26.490 0.007 7.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -25.130 -0.561 9.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -26.761 -0.468 9.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -26.021 -1.983 9.650 1.00 0.00 H new ATOM 667 N LEU A 47 -25.853 -5.132 3.911 1.00 0.00 N ATOM 668 CA LEU A 47 -24.647 -5.716 3.337 1.00 0.00 C ATOM 669 C LEU A 47 -24.801 -5.907 1.831 1.00 0.00 C ATOM 670 O LEU A 47 -23.827 -5.827 1.082 1.00 0.00 O ATOM 671 CB LEU A 47 -24.338 -7.059 4.004 1.00 0.00 C ATOM 672 CG LEU A 47 -23.442 -6.976 5.242 1.00 0.00 C ATOM 673 CD1 LEU A 47 -23.874 -7.996 6.284 1.00 0.00 C ATOM 674 CD2 LEU A 47 -21.985 -7.187 4.859 1.00 0.00 C ATOM 0 H LEU A 47 -26.313 -5.715 4.610 1.00 0.00 H new ATOM 0 HA LEU A 47 -23.819 -5.030 3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -25.279 -7.532 4.286 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -23.861 -7.710 3.272 1.00 0.00 H new ATOM 0 HG LEU A 47 -23.544 -5.981 5.675 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -23.225 -7.922 7.157 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -24.904 -7.800 6.580 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -23.802 -8.999 5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -21.362 -7.125 5.751 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -21.868 -8.170 4.402 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -21.680 -6.418 4.149 1.00 0.00 H new ATOM 686 N ALA A 48 -26.031 -6.158 1.396 1.00 0.00 N ATOM 687 CA ALA A 48 -26.316 -6.359 -0.020 1.00 0.00 C ATOM 688 C ALA A 48 -26.195 -5.051 -0.797 1.00 0.00 C ATOM 689 O ALA A 48 -25.891 -5.052 -1.989 1.00 0.00 O ATOM 690 CB ALA A 48 -27.703 -6.954 -0.200 1.00 0.00 C ATOM 0 H ALA A 48 -26.847 -6.227 2.004 1.00 0.00 H new ATOM 0 HA ALA A 48 -25.579 -7.057 -0.417 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -27.902 -7.098 -1.262 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -27.756 -7.914 0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -28.447 -6.277 0.220 1.00 0.00 H new ATOM 696 N LYS A 49 -26.434 -3.936 -0.113 1.00 0.00 N ATOM 697 CA LYS A 49 -26.351 -2.624 -0.741 1.00 0.00 C ATOM 698 C LYS A 49 -24.943 -2.047 -0.616 1.00 0.00 C ATOM 699 O LYS A 49 -24.515 -1.244 -1.445 1.00 0.00 O ATOM 700 CB LYS A 49 -27.362 -1.667 -0.106 1.00 0.00 C ATOM 701 CG LYS A 49 -27.783 -0.530 -1.024 1.00 0.00 C ATOM 702 CD LYS A 49 -28.697 -1.019 -2.139 1.00 0.00 C ATOM 703 CE LYS A 49 -30.077 -0.388 -2.048 1.00 0.00 C ATOM 704 NZ LYS A 49 -30.834 -0.875 -0.861 1.00 0.00 N ATOM 0 H LYS A 49 -26.686 -3.916 0.875 1.00 0.00 H new ATOM 0 HA LYS A 49 -26.584 -2.741 -1.799 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -28.247 -2.230 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -26.932 -1.248 0.804 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -28.295 0.237 -0.443 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -26.898 -0.064 -1.457 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -28.251 -0.783 -3.105 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -28.788 -2.104 -2.086 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -29.978 0.696 -1.995 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -30.639 -0.613 -2.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -31.769 -0.421 -0.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.952 -1.906 -0.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -30.310 -0.638 0.006 1.00 0.00 H new ATOM 718 N MET A 50 -24.228 -2.461 0.425 1.00 0.00 N ATOM 719 CA MET A 50 -22.869 -1.984 0.657 1.00 0.00 C ATOM 720 C MET A 50 -21.892 -2.614 -0.332 1.00 0.00 C ATOM 721 O MET A 50 -21.228 -1.912 -1.094 1.00 0.00 O ATOM 722 CB MET A 50 -22.435 -2.299 2.090 1.00 0.00 C ATOM 723 CG MET A 50 -21.107 -1.667 2.476 1.00 0.00 C ATOM 724 SD MET A 50 -20.272 -2.562 3.799 1.00 0.00 S ATOM 725 CE MET A 50 -19.913 -1.227 4.937 1.00 0.00 C ATOM 0 H MET A 50 -24.567 -3.125 1.121 1.00 0.00 H new ATOM 0 HA MET A 50 -22.860 -0.904 0.509 1.00 0.00 H new ATOM 0 HB2 MET A 50 -23.206 -1.954 2.779 1.00 0.00 H new ATOM 0 HB3 MET A 50 -22.362 -3.380 2.209 1.00 0.00 H new ATOM 0 HG2 MET A 50 -20.458 -1.631 1.601 1.00 0.00 H new ATOM 0 HG3 MET A 50 -21.277 -0.637 2.790 1.00 0.00 H new ATOM 0 HE1 MET A 50 -19.395 -1.623 5.811 1.00 0.00 H new ATOM 0 HE2 MET A 50 -19.281 -0.489 4.444 1.00 0.00 H new ATOM 0 HE3 MET A 50 -20.845 -0.756 5.250 1.00 0.00 H new ATOM 735 N ILE A 51 -21.808 -3.941 -0.310 1.00 0.00 N ATOM 736 CA ILE A 51 -20.908 -4.662 -1.204 1.00 0.00 C ATOM 737 C ILE A 51 -21.594 -5.878 -1.816 1.00 0.00 C ATOM 738 O ILE A 51 -20.941 -6.868 -2.148 1.00 0.00 O ATOM 739 CB ILE A 51 -19.638 -5.122 -0.466 1.00 0.00 C ATOM 740 CG1 ILE A 51 -20.008 -5.825 0.841 1.00 0.00 C ATOM 741 CG2 ILE A 51 -18.722 -3.938 -0.197 1.00 0.00 C ATOM 742 CD1 ILE A 51 -18.893 -6.679 1.405 1.00 0.00 C ATOM 0 H ILE A 51 -22.350 -4.537 0.315 1.00 0.00 H new ATOM 0 HA ILE A 51 -20.630 -3.969 -1.998 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.105 -5.831 -1.099 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -20.290 -5.075 1.580 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -20.884 -6.451 0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.829 -4.280 0.325 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.435 -3.478 -1.142 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -19.245 -3.206 0.419 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -19.226 -7.147 2.332 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -18.626 -7.452 0.684 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -18.023 -6.054 1.606 1.00 0.00 H new ATOM 754 N GLY A 52 -22.912 -5.800 -1.967 1.00 0.00 N ATOM 755 CA GLY A 52 -23.658 -6.904 -2.541 1.00 0.00 C ATOM 756 C GLY A 52 -23.731 -6.829 -4.053 1.00 0.00 C ATOM 757 O GLY A 52 -23.634 -7.847 -4.737 1.00 0.00 O ATOM 0 H GLY A 52 -23.476 -4.993 -1.702 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -23.191 -7.845 -2.249 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -24.668 -6.908 -2.131 1.00 0.00 H new ATOM 761 N HIS A 53 -23.902 -5.618 -4.576 1.00 0.00 N ATOM 762 CA HIS A 53 -23.986 -5.413 -6.017 1.00 0.00 C ATOM 763 C HIS A 53 -22.719 -5.902 -6.712 1.00 0.00 C ATOM 764 O HIS A 53 -22.757 -6.319 -7.869 1.00 0.00 O ATOM 765 CB HIS A 53 -24.214 -3.932 -6.330 1.00 0.00 C ATOM 766 CG HIS A 53 -23.167 -3.030 -5.755 1.00 0.00 C ATOM 767 ND1 HIS A 53 -23.168 -2.618 -4.439 1.00 0.00 N ATOM 768 CD2 HIS A 53 -22.079 -2.459 -6.326 1.00 0.00 C ATOM 769 CE1 HIS A 53 -22.127 -1.832 -4.225 1.00 0.00 C ATOM 770 NE2 HIS A 53 -21.451 -1.720 -5.353 1.00 0.00 N ATOM 0 H HIS A 53 -23.985 -4.765 -4.023 1.00 0.00 H new ATOM 0 HA HIS A 53 -24.830 -5.991 -6.392 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -24.243 -3.798 -7.411 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -25.189 -3.634 -5.946 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -21.764 -2.565 -7.354 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -21.873 -1.361 -3.287 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -20.600 -1.173 -5.482 1.00 0.00 H new ATOM 779 N ILE A 54 -21.600 -5.850 -5.998 1.00 0.00 N ATOM 780 CA ILE A 54 -20.323 -6.289 -6.545 1.00 0.00 C ATOM 781 C ILE A 54 -20.270 -7.809 -6.661 1.00 0.00 C ATOM 782 O ILE A 54 -19.661 -8.350 -7.584 1.00 0.00 O ATOM 783 CB ILE A 54 -19.142 -5.812 -5.675 1.00 0.00 C ATOM 784 CG1 ILE A 54 -19.255 -4.311 -5.401 1.00 0.00 C ATOM 785 CG2 ILE A 54 -17.819 -6.133 -6.353 1.00 0.00 C ATOM 786 CD1 ILE A 54 -18.464 -3.857 -4.193 1.00 0.00 C ATOM 0 H ILE A 54 -21.552 -5.508 -5.038 1.00 0.00 H new ATOM 0 HA ILE A 54 -20.236 -5.846 -7.537 1.00 0.00 H new ATOM 0 HB ILE A 54 -19.177 -6.340 -4.722 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -18.911 -3.763 -6.278 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -20.304 -4.054 -5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -16.996 -5.790 -5.726 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -17.738 -7.210 -6.501 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -17.774 -5.630 -7.319 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -18.590 -2.783 -4.058 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -18.823 -4.378 -3.306 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -17.408 -4.082 -4.344 1.00 0.00 H new ATOM 798 N PHE A 55 -20.913 -8.492 -5.720 1.00 0.00 N ATOM 799 CA PHE A 55 -20.940 -9.950 -5.717 1.00 0.00 C ATOM 800 C PHE A 55 -21.595 -10.483 -6.988 1.00 0.00 C ATOM 801 O PHE A 55 -21.047 -11.358 -7.660 1.00 0.00 O ATOM 802 CB PHE A 55 -21.690 -10.464 -4.487 1.00 0.00 C ATOM 803 CG PHE A 55 -20.790 -10.803 -3.333 1.00 0.00 C ATOM 804 CD1 PHE A 55 -20.011 -11.949 -3.359 1.00 0.00 C ATOM 805 CD2 PHE A 55 -20.722 -9.976 -2.223 1.00 0.00 C ATOM 806 CE1 PHE A 55 -19.181 -12.263 -2.300 1.00 0.00 C ATOM 807 CE2 PHE A 55 -19.894 -10.286 -1.160 1.00 0.00 C ATOM 808 CZ PHE A 55 -19.123 -11.431 -1.200 1.00 0.00 C ATOM 0 H PHE A 55 -21.422 -8.059 -4.950 1.00 0.00 H new ATOM 0 HA PHE A 55 -19.911 -10.309 -5.682 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -22.408 -9.709 -4.167 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -22.261 -11.350 -4.764 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -20.053 -12.604 -4.217 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -21.323 -9.079 -2.188 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -18.578 -13.159 -2.333 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -19.850 -9.634 -0.300 1.00 0.00 H new ATOM 0 HZ PHE A 55 -18.475 -11.675 -0.371 1.00 0.00 H new ATOM 818 N GLU A 56 -22.769 -9.951 -7.311 1.00 0.00 N ATOM 819 CA GLU A 56 -23.497 -10.373 -8.503 1.00 0.00 C ATOM 820 C GLU A 56 -22.830 -9.844 -9.768 1.00 0.00 C ATOM 821 O GLU A 56 -22.974 -10.424 -10.845 1.00 0.00 O ATOM 822 CB GLU A 56 -24.947 -9.889 -8.436 1.00 0.00 C ATOM 823 CG GLU A 56 -25.785 -10.619 -7.399 1.00 0.00 C ATOM 824 CD GLU A 56 -27.211 -10.850 -7.859 1.00 0.00 C ATOM 825 OE1 GLU A 56 -27.397 -11.423 -8.953 1.00 0.00 O ATOM 826 OE2 GLU A 56 -28.143 -10.458 -7.125 1.00 0.00 O ATOM 0 H GLU A 56 -23.237 -9.227 -6.765 1.00 0.00 H new ATOM 0 HA GLU A 56 -23.484 -11.462 -8.539 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -24.955 -8.822 -8.212 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -25.408 -10.012 -9.416 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -25.320 -11.579 -7.172 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -25.794 -10.043 -6.474 1.00 0.00 H new ATOM 833 N MET A 57 -22.100 -8.739 -9.633 1.00 0.00 N ATOM 834 CA MET A 57 -21.412 -8.133 -10.768 1.00 0.00 C ATOM 835 C MET A 57 -20.500 -9.142 -11.459 1.00 0.00 C ATOM 836 O MET A 57 -20.159 -10.178 -10.889 1.00 0.00 O ATOM 837 CB MET A 57 -20.595 -6.923 -10.306 1.00 0.00 C ATOM 838 CG MET A 57 -20.467 -5.837 -11.362 1.00 0.00 C ATOM 839 SD MET A 57 -20.518 -4.177 -10.659 1.00 0.00 S ATOM 840 CE MET A 57 -19.188 -3.386 -11.561 1.00 0.00 C ATOM 0 H MET A 57 -21.970 -8.246 -8.749 1.00 0.00 H new ATOM 0 HA MET A 57 -22.166 -7.806 -11.484 1.00 0.00 H new ATOM 0 HB2 MET A 57 -21.060 -6.500 -9.416 1.00 0.00 H new ATOM 0 HB3 MET A 57 -19.598 -7.257 -10.017 1.00 0.00 H new ATOM 0 HG2 MET A 57 -19.530 -5.970 -11.903 1.00 0.00 H new ATOM 0 HG3 MET A 57 -21.272 -5.945 -12.088 1.00 0.00 H new ATOM 0 HE1 MET A 57 -19.094 -2.350 -11.237 1.00 0.00 H new ATOM 0 HE2 MET A 57 -18.254 -3.913 -11.367 1.00 0.00 H new ATOM 0 HE3 MET A 57 -19.406 -3.414 -12.629 1.00 0.00 H new ATOM 850 N ASN A 58 -20.110 -8.833 -12.692 1.00 0.00 N ATOM 851 CA ASN A 58 -19.239 -9.712 -13.462 1.00 0.00 C ATOM 852 C ASN A 58 -17.912 -9.934 -12.740 1.00 0.00 C ATOM 853 O ASN A 58 -17.663 -9.348 -11.687 1.00 0.00 O ATOM 854 CB ASN A 58 -18.988 -9.125 -14.854 1.00 0.00 C ATOM 855 CG ASN A 58 -19.456 -10.048 -15.963 1.00 0.00 C ATOM 856 OD1 ASN A 58 -18.776 -11.014 -16.310 1.00 0.00 O ATOM 857 ND2 ASN A 58 -20.621 -9.751 -16.527 1.00 0.00 N ATOM 0 H ASN A 58 -20.384 -7.980 -13.179 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.738 -10.675 -13.568 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -19.502 -8.168 -14.940 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -17.923 -8.926 -14.975 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -20.986 -10.334 -17.280 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -21.151 -8.940 -16.207 1.00 0.00 H new ATOM 864 N ASP A 59 -17.066 -10.781 -13.316 1.00 0.00 N ATOM 865 CA ASP A 59 -15.765 -11.080 -12.728 1.00 0.00 C ATOM 866 C ASP A 59 -14.642 -10.441 -13.540 1.00 0.00 C ATOM 867 O ASP A 59 -13.603 -10.068 -12.994 1.00 0.00 O ATOM 868 CB ASP A 59 -15.554 -12.592 -12.645 1.00 0.00 C ATOM 869 CG ASP A 59 -16.453 -13.246 -11.616 1.00 0.00 C ATOM 870 OD1 ASP A 59 -17.474 -12.630 -11.242 1.00 0.00 O ATOM 871 OD2 ASP A 59 -16.138 -14.375 -11.183 1.00 0.00 O ATOM 0 H ASP A 59 -17.257 -11.273 -14.189 1.00 0.00 H new ATOM 0 HA ASP A 59 -15.744 -10.663 -11.721 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.742 -13.036 -13.622 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -14.513 -12.798 -12.397 1.00 0.00 H new ATOM 876 N ASP A 60 -14.858 -10.320 -14.846 1.00 0.00 N ATOM 877 CA ASP A 60 -13.865 -9.728 -15.733 1.00 0.00 C ATOM 878 C ASP A 60 -14.224 -8.283 -16.067 1.00 0.00 C ATOM 879 O ASP A 60 -13.953 -7.805 -17.168 1.00 0.00 O ATOM 880 CB ASP A 60 -13.746 -10.546 -17.020 1.00 0.00 C ATOM 881 CG ASP A 60 -12.459 -10.261 -17.770 1.00 0.00 C ATOM 882 OD1 ASP A 60 -11.423 -10.864 -17.422 1.00 0.00 O ATOM 883 OD2 ASP A 60 -12.489 -9.434 -18.705 1.00 0.00 O ATOM 0 H ASP A 60 -15.712 -10.624 -15.313 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.905 -9.735 -15.216 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -13.795 -11.608 -16.778 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.596 -10.327 -17.666 1.00 0.00 H new ATOM 888 N ASP A 61 -14.836 -7.594 -15.110 1.00 0.00 N ATOM 889 CA ASP A 61 -15.233 -6.204 -15.303 1.00 0.00 C ATOM 890 C ASP A 61 -14.236 -5.256 -14.637 1.00 0.00 C ATOM 891 O ASP A 61 -13.747 -5.530 -13.541 1.00 0.00 O ATOM 892 CB ASP A 61 -16.635 -5.968 -14.740 1.00 0.00 C ATOM 893 CG ASP A 61 -17.710 -6.061 -15.805 1.00 0.00 C ATOM 894 OD1 ASP A 61 -17.869 -7.151 -16.395 1.00 0.00 O ATOM 895 OD2 ASP A 61 -18.393 -5.045 -16.050 1.00 0.00 O ATOM 0 H ASP A 61 -15.068 -7.975 -14.193 1.00 0.00 H new ATOM 0 HA ASP A 61 -15.242 -6.000 -16.374 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -16.838 -6.700 -13.959 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -16.675 -4.984 -14.273 1.00 0.00 H new ATOM 900 N PRO A 62 -13.921 -4.123 -15.292 1.00 0.00 N ATOM 901 CA PRO A 62 -12.978 -3.138 -14.754 1.00 0.00 C ATOM 902 C PRO A 62 -13.562 -2.360 -13.579 1.00 0.00 C ATOM 903 O PRO A 62 -12.846 -1.997 -12.645 1.00 0.00 O ATOM 904 CB PRO A 62 -12.728 -2.206 -15.940 1.00 0.00 C ATOM 905 CG PRO A 62 -13.968 -2.301 -16.758 1.00 0.00 C ATOM 906 CD PRO A 62 -14.455 -3.715 -16.605 1.00 0.00 C ATOM 0 HA PRO A 62 -12.075 -3.607 -14.364 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -12.548 -1.183 -15.610 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.852 -2.516 -16.510 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -14.719 -1.590 -16.413 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -13.765 -2.069 -17.803 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -15.543 -3.770 -16.630 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -14.085 -4.356 -17.405 1.00 0.00 H new ATOM 914 N HIS A 63 -14.865 -2.106 -13.633 1.00 0.00 N ATOM 915 CA HIS A 63 -15.546 -1.370 -12.574 1.00 0.00 C ATOM 916 C HIS A 63 -15.422 -2.094 -11.237 1.00 0.00 C ATOM 917 O HIS A 63 -15.459 -1.469 -10.177 1.00 0.00 O ATOM 918 CB HIS A 63 -17.021 -1.176 -12.928 1.00 0.00 C ATOM 919 CG HIS A 63 -17.236 -0.493 -14.243 1.00 0.00 C ATOM 920 ND1 HIS A 63 -16.924 0.831 -14.463 1.00 0.00 N ATOM 921 CD2 HIS A 63 -17.735 -0.960 -15.413 1.00 0.00 C ATOM 922 CE1 HIS A 63 -17.221 1.150 -15.710 1.00 0.00 C ATOM 923 NE2 HIS A 63 -17.714 0.082 -16.307 1.00 0.00 N ATOM 0 H HIS A 63 -15.471 -2.399 -14.399 1.00 0.00 H new ATOM 0 HA HIS A 63 -15.069 -0.394 -12.481 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -17.512 -2.149 -12.949 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -17.501 -0.593 -12.142 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -18.084 -1.964 -15.606 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -17.084 2.120 -16.164 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -18.029 0.037 -17.276 1.00 0.00 H new ATOM 932 N LYS A 64 -15.277 -3.415 -11.293 1.00 0.00 N ATOM 933 CA LYS A 64 -15.149 -4.223 -10.084 1.00 0.00 C ATOM 934 C LYS A 64 -13.977 -3.748 -9.230 1.00 0.00 C ATOM 935 O LYS A 64 -14.101 -3.604 -8.014 1.00 0.00 O ATOM 936 CB LYS A 64 -14.967 -5.698 -10.450 1.00 0.00 C ATOM 937 CG LYS A 64 -15.735 -6.647 -9.546 1.00 0.00 C ATOM 938 CD LYS A 64 -15.001 -7.966 -9.372 1.00 0.00 C ATOM 939 CE LYS A 64 -15.484 -8.714 -8.139 1.00 0.00 C ATOM 940 NZ LYS A 64 -15.571 -10.181 -8.379 1.00 0.00 N ATOM 0 H LYS A 64 -15.245 -3.948 -12.162 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.064 -4.110 -9.503 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -15.289 -5.851 -11.480 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.907 -5.946 -10.407 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.885 -6.182 -8.572 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -16.723 -6.832 -9.967 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.150 -8.586 -10.256 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -13.930 -7.780 -9.290 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -14.805 -8.522 -7.308 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.463 -8.335 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.904 -10.655 -7.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -16.238 -10.367 -9.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -14.632 -10.547 -8.635 1.00 0.00 H new ATOM 954 N GLU A 65 -12.840 -3.506 -9.875 1.00 0.00 N ATOM 955 CA GLU A 65 -11.647 -3.047 -9.174 1.00 0.00 C ATOM 956 C GLU A 65 -11.830 -1.621 -8.664 1.00 0.00 C ATOM 957 O GLU A 65 -11.337 -1.266 -7.594 1.00 0.00 O ATOM 958 CB GLU A 65 -10.428 -3.119 -10.096 1.00 0.00 C ATOM 959 CG GLU A 65 -9.676 -4.438 -10.007 1.00 0.00 C ATOM 960 CD GLU A 65 -8.509 -4.509 -10.973 1.00 0.00 C ATOM 961 OE1 GLU A 65 -8.042 -3.440 -11.420 1.00 0.00 O ATOM 962 OE2 GLU A 65 -8.063 -5.633 -11.282 1.00 0.00 O ATOM 0 H GLU A 65 -12.720 -3.620 -10.881 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.485 -3.702 -8.318 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -10.751 -2.963 -11.125 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.747 -2.304 -9.849 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -9.310 -4.576 -8.990 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -10.363 -5.259 -10.212 1.00 0.00 H new ATOM 969 N GLU A 66 -12.541 -0.808 -9.438 1.00 0.00 N ATOM 970 CA GLU A 66 -12.790 0.579 -9.065 1.00 0.00 C ATOM 971 C GLU A 66 -13.735 0.661 -7.870 1.00 0.00 C ATOM 972 O GLU A 66 -13.643 1.578 -7.055 1.00 0.00 O ATOM 973 CB GLU A 66 -13.378 1.351 -10.248 1.00 0.00 C ATOM 974 CG GLU A 66 -12.489 1.344 -11.481 1.00 0.00 C ATOM 975 CD GLU A 66 -11.433 2.431 -11.444 1.00 0.00 C ATOM 976 OE1 GLU A 66 -10.559 2.380 -10.554 1.00 0.00 O ATOM 977 OE2 GLU A 66 -11.481 3.334 -12.306 1.00 0.00 O ATOM 0 H GLU A 66 -12.955 -1.086 -10.328 1.00 0.00 H new ATOM 0 HA GLU A 66 -11.838 1.029 -8.784 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -14.346 0.922 -10.506 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -13.557 2.383 -9.945 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.002 0.373 -11.568 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -13.106 1.472 -12.370 1.00 0.00 H new ATOM 984 N GLU A 67 -14.643 -0.305 -7.774 1.00 0.00 N ATOM 985 CA GLU A 67 -15.606 -0.343 -6.679 1.00 0.00 C ATOM 986 C GLU A 67 -14.952 -0.850 -5.398 1.00 0.00 C ATOM 987 O GLU A 67 -15.246 -0.366 -4.305 1.00 0.00 O ATOM 988 CB GLU A 67 -16.793 -1.234 -7.047 1.00 0.00 C ATOM 989 CG GLU A 67 -17.817 -0.548 -7.938 1.00 0.00 C ATOM 990 CD GLU A 67 -18.870 0.201 -7.145 1.00 0.00 C ATOM 991 OE1 GLU A 67 -18.506 1.155 -6.426 1.00 0.00 O ATOM 992 OE2 GLU A 67 -20.059 -0.166 -7.244 1.00 0.00 O ATOM 0 H GLU A 67 -14.732 -1.072 -8.441 1.00 0.00 H new ATOM 0 HA GLU A 67 -15.963 0.672 -6.506 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -16.424 -2.126 -7.553 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.284 -1.566 -6.132 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.306 0.147 -8.604 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -18.303 -1.293 -8.567 1.00 0.00 H new ATOM 999 N ILE A 68 -14.064 -1.828 -5.540 1.00 0.00 N ATOM 1000 CA ILE A 68 -13.368 -2.401 -4.395 1.00 0.00 C ATOM 1001 C ILE A 68 -12.238 -1.490 -3.927 1.00 0.00 C ATOM 1002 O ILE A 68 -11.951 -1.403 -2.734 1.00 0.00 O ATOM 1003 CB ILE A 68 -12.790 -3.792 -4.725 1.00 0.00 C ATOM 1004 CG1 ILE A 68 -13.872 -4.690 -5.328 1.00 0.00 C ATOM 1005 CG2 ILE A 68 -12.200 -4.432 -3.477 1.00 0.00 C ATOM 1006 CD1 ILE A 68 -13.328 -5.736 -6.278 1.00 0.00 C ATOM 0 H ILE A 68 -13.809 -2.240 -6.438 1.00 0.00 H new ATOM 0 HA ILE A 68 -14.103 -2.503 -3.597 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.994 -3.671 -5.459 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -14.411 -5.188 -4.522 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -14.594 -4.069 -5.858 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -11.796 -5.413 -3.727 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.402 -3.800 -3.087 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -12.978 -4.542 -2.722 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -14.150 -6.336 -6.668 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.814 -5.245 -7.104 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -12.628 -6.381 -5.747 1.00 0.00 H new ATOM 1018 N ARG A 69 -11.599 -0.813 -4.876 1.00 0.00 N ATOM 1019 CA ARG A 69 -10.501 0.092 -4.561 1.00 0.00 C ATOM 1020 C ARG A 69 -10.986 1.265 -3.715 1.00 0.00 C ATOM 1021 O ARG A 69 -10.243 1.795 -2.889 1.00 0.00 O ATOM 1022 CB ARG A 69 -9.854 0.610 -5.847 1.00 0.00 C ATOM 1023 CG ARG A 69 -8.786 -0.316 -6.406 1.00 0.00 C ATOM 1024 CD ARG A 69 -8.533 -0.051 -7.882 1.00 0.00 C ATOM 1025 NE ARG A 69 -7.266 0.642 -8.104 1.00 0.00 N ATOM 1026 CZ ARG A 69 -6.074 0.112 -7.839 1.00 0.00 C ATOM 1027 NH1 ARG A 69 -5.982 -1.115 -7.340 1.00 0.00 N ATOM 1028 NH2 ARG A 69 -4.971 0.810 -8.071 1.00 0.00 N ATOM 0 H ARG A 69 -11.823 -0.875 -5.869 1.00 0.00 H new ATOM 0 HA ARG A 69 -9.760 -0.464 -3.987 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -10.628 0.755 -6.601 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.411 1.587 -5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -7.859 -0.183 -5.848 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -9.094 -1.353 -6.269 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.529 -0.996 -8.425 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.349 0.546 -8.288 1.00 0.00 H new ATOM 0 HE ARG A 69 -7.297 1.588 -8.485 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -6.827 -1.656 -7.158 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -5.066 -1.516 -7.139 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.035 1.754 -8.453 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -4.058 0.403 -7.868 1.00 0.00 H new ATOM 1042 N LYS A 70 -12.236 1.662 -3.926 1.00 0.00 N ATOM 1043 CA LYS A 70 -12.820 2.772 -3.181 1.00 0.00 C ATOM 1044 C LYS A 70 -13.035 2.392 -1.719 1.00 0.00 C ATOM 1045 O LYS A 70 -12.555 3.074 -0.813 1.00 0.00 O ATOM 1046 CB LYS A 70 -14.149 3.193 -3.810 1.00 0.00 C ATOM 1047 CG LYS A 70 -14.570 4.609 -3.450 1.00 0.00 C ATOM 1048 CD LYS A 70 -16.060 4.693 -3.158 1.00 0.00 C ATOM 1049 CE LYS A 70 -16.348 5.633 -1.999 1.00 0.00 C ATOM 1050 NZ LYS A 70 -17.808 5.864 -1.821 1.00 0.00 N ATOM 0 H LYS A 70 -12.864 1.233 -4.606 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.125 3.610 -3.222 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -14.071 3.110 -4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -14.928 2.499 -3.493 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -14.008 4.946 -2.579 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -14.321 5.283 -4.270 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -16.587 5.038 -4.047 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -16.443 3.699 -2.926 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -15.932 5.216 -1.082 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -15.848 6.586 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -17.962 6.510 -1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -18.201 6.285 -2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -18.282 4.958 -1.631 1.00 0.00 H new ATOM 1064 N TYR A 71 -13.759 1.300 -1.497 1.00 0.00 N ATOM 1065 CA TYR A 71 -14.037 0.830 -0.145 1.00 0.00 C ATOM 1066 C TYR A 71 -12.758 0.356 0.539 1.00 0.00 C ATOM 1067 O TYR A 71 -12.618 0.466 1.758 1.00 0.00 O ATOM 1068 CB TYR A 71 -15.061 -0.306 -0.179 1.00 0.00 C ATOM 1069 CG TYR A 71 -16.485 0.168 -0.361 1.00 0.00 C ATOM 1070 CD1 TYR A 71 -17.221 0.647 0.716 1.00 0.00 C ATOM 1071 CD2 TYR A 71 -17.093 0.138 -1.609 1.00 0.00 C ATOM 1072 CE1 TYR A 71 -18.523 1.081 0.553 1.00 0.00 C ATOM 1073 CE2 TYR A 71 -18.395 0.571 -1.780 1.00 0.00 C ATOM 1074 CZ TYR A 71 -19.105 1.041 -0.696 1.00 0.00 C ATOM 1075 OH TYR A 71 -20.401 1.473 -0.862 1.00 0.00 O ATOM 0 H TYR A 71 -14.164 0.724 -2.235 1.00 0.00 H new ATOM 0 HA TYR A 71 -14.447 1.663 0.426 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -14.808 -0.988 -0.990 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -14.992 -0.874 0.749 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -16.768 0.681 1.696 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -16.540 -0.230 -2.460 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -19.082 1.450 1.400 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -18.853 0.541 -2.758 1.00 0.00 H new ATOM 0 HH TYR A 71 -20.659 1.379 -1.803 1.00 0.00 H new ATOM 1085 N SER A 72 -11.829 -0.169 -0.252 1.00 0.00 N ATOM 1086 CA SER A 72 -10.562 -0.658 0.278 1.00 0.00 C ATOM 1087 C SER A 72 -9.697 0.497 0.774 1.00 0.00 C ATOM 1088 O SER A 72 -8.689 0.841 0.157 1.00 0.00 O ATOM 1089 CB SER A 72 -9.811 -1.454 -0.791 1.00 0.00 C ATOM 1090 OG SER A 72 -10.275 -2.791 -0.853 1.00 0.00 O ATOM 0 H SER A 72 -11.930 -0.267 -1.262 1.00 0.00 H new ATOM 0 HA SER A 72 -10.778 -1.313 1.122 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.940 -0.976 -1.762 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.743 -1.446 -0.571 1.00 0.00 H new ATOM 0 HG SER A 72 -9.631 -3.382 -0.409 1.00 0.00 H new ATOM 1096 N ALA A 73 -10.100 1.093 1.891 1.00 0.00 N ATOM 1097 CA ALA A 73 -9.363 2.211 2.469 1.00 0.00 C ATOM 1098 C ALA A 73 -9.412 2.170 3.993 1.00 0.00 C ATOM 1099 O ALA A 73 -10.412 2.546 4.604 1.00 0.00 O ATOM 1100 CB ALA A 73 -9.921 3.531 1.958 1.00 0.00 C ATOM 0 H ALA A 73 -10.932 0.821 2.414 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.321 2.126 2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.362 4.357 2.397 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.830 3.568 0.872 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.971 3.615 2.238 1.00 0.00 H new ATOM 1106 N ILE A 74 -8.324 1.709 4.602 1.00 0.00 N ATOM 1107 CA ILE A 74 -8.242 1.619 6.055 1.00 0.00 C ATOM 1108 C ILE A 74 -7.403 2.756 6.629 1.00 0.00 C ATOM 1109 O ILE A 74 -7.647 3.217 7.745 1.00 0.00 O ATOM 1110 CB ILE A 74 -7.638 0.273 6.502 1.00 0.00 C ATOM 1111 CG1 ILE A 74 -8.357 -0.890 5.814 1.00 0.00 C ATOM 1112 CG2 ILE A 74 -7.719 0.131 8.015 1.00 0.00 C ATOM 1113 CD1 ILE A 74 -7.496 -2.125 5.660 1.00 0.00 C ATOM 0 H ILE A 74 -7.487 1.392 4.112 1.00 0.00 H new ATOM 0 HA ILE A 74 -9.261 1.695 6.435 1.00 0.00 H new ATOM 0 HB ILE A 74 -6.588 0.250 6.210 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.248 -1.147 6.388 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.694 -0.567 4.829 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.288 -0.825 8.314 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.165 0.942 8.487 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.762 0.173 8.329 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -8.069 -2.909 5.165 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.618 -1.884 5.061 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.180 -2.473 6.643 1.00 0.00 H new ATOM 1125 N TYR A 75 -6.416 3.203 5.861 1.00 0.00 N ATOM 1126 CA TYR A 75 -5.541 4.287 6.293 1.00 0.00 C ATOM 1127 C TYR A 75 -5.759 5.535 5.444 1.00 0.00 C ATOM 1128 O TYR A 75 -5.587 5.507 4.225 1.00 0.00 O ATOM 1129 CB TYR A 75 -4.077 3.852 6.213 1.00 0.00 C ATOM 1130 CG TYR A 75 -3.612 3.059 7.413 1.00 0.00 C ATOM 1131 CD1 TYR A 75 -4.018 1.743 7.598 1.00 0.00 C ATOM 1132 CD2 TYR A 75 -2.769 3.625 8.360 1.00 0.00 C ATOM 1133 CE1 TYR A 75 -3.596 1.013 8.694 1.00 0.00 C ATOM 1134 CE2 TYR A 75 -2.342 2.902 9.459 1.00 0.00 C ATOM 1135 CZ TYR A 75 -2.759 1.598 9.621 1.00 0.00 C ATOM 1136 OH TYR A 75 -2.336 0.876 10.713 1.00 0.00 O ATOM 0 H TYR A 75 -6.201 2.831 4.936 1.00 0.00 H new ATOM 0 HA TYR A 75 -5.786 4.526 7.328 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -3.934 3.252 5.314 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -3.449 4.737 6.108 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.674 1.283 6.874 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -2.441 4.647 8.236 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.920 -0.009 8.823 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -1.686 3.356 10.186 1.00 0.00 H new ATOM 0 HH TYR A 75 -1.751 1.434 11.267 1.00 0.00 H new ATOM 1146 N GLY A 76 -6.138 6.630 6.097 1.00 0.00 N ATOM 1147 CA GLY A 76 -6.373 7.873 5.386 1.00 0.00 C ATOM 1148 C GLY A 76 -7.838 8.086 5.059 1.00 0.00 C ATOM 1149 O GLY A 76 -8.329 9.214 5.089 1.00 0.00 O ATOM 0 H GLY A 76 -6.286 6.678 7.105 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.014 8.707 5.989 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.794 7.875 4.463 1.00 0.00 H new ATOM 1153 N ARG A 77 -8.537 7.000 4.746 1.00 0.00 N ATOM 1154 CA ARG A 77 -9.954 7.075 4.411 1.00 0.00 C ATOM 1155 C ARG A 77 -10.178 7.958 3.188 1.00 0.00 C ATOM 1156 O ARG A 77 -9.243 8.252 2.443 1.00 0.00 O ATOM 1157 CB ARG A 77 -10.752 7.611 5.603 1.00 0.00 C ATOM 1158 CG ARG A 77 -12.052 6.863 5.852 1.00 0.00 C ATOM 1159 CD ARG A 77 -11.793 5.450 6.344 1.00 0.00 C ATOM 1160 NE ARG A 77 -12.980 4.605 6.234 1.00 0.00 N ATOM 1161 CZ ARG A 77 -13.377 4.027 5.103 1.00 0.00 C ATOM 1162 NH1 ARG A 77 -12.686 4.201 3.983 1.00 0.00 N ATOM 1163 NH2 ARG A 77 -14.468 3.274 5.091 1.00 0.00 N ATOM 0 H ARG A 77 -8.146 6.059 4.717 1.00 0.00 H new ATOM 0 HA ARG A 77 -10.302 6.069 4.175 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -10.133 7.555 6.498 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -10.975 8.665 5.436 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -12.649 7.402 6.588 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -12.635 6.828 4.932 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -10.980 5.009 5.768 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -11.466 5.482 7.383 1.00 0.00 H new ATOM 0 HE ARG A 77 -13.537 4.449 7.074 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -11.846 4.780 3.987 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -12.995 3.756 3.119 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -15.003 3.138 5.949 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -14.772 2.831 4.224 1.00 0.00 H new ATOM 1177 N PHE A 78 -11.422 8.381 2.987 1.00 0.00 N ATOM 1178 CA PHE A 78 -11.766 9.232 1.854 1.00 0.00 C ATOM 1179 C PHE A 78 -11.744 10.704 2.249 1.00 0.00 C ATOM 1180 O PHE A 78 -11.464 11.574 1.425 1.00 0.00 O ATOM 1181 CB PHE A 78 -13.147 8.859 1.308 1.00 0.00 C ATOM 1182 CG PHE A 78 -14.191 8.690 2.373 1.00 0.00 C ATOM 1183 CD1 PHE A 78 -14.946 9.772 2.800 1.00 0.00 C ATOM 1184 CD2 PHE A 78 -14.420 7.450 2.949 1.00 0.00 C ATOM 1185 CE1 PHE A 78 -15.909 9.619 3.780 1.00 0.00 C ATOM 1186 CE2 PHE A 78 -15.380 7.293 3.930 1.00 0.00 C ATOM 1187 CZ PHE A 78 -16.125 8.378 4.346 1.00 0.00 C ATOM 0 H PHE A 78 -12.208 8.148 3.594 1.00 0.00 H new ATOM 0 HA PHE A 78 -11.020 9.073 1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -13.473 9.631 0.611 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -13.066 7.932 0.741 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -14.780 10.745 2.362 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -13.841 6.597 2.627 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -16.492 10.469 4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -15.548 6.322 4.371 1.00 0.00 H new ATOM 0 HZ PHE A 78 -16.876 8.257 5.113 1.00 0.00 H new ATOM 1197 N ASP A 79 -12.040 10.978 3.516 1.00 0.00 N ATOM 1198 CA ASP A 79 -12.052 12.347 4.018 1.00 0.00 C ATOM 1199 C ASP A 79 -11.270 12.459 5.324 1.00 0.00 C ATOM 1200 O ASP A 79 -11.524 13.350 6.136 1.00 0.00 O ATOM 1201 CB ASP A 79 -13.491 12.821 4.230 1.00 0.00 C ATOM 1202 CG ASP A 79 -13.673 14.286 3.887 1.00 0.00 C ATOM 1203 OD1 ASP A 79 -12.841 15.107 4.325 1.00 0.00 O ATOM 1204 OD2 ASP A 79 -14.649 14.613 3.178 1.00 0.00 O ATOM 0 H ASP A 79 -12.274 10.271 4.213 1.00 0.00 H new ATOM 0 HA ASP A 79 -11.571 12.983 3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -14.163 12.221 3.616 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -13.776 12.656 5.269 1.00 0.00 H new ATOM 1209 N SER A 80 -10.317 11.552 5.523 1.00 0.00 N ATOM 1210 CA SER A 80 -9.498 11.553 6.731 1.00 0.00 C ATOM 1211 C SER A 80 -10.370 11.512 7.984 1.00 0.00 C ATOM 1212 O SER A 80 -10.872 12.542 8.434 1.00 0.00 O ATOM 1213 CB SER A 80 -8.597 12.789 6.761 1.00 0.00 C ATOM 1214 OG SER A 80 -7.286 12.455 7.181 1.00 0.00 O ATOM 0 H SER A 80 -10.093 10.807 4.863 1.00 0.00 H new ATOM 0 HA SER A 80 -8.875 10.658 6.717 1.00 0.00 H new ATOM 0 HB2 SER A 80 -8.561 13.240 5.769 1.00 0.00 H new ATOM 0 HB3 SER A 80 -9.019 13.534 7.435 1.00 0.00 H new ATOM 0 HG SER A 80 -6.730 13.262 7.190 1.00 0.00 H new ATOM 1220 N LYS A 81 -10.545 10.319 8.540 1.00 0.00 N ATOM 1221 CA LYS A 81 -11.356 10.146 9.739 1.00 0.00 C ATOM 1222 C LYS A 81 -10.487 9.763 10.934 1.00 0.00 C ATOM 1223 O LYS A 81 -10.775 10.140 12.070 1.00 0.00 O ATOM 1224 CB LYS A 81 -12.426 9.078 9.507 1.00 0.00 C ATOM 1225 CG LYS A 81 -13.814 9.498 9.964 1.00 0.00 C ATOM 1226 CD LYS A 81 -14.763 8.314 10.025 1.00 0.00 C ATOM 1227 CE LYS A 81 -16.131 8.722 10.548 1.00 0.00 C ATOM 1228 NZ LYS A 81 -16.709 7.692 11.456 1.00 0.00 N ATOM 0 H LYS A 81 -10.136 9.457 8.180 1.00 0.00 H new ATOM 0 HA LYS A 81 -11.843 11.096 9.958 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.460 8.835 8.445 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.139 8.168 10.034 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -13.749 9.964 10.947 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -14.211 10.249 9.281 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.867 7.879 9.031 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.342 7.542 10.669 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -16.048 9.670 11.080 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -16.806 8.886 9.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -17.641 8.008 11.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.812 6.794 10.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.077 7.554 12.271 1.00 0.00 H new ATOM 1242 N ARG A 82 -9.422 9.014 10.669 1.00 0.00 N ATOM 1243 CA ARG A 82 -8.510 8.581 11.722 1.00 0.00 C ATOM 1244 C ARG A 82 -7.625 9.734 12.182 1.00 0.00 C ATOM 1245 O ARG A 82 -6.684 10.123 11.489 1.00 0.00 O ATOM 1246 CB ARG A 82 -7.643 7.421 11.229 1.00 0.00 C ATOM 1247 CG ARG A 82 -8.292 6.058 11.407 1.00 0.00 C ATOM 1248 CD ARG A 82 -7.632 5.008 10.529 1.00 0.00 C ATOM 1249 NE ARG A 82 -6.481 4.391 11.184 1.00 0.00 N ATOM 1250 CZ ARG A 82 -6.578 3.438 12.109 1.00 0.00 C ATOM 1251 NH1 ARG A 82 -7.768 2.991 12.490 1.00 0.00 N ATOM 1252 NH2 ARG A 82 -5.480 2.930 12.653 1.00 0.00 N ATOM 0 H ARG A 82 -9.169 8.694 9.734 1.00 0.00 H new ATOM 0 HA ARG A 82 -9.106 8.244 12.570 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.416 7.571 10.174 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.694 7.435 11.764 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -8.224 5.755 12.452 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -9.352 6.124 11.163 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -8.360 4.238 10.275 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.314 5.466 9.593 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.549 4.709 10.917 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.615 3.378 12.074 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -7.835 2.261 13.199 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.563 3.269 12.363 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.553 2.200 13.362 1.00 0.00 H new ATOM 1266 N LYS A 83 -7.930 10.276 13.356 1.00 0.00 N ATOM 1267 CA LYS A 83 -7.162 11.385 13.909 1.00 0.00 C ATOM 1268 C LYS A 83 -6.603 11.027 15.283 1.00 0.00 C ATOM 1269 O LYS A 83 -7.249 11.257 16.306 1.00 0.00 O ATOM 1270 CB LYS A 83 -8.035 12.639 14.011 1.00 0.00 C ATOM 1271 CG LYS A 83 -7.325 13.910 13.575 1.00 0.00 C ATOM 1272 CD LYS A 83 -8.080 15.151 14.023 1.00 0.00 C ATOM 1273 CE LYS A 83 -9.260 15.448 13.111 1.00 0.00 C ATOM 1274 NZ LYS A 83 -9.357 16.897 12.782 1.00 0.00 N ATOM 0 H LYS A 83 -8.704 9.965 13.943 1.00 0.00 H new ATOM 0 HA LYS A 83 -6.327 11.587 13.238 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -8.926 12.502 13.399 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.371 12.755 15.041 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -6.317 13.926 13.990 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -7.223 13.917 12.490 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -8.435 15.013 15.044 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -7.403 16.005 14.033 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -9.161 14.873 12.191 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.182 15.123 13.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.174 17.058 12.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -9.477 17.445 13.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -8.488 17.202 12.299 1.00 0.00 H new ATOM 1288 N ASP A 84 -5.399 10.463 15.297 1.00 0.00 N ATOM 1289 CA ASP A 84 -4.753 10.073 16.545 1.00 0.00 C ATOM 1290 C ASP A 84 -3.240 10.230 16.446 1.00 0.00 C ATOM 1291 O ASP A 84 -2.485 9.473 17.056 1.00 0.00 O ATOM 1292 CB ASP A 84 -5.106 8.627 16.896 1.00 0.00 C ATOM 1293 CG ASP A 84 -4.665 7.649 15.824 1.00 0.00 C ATOM 1294 OD1 ASP A 84 -4.702 8.018 14.632 1.00 0.00 O ATOM 1295 OD2 ASP A 84 -4.283 6.514 16.179 1.00 0.00 O ATOM 0 H ASP A 84 -4.852 10.266 14.459 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.117 10.730 17.335 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -4.636 8.361 17.843 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -6.183 8.543 17.040 1.00 0.00 H new ATOM 1300 N GLY A 85 -2.801 11.218 15.672 1.00 0.00 N ATOM 1301 CA GLY A 85 -1.380 11.456 15.507 1.00 0.00 C ATOM 1302 C GLY A 85 -0.718 10.420 14.620 1.00 0.00 C ATOM 1303 O GLY A 85 0.421 10.019 14.866 1.00 0.00 O ATOM 0 H GLY A 85 -3.405 11.858 15.156 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.228 12.447 15.079 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.898 11.454 16.485 1.00 0.00 H new ATOM 1307 N LYS A 86 -1.432 9.984 13.588 1.00 0.00 N ATOM 1308 CA LYS A 86 -0.907 8.988 12.662 1.00 0.00 C ATOM 1309 C LYS A 86 -1.267 9.339 11.222 1.00 0.00 C ATOM 1310 O LYS A 86 -2.410 9.167 10.798 1.00 0.00 O ATOM 1311 CB LYS A 86 -1.449 7.600 13.011 1.00 0.00 C ATOM 1312 CG LYS A 86 -0.676 6.464 12.363 1.00 0.00 C ATOM 1313 CD LYS A 86 0.743 6.376 12.904 1.00 0.00 C ATOM 1314 CE LYS A 86 1.406 5.063 12.519 1.00 0.00 C ATOM 1315 NZ LYS A 86 1.218 4.019 13.564 1.00 0.00 N ATOM 0 H LYS A 86 -2.376 10.305 13.372 1.00 0.00 H new ATOM 0 HA LYS A 86 0.179 8.981 12.754 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.427 7.472 14.093 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.493 7.539 12.704 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -1.194 5.522 12.542 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -0.647 6.612 11.283 1.00 0.00 H new ATOM 0 HD2 LYS A 86 1.332 7.209 12.520 1.00 0.00 H new ATOM 0 HD3 LYS A 86 0.726 6.472 13.990 1.00 0.00 H new ATOM 0 HE2 LYS A 86 0.992 4.710 11.575 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.471 5.228 12.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.685 3.139 13.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 1.636 4.344 14.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 0.202 3.843 13.700 1.00 0.00 H new ATOM 1329 N HIS A 87 -0.285 9.833 10.476 1.00 0.00 N ATOM 1330 CA HIS A 87 -0.499 10.209 9.082 1.00 0.00 C ATOM 1331 C HIS A 87 0.136 9.192 8.140 1.00 0.00 C ATOM 1332 O HIS A 87 0.766 8.231 8.581 1.00 0.00 O ATOM 1333 CB HIS A 87 0.079 11.599 8.814 1.00 0.00 C ATOM 1334 CG HIS A 87 -0.581 12.686 9.604 1.00 0.00 C ATOM 1335 ND1 HIS A 87 -0.715 12.644 10.976 1.00 0.00 N ATOM 1336 CD2 HIS A 87 -1.145 13.852 9.209 1.00 0.00 C ATOM 1337 CE1 HIS A 87 -1.334 13.736 11.390 1.00 0.00 C ATOM 1338 NE2 HIS A 87 -1.604 14.485 10.337 1.00 0.00 N ATOM 0 H HIS A 87 0.666 9.983 10.812 1.00 0.00 H new ATOM 0 HA HIS A 87 -1.573 10.227 8.897 1.00 0.00 H new ATOM 0 HB2 HIS A 87 1.145 11.590 9.044 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -0.017 11.824 7.752 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -1.220 14.216 8.195 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -1.577 13.975 12.415 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -2.077 15.388 10.358 1.00 0.00 H new ATOM 1347 N LEU A 88 -0.033 9.411 6.840 1.00 0.00 N ATOM 1348 CA LEU A 88 0.525 8.515 5.834 1.00 0.00 C ATOM 1349 C LEU A 88 1.965 8.894 5.508 1.00 0.00 C ATOM 1350 O LEU A 88 2.216 9.816 4.733 1.00 0.00 O ATOM 1351 CB LEU A 88 -0.325 8.550 4.562 1.00 0.00 C ATOM 1352 CG LEU A 88 -1.833 8.437 4.786 1.00 0.00 C ATOM 1353 CD1 LEU A 88 -2.591 8.893 3.549 1.00 0.00 C ATOM 1354 CD2 LEU A 88 -2.212 7.009 5.151 1.00 0.00 C ATOM 0 H LEU A 88 -0.552 10.202 6.458 1.00 0.00 H new ATOM 0 HA LEU A 88 0.518 7.503 6.240 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.121 9.481 4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.008 7.736 3.910 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.108 9.088 5.616 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.663 8.806 3.726 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -2.342 9.932 3.332 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.312 8.269 2.700 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.289 6.947 5.307 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.923 6.338 4.342 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.696 6.718 6.066 1.00 0.00 H new ATOM 1366 N THR A 89 2.910 8.174 6.106 1.00 0.00 N ATOM 1367 CA THR A 89 4.327 8.435 5.879 1.00 0.00 C ATOM 1368 C THR A 89 4.902 7.462 4.854 1.00 0.00 C ATOM 1369 O THR A 89 5.677 7.851 3.981 1.00 0.00 O ATOM 1370 CB THR A 89 5.103 8.327 7.192 1.00 0.00 C ATOM 1371 OG1 THR A 89 6.491 8.501 6.971 1.00 0.00 O ATOM 1372 CG2 THR A 89 4.913 6.999 7.892 1.00 0.00 C ATOM 0 H THR A 89 2.720 7.407 6.750 1.00 0.00 H new ATOM 0 HA THR A 89 4.426 9.448 5.488 1.00 0.00 H new ATOM 0 HB THR A 89 4.703 9.116 7.829 1.00 0.00 H new ATOM 0 HG1 THR A 89 6.969 8.430 7.823 1.00 0.00 H new ATOM 0 HG21 THR A 89 5.491 6.989 8.816 1.00 0.00 H new ATOM 0 HG22 THR A 89 3.857 6.857 8.122 1.00 0.00 H new ATOM 0 HG23 THR A 89 5.254 6.193 7.242 1.00 0.00 H new ATOM 1380 N LEU A 90 4.517 6.195 4.969 1.00 0.00 N ATOM 1381 CA LEU A 90 4.994 5.166 4.052 1.00 0.00 C ATOM 1382 C LEU A 90 4.331 3.825 4.347 1.00 0.00 C ATOM 1383 O LEU A 90 3.582 3.297 3.525 1.00 0.00 O ATOM 1384 CB LEU A 90 6.515 5.028 4.155 1.00 0.00 C ATOM 1385 CG LEU A 90 7.161 4.153 3.080 1.00 0.00 C ATOM 1386 CD1 LEU A 90 7.223 4.896 1.754 1.00 0.00 C ATOM 1387 CD2 LEU A 90 8.552 3.716 3.513 1.00 0.00 C ATOM 0 H LEU A 90 3.877 5.857 5.687 1.00 0.00 H new ATOM 0 HA LEU A 90 4.730 5.467 3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.959 6.022 4.107 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.761 4.616 5.134 1.00 0.00 H new ATOM 0 HG LEU A 90 6.547 3.262 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.686 4.258 1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.214 5.159 1.437 1.00 0.00 H new ATOM 0 HD13 LEU A 90 7.814 5.804 1.873 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.996 3.094 2.736 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.176 4.595 3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 90 8.482 3.145 4.439 1.00 0.00 H new ATOM 1399 N HIS A 91 4.609 3.280 5.527 1.00 0.00 N ATOM 1400 CA HIS A 91 4.039 2.001 5.932 1.00 0.00 C ATOM 1401 C HIS A 91 2.516 2.066 5.961 1.00 0.00 C ATOM 1402 O HIS A 91 1.838 1.069 5.713 1.00 0.00 O ATOM 1403 CB HIS A 91 4.570 1.596 7.309 1.00 0.00 C ATOM 1404 CG HIS A 91 4.358 0.149 7.631 1.00 0.00 C ATOM 1405 ND1 HIS A 91 4.361 -0.343 8.919 1.00 0.00 N ATOM 1406 CD2 HIS A 91 4.133 -0.915 6.824 1.00 0.00 C ATOM 1407 CE1 HIS A 91 4.149 -1.648 8.891 1.00 0.00 C ATOM 1408 NE2 HIS A 91 4.007 -2.019 7.632 1.00 0.00 N ATOM 0 H HIS A 91 5.226 3.705 6.219 1.00 0.00 H new ATOM 0 HA HIS A 91 4.337 1.251 5.199 1.00 0.00 H new ATOM 0 HB2 HIS A 91 5.636 1.818 7.358 1.00 0.00 H new ATOM 0 HB3 HIS A 91 4.082 2.204 8.071 1.00 0.00 H new ATOM 0 HD1 HIS A 91 4.504 0.213 9.762 1.00 0.00 H new ATOM 0 HD2 HIS A 91 4.065 -0.899 5.746 1.00 0.00 H new ATOM 0 HE1 HIS A 91 4.100 -2.299 9.751 1.00 0.00 H new ATOM 1417 N GLU A 92 1.984 3.246 6.265 1.00 0.00 N ATOM 1418 CA GLU A 92 0.540 3.440 6.326 1.00 0.00 C ATOM 1419 C GLU A 92 -0.087 3.304 4.943 1.00 0.00 C ATOM 1420 O GLU A 92 -1.082 2.601 4.768 1.00 0.00 O ATOM 1421 CB GLU A 92 0.214 4.814 6.914 1.00 0.00 C ATOM 1422 CG GLU A 92 0.272 4.854 8.433 1.00 0.00 C ATOM 1423 CD GLU A 92 1.685 5.011 8.959 1.00 0.00 C ATOM 1424 OE1 GLU A 92 2.455 4.029 8.896 1.00 0.00 O ATOM 1425 OE2 GLU A 92 2.022 6.117 9.433 1.00 0.00 O ATOM 0 H GLU A 92 2.531 4.081 6.473 1.00 0.00 H new ATOM 0 HA GLU A 92 0.122 2.667 6.971 1.00 0.00 H new ATOM 0 HB2 GLU A 92 0.913 5.547 6.512 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -0.783 5.112 6.589 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.340 5.680 8.795 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.161 3.937 8.834 1.00 0.00 H new ATOM 1432 N LEU A 93 0.503 3.980 3.961 1.00 0.00 N ATOM 1433 CA LEU A 93 0.001 3.932 2.592 1.00 0.00 C ATOM 1434 C LEU A 93 0.019 2.504 2.056 1.00 0.00 C ATOM 1435 O LEU A 93 -0.816 2.127 1.234 1.00 0.00 O ATOM 1436 CB LEU A 93 0.838 4.842 1.689 1.00 0.00 C ATOM 1437 CG LEU A 93 0.167 6.160 1.298 1.00 0.00 C ATOM 1438 CD1 LEU A 93 1.061 6.956 0.360 1.00 0.00 C ATOM 1439 CD2 LEU A 93 -1.185 5.896 0.651 1.00 0.00 C ATOM 0 H LEU A 93 1.328 4.566 4.088 1.00 0.00 H new ATOM 0 HA LEU A 93 -1.030 4.285 2.595 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.777 5.066 2.195 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.088 4.295 0.780 1.00 0.00 H new ATOM 0 HG LEU A 93 0.008 6.748 2.202 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.567 7.890 0.093 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.006 7.174 0.857 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.251 6.375 -0.542 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.649 6.844 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.048 5.289 -0.244 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.828 5.366 1.354 1.00 0.00 H new ATOM 1451 N THR A 94 0.976 1.712 2.530 1.00 0.00 N ATOM 1452 CA THR A 94 1.105 0.325 2.099 1.00 0.00 C ATOM 1453 C THR A 94 -0.108 -0.494 2.530 1.00 0.00 C ATOM 1454 O THR A 94 -0.566 -1.373 1.802 1.00 0.00 O ATOM 1455 CB THR A 94 2.381 -0.292 2.674 1.00 0.00 C ATOM 1456 OG1 THR A 94 3.306 0.717 3.039 1.00 0.00 O ATOM 1457 CG2 THR A 94 3.080 -1.228 1.711 1.00 0.00 C ATOM 0 H THR A 94 1.674 2.008 3.213 1.00 0.00 H new ATOM 0 HA THR A 94 1.161 0.312 1.011 1.00 0.00 H new ATOM 0 HB THR A 94 2.058 -0.865 3.543 1.00 0.00 H new ATOM 0 HG1 THR A 94 4.169 0.307 3.255 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.977 -1.631 2.181 1.00 0.00 H new ATOM 0 HG22 THR A 94 2.410 -2.046 1.448 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.357 -0.682 0.809 1.00 0.00 H new ATOM 1465 N VAL A 95 -0.621 -0.199 3.720 1.00 0.00 N ATOM 1466 CA VAL A 95 -1.779 -0.908 4.251 1.00 0.00 C ATOM 1467 C VAL A 95 -3.042 -0.569 3.465 1.00 0.00 C ATOM 1468 O VAL A 95 -3.949 -1.394 3.344 1.00 0.00 O ATOM 1469 CB VAL A 95 -2.008 -0.575 5.737 1.00 0.00 C ATOM 1470 CG1 VAL A 95 -3.089 -1.469 6.325 1.00 0.00 C ATOM 1471 CG2 VAL A 95 -0.710 -0.708 6.519 1.00 0.00 C ATOM 0 H VAL A 95 -0.253 0.527 4.335 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.569 -1.973 4.152 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.346 0.459 5.812 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.237 -1.219 7.376 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.022 -1.318 5.782 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.785 -2.512 6.240 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.891 -0.469 7.567 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.340 -1.730 6.438 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.032 -0.020 6.113 1.00 0.00 H new ATOM 1481 N ASN A 96 -3.096 0.647 2.934 1.00 0.00 N ATOM 1482 CA ASN A 96 -4.249 1.093 2.161 1.00 0.00 C ATOM 1483 C ASN A 96 -4.424 0.246 0.905 1.00 0.00 C ATOM 1484 O ASN A 96 -5.488 -0.331 0.677 1.00 0.00 O ATOM 1485 CB ASN A 96 -4.094 2.567 1.778 1.00 0.00 C ATOM 1486 CG ASN A 96 -5.402 3.189 1.331 1.00 0.00 C ATOM 1487 OD1 ASN A 96 -6.266 2.513 0.771 1.00 0.00 O ATOM 1488 ND2 ASN A 96 -5.555 4.485 1.577 1.00 0.00 N ATOM 0 H ASN A 96 -2.355 1.342 3.025 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.137 0.977 2.782 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.704 3.122 2.631 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.360 2.656 0.977 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -6.415 4.959 1.299 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -4.813 5.007 2.044 1.00 0.00 H new ATOM 1495 N GLU A 97 -3.375 0.177 0.092 1.00 0.00 N ATOM 1496 CA GLU A 97 -3.413 -0.599 -1.143 1.00 0.00 C ATOM 1497 C GLU A 97 -3.216 -2.088 -0.864 1.00 0.00 C ATOM 1498 O GLU A 97 -3.608 -2.934 -1.667 1.00 0.00 O ATOM 1499 CB GLU A 97 -2.340 -0.101 -2.114 1.00 0.00 C ATOM 1500 CG GLU A 97 -2.864 0.885 -3.144 1.00 0.00 C ATOM 1501 CD GLU A 97 -1.982 0.964 -4.376 1.00 0.00 C ATOM 1502 OE1 GLU A 97 -1.475 -0.091 -4.812 1.00 0.00 O ATOM 1503 OE2 GLU A 97 -1.799 2.081 -4.904 1.00 0.00 O ATOM 0 H GLU A 97 -2.488 0.649 0.266 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.395 -0.464 -1.596 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.538 0.371 -1.546 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -1.904 -0.956 -2.630 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.872 0.594 -3.441 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -2.938 1.873 -2.691 1.00 0.00 H new ATOM 1510 N ALA A 98 -2.606 -2.402 0.276 1.00 0.00 N ATOM 1511 CA ALA A 98 -2.358 -3.788 0.653 1.00 0.00 C ATOM 1512 C ALA A 98 -3.647 -4.604 0.637 1.00 0.00 C ATOM 1513 O ALA A 98 -3.683 -5.715 0.109 1.00 0.00 O ATOM 1514 CB ALA A 98 -1.709 -3.853 2.027 1.00 0.00 C ATOM 0 H ALA A 98 -2.275 -1.715 0.953 1.00 0.00 H new ATOM 0 HA ALA A 98 -1.677 -4.220 -0.081 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.530 -4.894 2.296 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.761 -3.315 2.008 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -2.370 -3.397 2.764 1.00 0.00 H new ATOM 1520 N ALA A 99 -4.703 -4.045 1.220 1.00 0.00 N ATOM 1521 CA ALA A 99 -5.992 -4.723 1.272 1.00 0.00 C ATOM 1522 C ALA A 99 -6.920 -4.236 0.161 1.00 0.00 C ATOM 1523 O ALA A 99 -8.142 -4.315 0.282 1.00 0.00 O ATOM 1524 CB ALA A 99 -6.642 -4.516 2.631 1.00 0.00 C ATOM 0 H ALA A 99 -4.691 -3.126 1.662 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.818 -5.788 1.121 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.604 -5.028 2.656 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -5.995 -4.921 3.409 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.793 -3.450 2.803 1.00 0.00 H new ATOM 1530 N ALA A 100 -6.331 -3.734 -0.920 1.00 0.00 N ATOM 1531 CA ALA A 100 -7.106 -3.238 -2.050 1.00 0.00 C ATOM 1532 C ALA A 100 -7.160 -4.269 -3.171 1.00 0.00 C ATOM 1533 O ALA A 100 -8.161 -4.380 -3.879 1.00 0.00 O ATOM 1534 CB ALA A 100 -6.517 -1.931 -2.561 1.00 0.00 C ATOM 0 H ALA A 100 -5.320 -3.660 -1.036 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.125 -3.056 -1.709 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -7.106 -1.572 -3.405 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.535 -1.188 -1.764 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.488 -2.096 -2.880 1.00 0.00 H new ATOM 1540 N GLN A 101 -6.076 -5.021 -3.327 1.00 0.00 N ATOM 1541 CA GLN A 101 -5.996 -6.044 -4.362 1.00 0.00 C ATOM 1542 C GLN A 101 -6.472 -7.394 -3.835 1.00 0.00 C ATOM 1543 O GLN A 101 -7.013 -8.207 -4.583 1.00 0.00 O ATOM 1544 CB GLN A 101 -4.560 -6.161 -4.876 1.00 0.00 C ATOM 1545 CG GLN A 101 -4.081 -4.927 -5.623 1.00 0.00 C ATOM 1546 CD GLN A 101 -2.705 -5.115 -6.234 1.00 0.00 C ATOM 1547 OE1 GLN A 101 -2.574 -5.357 -7.434 1.00 0.00 O ATOM 1548 NE2 GLN A 101 -1.670 -5.004 -5.409 1.00 0.00 N ATOM 0 H GLN A 101 -5.240 -4.941 -2.749 1.00 0.00 H new ATOM 0 HA GLN A 101 -6.649 -5.748 -5.183 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.895 -6.347 -4.033 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.488 -7.026 -5.535 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.794 -4.683 -6.410 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.059 -4.078 -4.939 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.825 -4.802 -4.421 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -0.721 -5.120 -5.763 1.00 0.00 H new ATOM 1557 N LEU A 102 -6.266 -7.626 -2.542 1.00 0.00 N ATOM 1558 CA LEU A 102 -6.675 -8.879 -1.916 1.00 0.00 C ATOM 1559 C LEU A 102 -8.180 -9.087 -2.043 1.00 0.00 C ATOM 1560 O LEU A 102 -8.641 -10.191 -2.328 1.00 0.00 O ATOM 1561 CB LEU A 102 -6.269 -8.893 -0.441 1.00 0.00 C ATOM 1562 CG LEU A 102 -4.774 -9.085 -0.181 1.00 0.00 C ATOM 1563 CD1 LEU A 102 -4.417 -8.645 1.230 1.00 0.00 C ATOM 1564 CD2 LEU A 102 -4.377 -10.537 -0.405 1.00 0.00 C ATOM 0 H LEU A 102 -5.819 -6.964 -1.908 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.170 -9.695 -2.433 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.584 -7.954 0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -6.815 -9.691 0.062 1.00 0.00 H new ATOM 0 HG LEU A 102 -4.219 -8.464 -0.884 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.350 -8.789 1.397 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -4.665 -7.591 1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.980 -9.239 1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -3.310 -10.656 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -4.940 -11.177 0.275 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.596 -10.820 -1.435 1.00 0.00 H new ATOM 1576 N CYS A 103 -8.940 -8.018 -1.831 1.00 0.00 N ATOM 1577 CA CYS A 103 -10.394 -8.084 -1.922 1.00 0.00 C ATOM 1578 C CYS A 103 -10.834 -8.522 -3.315 1.00 0.00 C ATOM 1579 O CYS A 103 -11.832 -9.225 -3.470 1.00 0.00 O ATOM 1580 CB CYS A 103 -11.011 -6.724 -1.586 1.00 0.00 C ATOM 1581 SG CYS A 103 -11.290 -6.458 0.181 1.00 0.00 S ATOM 0 H CYS A 103 -8.573 -7.096 -1.595 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.743 -8.823 -1.200 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -10.357 -5.937 -1.962 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -11.961 -6.628 -2.112 1.00 0.00 H new ATOM 0 HG CYS A 103 -11.400 -5.184 0.416 1.00 0.00 H new ATOM 1587 N VAL A 104 -10.080 -8.103 -4.327 1.00 0.00 N ATOM 1588 CA VAL A 104 -10.391 -8.454 -5.707 1.00 0.00 C ATOM 1589 C VAL A 104 -10.346 -9.963 -5.914 1.00 0.00 C ATOM 1590 O VAL A 104 -11.209 -10.535 -6.581 1.00 0.00 O ATOM 1591 CB VAL A 104 -9.414 -7.783 -6.691 1.00 0.00 C ATOM 1592 CG1 VAL A 104 -9.869 -7.998 -8.126 1.00 0.00 C ATOM 1593 CG2 VAL A 104 -9.282 -6.299 -6.383 1.00 0.00 C ATOM 0 H VAL A 104 -9.250 -7.520 -4.217 1.00 0.00 H new ATOM 0 HA VAL A 104 -11.400 -8.093 -5.905 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.434 -8.244 -6.572 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.166 -7.517 -8.806 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.907 -9.066 -8.339 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.860 -7.565 -8.262 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.588 -5.841 -7.088 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.257 -5.821 -6.472 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.906 -6.170 -5.368 1.00 0.00 H new ATOM 1603 N LYS A 105 -9.334 -10.605 -5.338 1.00 0.00 N ATOM 1604 CA LYS A 105 -9.177 -12.050 -5.460 1.00 0.00 C ATOM 1605 C LYS A 105 -10.227 -12.782 -4.632 1.00 0.00 C ATOM 1606 O LYS A 105 -10.722 -13.837 -5.029 1.00 0.00 O ATOM 1607 CB LYS A 105 -7.775 -12.470 -5.013 1.00 0.00 C ATOM 1608 CG LYS A 105 -6.660 -11.759 -5.763 1.00 0.00 C ATOM 1609 CD LYS A 105 -6.173 -12.581 -6.947 1.00 0.00 C ATOM 1610 CE LYS A 105 -4.852 -12.057 -7.487 1.00 0.00 C ATOM 1611 NZ LYS A 105 -4.913 -11.802 -8.953 1.00 0.00 N ATOM 0 H LYS A 105 -8.611 -10.148 -4.783 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.313 -12.319 -6.507 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.668 -12.272 -3.946 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.666 -13.546 -5.150 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -7.016 -10.790 -6.113 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.828 -11.567 -5.085 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -6.056 -13.622 -6.645 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -6.923 -12.561 -7.737 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -4.588 -11.135 -6.969 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -4.062 -12.778 -7.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -4.029 -11.351 -9.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -5.038 -12.703 -9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -5.714 -11.173 -9.163 1.00 0.00 H new ATOM 1625 N ASP A 106 -10.565 -12.214 -3.478 1.00 0.00 N ATOM 1626 CA ASP A 106 -11.558 -12.814 -2.593 1.00 0.00 C ATOM 1627 C ASP A 106 -12.591 -11.780 -2.158 1.00 0.00 C ATOM 1628 O ASP A 106 -12.320 -10.940 -1.300 1.00 0.00 O ATOM 1629 CB ASP A 106 -10.878 -13.422 -1.366 1.00 0.00 C ATOM 1630 CG ASP A 106 -10.552 -14.890 -1.556 1.00 0.00 C ATOM 1631 OD1 ASP A 106 -10.240 -15.287 -2.698 1.00 0.00 O ATOM 1632 OD2 ASP A 106 -10.607 -15.644 -0.561 1.00 0.00 O ATOM 0 H ASP A 106 -10.166 -11.340 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 106 -12.070 -13.604 -3.143 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -9.961 -12.873 -1.153 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -11.528 -13.306 -0.499 1.00 0.00 H new ATOM 1637 N ASN A 107 -13.776 -11.848 -2.755 1.00 0.00 N ATOM 1638 CA ASN A 107 -14.852 -10.918 -2.429 1.00 0.00 C ATOM 1639 C ASN A 107 -15.289 -11.078 -0.977 1.00 0.00 C ATOM 1640 O ASN A 107 -15.742 -10.123 -0.345 1.00 0.00 O ATOM 1641 CB ASN A 107 -16.043 -11.139 -3.363 1.00 0.00 C ATOM 1642 CG ASN A 107 -16.613 -9.837 -3.891 1.00 0.00 C ATOM 1643 OD1 ASN A 107 -15.776 -9.055 -4.565 1.00 0.00 O flip ATOM 1644 ND2 ASN A 107 -17.791 -9.537 -3.697 1.00 0.00 N flip ATOM 0 H ASN A 107 -14.016 -12.537 -3.467 1.00 0.00 H new ATOM 0 HA ASN A 107 -14.477 -9.904 -2.564 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -15.733 -11.763 -4.201 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -16.822 -11.684 -2.831 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -18.398 -10.168 -3.174 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -18.160 -8.658 -4.059 1.00 0.00 H new ATOM 1651 N ALA A 108 -15.152 -12.292 -0.452 1.00 0.00 N ATOM 1652 CA ALA A 108 -15.533 -12.577 0.927 1.00 0.00 C ATOM 1653 C ALA A 108 -14.777 -11.684 1.905 1.00 0.00 C ATOM 1654 O ALA A 108 -15.276 -11.368 2.985 1.00 0.00 O ATOM 1655 CB ALA A 108 -15.285 -14.043 1.250 1.00 0.00 C ATOM 0 H ALA A 108 -14.780 -13.094 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.597 -12.366 1.033 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.574 -14.242 2.282 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.876 -14.668 0.581 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.227 -14.271 1.119 1.00 0.00 H new ATOM 1661 N LEU A 109 -13.571 -11.280 1.520 1.00 0.00 N ATOM 1662 CA LEU A 109 -12.745 -10.424 2.365 1.00 0.00 C ATOM 1663 C LEU A 109 -13.423 -9.077 2.603 1.00 0.00 C ATOM 1664 O LEU A 109 -13.211 -8.440 3.636 1.00 0.00 O ATOM 1665 CB LEU A 109 -11.373 -10.210 1.724 1.00 0.00 C ATOM 1666 CG LEU A 109 -10.325 -11.269 2.070 1.00 0.00 C ATOM 1667 CD1 LEU A 109 -9.106 -11.128 1.171 1.00 0.00 C ATOM 1668 CD2 LEU A 109 -9.926 -11.164 3.534 1.00 0.00 C ATOM 0 H LEU A 109 -13.144 -11.531 0.629 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.616 -10.921 3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.495 -10.182 0.641 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.995 -9.234 2.028 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.761 -12.254 1.902 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.371 -11.890 1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.405 -11.254 0.130 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.667 -10.139 1.306 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.180 -11.925 3.763 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.508 -10.176 3.727 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -10.804 -11.316 4.162 1.00 0.00 H new ATOM 1680 N LEU A 110 -14.237 -8.648 1.644 1.00 0.00 N ATOM 1681 CA LEU A 110 -14.943 -7.377 1.751 1.00 0.00 C ATOM 1682 C LEU A 110 -15.833 -7.349 2.988 1.00 0.00 C ATOM 1683 O LEU A 110 -16.008 -6.304 3.615 1.00 0.00 O ATOM 1684 CB LEU A 110 -15.785 -7.131 0.498 1.00 0.00 C ATOM 1685 CG LEU A 110 -14.995 -6.700 -0.739 1.00 0.00 C ATOM 1686 CD1 LEU A 110 -15.876 -6.744 -1.978 1.00 0.00 C ATOM 1687 CD2 LEU A 110 -14.416 -5.307 -0.542 1.00 0.00 C ATOM 0 H LEU A 110 -14.424 -9.163 0.783 1.00 0.00 H new ATOM 0 HA LEU A 110 -14.200 -6.585 1.844 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -16.332 -8.044 0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -16.527 -6.364 0.722 1.00 0.00 H new ATOM 0 HG LEU A 110 -14.170 -7.398 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -15.297 -6.434 -2.848 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -16.242 -7.760 -2.129 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -16.722 -6.070 -1.847 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -13.857 -5.016 -1.431 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -15.226 -4.597 -0.374 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -13.750 -5.309 0.321 1.00 0.00 H new ATOM 1699 N THR A 111 -16.395 -8.503 3.336 1.00 0.00 N ATOM 1700 CA THR A 111 -17.268 -8.608 4.499 1.00 0.00 C ATOM 1701 C THR A 111 -16.452 -8.766 5.778 1.00 0.00 C ATOM 1702 O THR A 111 -16.872 -8.332 6.851 1.00 0.00 O ATOM 1703 CB THR A 111 -18.226 -9.790 4.341 1.00 0.00 C ATOM 1704 OG1 THR A 111 -17.518 -10.964 3.983 1.00 0.00 O ATOM 1705 CG2 THR A 111 -19.293 -9.560 3.292 1.00 0.00 C ATOM 0 H THR A 111 -16.261 -9.378 2.829 1.00 0.00 H new ATOM 0 HA THR A 111 -17.848 -7.688 4.570 1.00 0.00 H new ATOM 0 HB THR A 111 -18.711 -9.901 5.311 1.00 0.00 H new ATOM 0 HG1 THR A 111 -16.556 -10.810 4.087 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.938 -10.436 3.231 1.00 0.00 H new ATOM 0 HG22 THR A 111 -19.889 -8.689 3.564 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.821 -9.389 2.324 1.00 0.00 H new ATOM 1713 N ARG A 112 -15.285 -9.390 5.657 1.00 0.00 N ATOM 1714 CA ARG A 112 -14.411 -9.604 6.804 1.00 0.00 C ATOM 1715 C ARG A 112 -13.242 -8.625 6.786 1.00 0.00 C ATOM 1716 O ARG A 112 -12.288 -8.794 6.028 1.00 0.00 O ATOM 1717 CB ARG A 112 -13.887 -11.042 6.808 1.00 0.00 C ATOM 1718 CG ARG A 112 -14.986 -12.090 6.906 1.00 0.00 C ATOM 1719 CD ARG A 112 -14.732 -13.063 8.045 1.00 0.00 C ATOM 1720 NE ARG A 112 -14.135 -14.311 7.576 1.00 0.00 N ATOM 1721 CZ ARG A 112 -14.015 -15.404 8.327 1.00 0.00 C ATOM 1722 NH1 ARG A 112 -14.449 -15.407 9.581 1.00 0.00 N ATOM 1723 NH2 ARG A 112 -13.459 -16.496 7.821 1.00 0.00 N ATOM 0 H ARG A 112 -14.923 -9.756 4.777 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.991 -9.432 7.711 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -13.313 -11.213 5.897 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -13.201 -11.168 7.646 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -15.947 -11.597 7.055 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -15.051 -12.638 5.966 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -14.072 -12.599 8.778 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.672 -13.279 8.553 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.790 -14.347 6.617 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.877 -14.569 9.974 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.354 -16.247 10.151 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -13.124 -16.498 6.858 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.366 -17.334 8.395 1.00 0.00 H new ATOM 1737 N ARG A 113 -13.325 -7.599 7.628 1.00 0.00 N ATOM 1738 CA ARG A 113 -12.275 -6.590 7.709 1.00 0.00 C ATOM 1739 C ARG A 113 -11.078 -7.112 8.498 1.00 0.00 C ATOM 1740 O ARG A 113 -9.937 -6.738 8.233 1.00 0.00 O ATOM 1741 CB ARG A 113 -12.814 -5.316 8.363 1.00 0.00 C ATOM 1742 CG ARG A 113 -14.144 -4.854 7.789 1.00 0.00 C ATOM 1743 CD ARG A 113 -13.984 -3.601 6.941 1.00 0.00 C ATOM 1744 NE ARG A 113 -14.356 -2.394 7.673 1.00 0.00 N ATOM 1745 CZ ARG A 113 -14.285 -1.166 7.163 1.00 0.00 C ATOM 1746 NH1 ARG A 113 -13.856 -0.980 5.920 1.00 0.00 N ATOM 1747 NH2 ARG A 113 -14.643 -0.121 7.898 1.00 0.00 N ATOM 0 H ARG A 113 -14.108 -7.445 8.263 1.00 0.00 H new ATOM 0 HA ARG A 113 -11.947 -6.360 6.695 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -12.929 -5.488 9.433 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.080 -4.519 8.245 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -14.576 -5.651 7.184 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -14.843 -4.657 8.602 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.949 -3.518 6.608 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -14.601 -3.687 6.047 1.00 0.00 H new ATOM 0 HE ARG A 113 -14.690 -2.497 8.631 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.579 -1.780 5.351 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.804 -0.037 5.534 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -14.972 -0.258 8.853 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -14.589 0.820 7.508 1.00 0.00 H new ATOM 1761 N ASP A 114 -11.349 -7.978 9.470 1.00 0.00 N ATOM 1762 CA ASP A 114 -10.293 -8.552 10.297 1.00 0.00 C ATOM 1763 C ASP A 114 -9.345 -9.402 9.460 1.00 0.00 C ATOM 1764 O ASP A 114 -8.129 -9.214 9.497 1.00 0.00 O ATOM 1765 CB ASP A 114 -10.899 -9.396 11.420 1.00 0.00 C ATOM 1766 CG ASP A 114 -11.889 -8.614 12.261 1.00 0.00 C ATOM 1767 OD1 ASP A 114 -11.444 -7.801 13.099 1.00 0.00 O ATOM 1768 OD2 ASP A 114 -13.108 -8.815 12.085 1.00 0.00 O ATOM 0 H ASP A 114 -12.289 -8.297 9.704 1.00 0.00 H new ATOM 0 HA ASP A 114 -9.723 -7.732 10.734 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -11.398 -10.264 10.989 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -10.100 -9.772 12.060 1.00 0.00 H new ATOM 1773 N GLU A 115 -9.908 -10.341 8.707 1.00 0.00 N ATOM 1774 CA GLU A 115 -9.111 -11.222 7.860 1.00 0.00 C ATOM 1775 C GLU A 115 -8.376 -10.427 6.786 1.00 0.00 C ATOM 1776 O GLU A 115 -7.282 -10.800 6.364 1.00 0.00 O ATOM 1777 CB GLU A 115 -10.003 -12.282 7.210 1.00 0.00 C ATOM 1778 CG GLU A 115 -9.340 -13.644 7.089 1.00 0.00 C ATOM 1779 CD GLU A 115 -8.858 -14.178 8.423 1.00 0.00 C ATOM 1780 OE1 GLU A 115 -9.700 -14.368 9.326 1.00 0.00 O ATOM 1781 OE2 GLU A 115 -7.638 -14.406 8.566 1.00 0.00 O ATOM 0 H GLU A 115 -10.913 -10.512 8.666 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.370 -11.717 8.488 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -10.918 -12.383 7.794 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.295 -11.940 6.217 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -10.046 -14.350 6.653 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -8.495 -13.573 6.404 1.00 0.00 H new ATOM 1788 N LEU A 116 -8.986 -9.331 6.346 1.00 0.00 N ATOM 1789 CA LEU A 116 -8.389 -8.484 5.320 1.00 0.00 C ATOM 1790 C LEU A 116 -7.278 -7.619 5.906 1.00 0.00 C ATOM 1791 O LEU A 116 -6.313 -7.282 5.220 1.00 0.00 O ATOM 1792 CB LEU A 116 -9.457 -7.597 4.678 1.00 0.00 C ATOM 1793 CG LEU A 116 -8.948 -6.667 3.575 1.00 0.00 C ATOM 1794 CD1 LEU A 116 -8.705 -7.445 2.291 1.00 0.00 C ATOM 1795 CD2 LEU A 116 -9.936 -5.535 3.336 1.00 0.00 C ATOM 0 H LEU A 116 -9.893 -9.009 6.684 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.956 -9.131 4.557 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.237 -8.236 4.263 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -9.922 -6.992 5.457 1.00 0.00 H new ATOM 0 HG LEU A 116 -8.001 -6.235 3.898 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -8.343 -6.767 1.518 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.961 -8.221 2.471 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -9.637 -7.906 1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.559 -4.883 2.548 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -10.898 -5.949 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -10.060 -4.961 4.254 1.00 0.00 H new ATOM 1807 N PHE A 117 -7.420 -7.262 7.178 1.00 0.00 N ATOM 1808 CA PHE A 117 -6.429 -6.435 7.856 1.00 0.00 C ATOM 1809 C PHE A 117 -5.144 -7.218 8.108 1.00 0.00 C ATOM 1810 O PHE A 117 -4.043 -6.692 7.953 1.00 0.00 O ATOM 1811 CB PHE A 117 -6.989 -5.912 9.179 1.00 0.00 C ATOM 1812 CG PHE A 117 -6.359 -4.627 9.633 1.00 0.00 C ATOM 1813 CD1 PHE A 117 -5.042 -4.600 10.065 1.00 0.00 C ATOM 1814 CD2 PHE A 117 -7.082 -3.445 9.628 1.00 0.00 C ATOM 1815 CE1 PHE A 117 -4.459 -3.419 10.483 1.00 0.00 C ATOM 1816 CE2 PHE A 117 -6.505 -2.261 10.045 1.00 0.00 C ATOM 1817 CZ PHE A 117 -5.191 -2.248 10.474 1.00 0.00 C ATOM 0 H PHE A 117 -8.212 -7.533 7.760 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.196 -5.590 7.209 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.064 -5.763 9.075 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -6.845 -6.669 9.949 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -4.465 -5.513 10.075 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -8.109 -3.449 9.294 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -3.432 -3.412 10.816 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -7.080 -1.347 10.036 1.00 0.00 H new ATOM 0 HZ PHE A 117 -4.738 -1.324 10.801 1.00 0.00 H new ATOM 1827 N ALA A 118 -5.295 -8.480 8.500 1.00 0.00 N ATOM 1828 CA ALA A 118 -4.146 -9.336 8.776 1.00 0.00 C ATOM 1829 C ALA A 118 -3.362 -9.631 7.502 1.00 0.00 C ATOM 1830 O ALA A 118 -2.137 -9.756 7.532 1.00 0.00 O ATOM 1831 CB ALA A 118 -4.602 -10.631 9.429 1.00 0.00 C ATOM 0 H ALA A 118 -6.200 -8.932 8.633 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.485 -8.807 9.462 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.736 -11.262 9.630 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.113 -10.406 10.365 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.285 -11.155 8.760 1.00 0.00 H new ATOM 1837 N LEU A 119 -4.074 -9.741 6.386 1.00 0.00 N ATOM 1838 CA LEU A 119 -3.442 -10.023 5.101 1.00 0.00 C ATOM 1839 C LEU A 119 -2.789 -8.769 4.527 1.00 0.00 C ATOM 1840 O LEU A 119 -1.789 -8.850 3.815 1.00 0.00 O ATOM 1841 CB LEU A 119 -4.472 -10.575 4.113 1.00 0.00 C ATOM 1842 CG LEU A 119 -5.022 -11.959 4.458 1.00 0.00 C ATOM 1843 CD1 LEU A 119 -6.214 -12.294 3.574 1.00 0.00 C ATOM 1844 CD2 LEU A 119 -3.937 -13.014 4.315 1.00 0.00 C ATOM 0 H LEU A 119 -5.088 -9.639 6.344 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.666 -10.771 5.263 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.305 -9.875 4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.017 -10.618 3.123 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.356 -11.949 5.495 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -6.593 -13.283 3.833 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.999 -11.553 3.726 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.905 -12.286 2.529 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.346 -13.993 4.565 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.572 -13.024 3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.113 -12.782 4.990 1.00 0.00 H new ATOM 1856 N ALA A 120 -3.363 -7.612 4.841 1.00 0.00 N ATOM 1857 CA ALA A 120 -2.838 -6.343 4.354 1.00 0.00 C ATOM 1858 C ALA A 120 -1.553 -5.963 5.084 1.00 0.00 C ATOM 1859 O ALA A 120 -0.628 -5.412 4.487 1.00 0.00 O ATOM 1860 CB ALA A 120 -3.880 -5.245 4.512 1.00 0.00 C ATOM 0 H ALA A 120 -4.191 -7.528 5.430 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.604 -6.458 3.296 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.474 -4.303 4.144 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.771 -5.504 3.940 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -4.142 -5.141 5.565 1.00 0.00 H new ATOM 1866 N ARG A 121 -1.504 -6.259 6.378 1.00 0.00 N ATOM 1867 CA ARG A 121 -0.332 -5.948 7.190 1.00 0.00 C ATOM 1868 C ARG A 121 0.802 -6.930 6.912 1.00 0.00 C ATOM 1869 O ARG A 121 1.978 -6.583 7.021 1.00 0.00 O ATOM 1870 CB ARG A 121 -0.697 -5.972 8.677 1.00 0.00 C ATOM 1871 CG ARG A 121 -0.545 -4.623 9.359 1.00 0.00 C ATOM 1872 CD ARG A 121 -1.029 -4.670 10.800 1.00 0.00 C ATOM 1873 NE ARG A 121 0.060 -4.952 11.733 1.00 0.00 N ATOM 1874 CZ ARG A 121 -0.125 -5.377 12.981 1.00 0.00 C ATOM 1875 NH1 ARG A 121 -1.352 -5.571 13.448 1.00 0.00 N ATOM 1876 NH2 ARG A 121 0.920 -5.609 13.763 1.00 0.00 N ATOM 0 H ARG A 121 -2.262 -6.714 6.888 1.00 0.00 H new ATOM 0 HA ARG A 121 0.010 -4.948 6.924 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -1.727 -6.311 8.785 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.067 -6.701 9.186 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.501 -4.318 9.335 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.109 -3.870 8.809 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -1.491 -3.717 11.059 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.799 -5.435 10.899 1.00 0.00 H new ATOM 0 HE ARG A 121 1.017 -4.815 11.409 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -2.159 -5.394 12.850 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -1.488 -5.897 14.405 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.865 -5.462 13.408 1.00 0.00 H new ATOM 0 HH22 ARG A 121 0.779 -5.935 14.719 1.00 0.00 H new ATOM 1890 N GLN A 122 0.441 -8.159 6.554 1.00 0.00 N ATOM 1891 CA GLN A 122 1.429 -9.191 6.262 1.00 0.00 C ATOM 1892 C GLN A 122 2.298 -8.798 5.071 1.00 0.00 C ATOM 1893 O GLN A 122 3.464 -9.184 4.986 1.00 0.00 O ATOM 1894 CB GLN A 122 0.735 -10.525 5.983 1.00 0.00 C ATOM 1895 CG GLN A 122 1.646 -11.731 6.148 1.00 0.00 C ATOM 1896 CD GLN A 122 1.015 -13.012 5.639 1.00 0.00 C ATOM 1897 OE1 GLN A 122 0.210 -13.638 6.328 1.00 0.00 O ATOM 1898 NE2 GLN A 122 1.379 -13.409 4.425 1.00 0.00 N ATOM 0 H GLN A 122 -0.528 -8.464 6.459 1.00 0.00 H new ATOM 0 HA GLN A 122 2.072 -9.298 7.135 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -0.117 -10.629 6.655 1.00 0.00 H new ATOM 0 HB3 GLN A 122 0.341 -10.514 4.967 1.00 0.00 H new ATOM 0 HG2 GLN A 122 2.579 -11.553 5.614 1.00 0.00 H new ATOM 0 HG3 GLN A 122 1.900 -11.849 7.202 1.00 0.00 H new ATOM 0 HE21 GLN A 122 2.050 -12.859 3.888 1.00 0.00 H new ATOM 0 HE22 GLN A 122 0.988 -14.264 4.029 1.00 0.00 H new ATOM 1907 N ILE A 123 1.722 -8.029 4.151 1.00 0.00 N ATOM 1908 CA ILE A 123 2.445 -7.587 2.964 1.00 0.00 C ATOM 1909 C ILE A 123 3.040 -6.197 3.168 1.00 0.00 C ATOM 1910 O ILE A 123 4.081 -5.868 2.598 1.00 0.00 O ATOM 1911 CB ILE A 123 1.532 -7.566 1.725 1.00 0.00 C ATOM 1912 CG1 ILE A 123 0.762 -8.883 1.609 1.00 0.00 C ATOM 1913 CG2 ILE A 123 2.349 -7.311 0.468 1.00 0.00 C ATOM 1914 CD1 ILE A 123 -0.354 -8.842 0.586 1.00 0.00 C ATOM 0 H ILE A 123 0.758 -7.700 4.205 1.00 0.00 H new ATOM 0 HA ILE A 123 3.250 -8.303 2.800 1.00 0.00 H new ATOM 0 HB ILE A 123 0.812 -6.755 1.837 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.458 -9.679 1.344 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.343 -9.137 2.583 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.689 -7.299 -0.399 1.00 0.00 H new ATOM 0 HG22 ILE A 123 2.855 -6.349 0.552 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.090 -8.102 0.349 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.857 -9.809 0.557 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.071 -8.068 0.860 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.061 -8.620 -0.397 1.00 0.00 H new ATOM 1926 N SER A 124 2.373 -5.385 3.981 1.00 0.00 N ATOM 1927 CA SER A 124 2.836 -4.029 4.256 1.00 0.00 C ATOM 1928 C SER A 124 4.233 -4.042 4.869 1.00 0.00 C ATOM 1929 O SER A 124 5.020 -3.117 4.664 1.00 0.00 O ATOM 1930 CB SER A 124 1.863 -3.316 5.197 1.00 0.00 C ATOM 1931 OG SER A 124 0.871 -2.613 4.469 1.00 0.00 O ATOM 0 H SER A 124 1.510 -5.642 4.461 1.00 0.00 H new ATOM 0 HA SER A 124 2.879 -3.490 3.310 1.00 0.00 H new ATOM 0 HB2 SER A 124 1.388 -4.045 5.854 1.00 0.00 H new ATOM 0 HB3 SER A 124 2.411 -2.622 5.834 1.00 0.00 H new ATOM 0 HG SER A 124 0.266 -3.253 4.039 1.00 0.00 H new ATOM 1937 N ARG A 125 4.535 -5.097 5.620 1.00 0.00 N ATOM 1938 CA ARG A 125 5.838 -5.229 6.263 1.00 0.00 C ATOM 1939 C ARG A 125 6.885 -5.732 5.274 1.00 0.00 C ATOM 1940 O ARG A 125 8.064 -5.399 5.381 1.00 0.00 O ATOM 1941 CB ARG A 125 5.744 -6.183 7.457 1.00 0.00 C ATOM 1942 CG ARG A 125 5.688 -5.472 8.799 1.00 0.00 C ATOM 1943 CD ARG A 125 6.443 -6.243 9.870 1.00 0.00 C ATOM 1944 NE ARG A 125 7.806 -6.563 9.455 1.00 0.00 N ATOM 1945 CZ ARG A 125 8.640 -7.316 10.168 1.00 0.00 C ATOM 1946 NH1 ARG A 125 8.256 -7.828 11.331 1.00 0.00 N ATOM 1947 NH2 ARG A 125 9.864 -7.560 9.717 1.00 0.00 N ATOM 0 H ARG A 125 3.896 -5.872 5.798 1.00 0.00 H new ATOM 0 HA ARG A 125 6.144 -4.244 6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.855 -6.804 7.347 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.604 -6.853 7.445 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.113 -4.473 8.701 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.649 -5.348 9.103 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.472 -5.655 10.787 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.908 -7.165 10.099 1.00 0.00 H new ATOM 0 HE ARG A 125 8.138 -6.187 8.567 1.00 0.00 H new ATOM 0 HH11 ARG A 125 7.316 -7.645 11.683 1.00 0.00 H new ATOM 0 HH12 ARG A 125 8.900 -8.404 11.872 1.00 0.00 H new ATOM 0 HH21 ARG A 125 10.166 -7.170 8.824 1.00 0.00 H new ATOM 0 HH22 ARG A 125 10.503 -8.137 10.264 1.00 0.00 H new ATOM 1961 N GLU A 126 6.445 -6.537 4.312 1.00 0.00 N ATOM 1962 CA GLU A 126 7.344 -7.087 3.304 1.00 0.00 C ATOM 1963 C GLU A 126 7.897 -5.983 2.406 1.00 0.00 C ATOM 1964 O GLU A 126 9.023 -6.073 1.916 1.00 0.00 O ATOM 1965 CB GLU A 126 6.616 -8.136 2.460 1.00 0.00 C ATOM 1966 CG GLU A 126 7.283 -9.501 2.480 1.00 0.00 C ATOM 1967 CD GLU A 126 6.285 -10.639 2.387 1.00 0.00 C ATOM 1968 OE1 GLU A 126 5.342 -10.536 1.574 1.00 0.00 O ATOM 1969 OE2 GLU A 126 6.445 -11.632 3.127 1.00 0.00 O ATOM 0 H GLU A 126 5.471 -6.823 4.209 1.00 0.00 H new ATOM 0 HA GLU A 126 8.180 -7.562 3.818 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.593 -8.235 2.822 1.00 0.00 H new ATOM 0 HB3 GLU A 126 6.557 -7.785 1.430 1.00 0.00 H new ATOM 0 HG2 GLU A 126 7.986 -9.570 1.650 1.00 0.00 H new ATOM 0 HG3 GLU A 126 7.862 -9.605 3.397 1.00 0.00 H new ATOM 1976 N VAL A 127 7.097 -4.942 2.196 1.00 0.00 N ATOM 1977 CA VAL A 127 7.507 -3.823 1.358 1.00 0.00 C ATOM 1978 C VAL A 127 8.465 -2.899 2.103 1.00 0.00 C ATOM 1979 O VAL A 127 9.409 -2.368 1.521 1.00 0.00 O ATOM 1980 CB VAL A 127 6.292 -3.004 0.879 1.00 0.00 C ATOM 1981 CG1 VAL A 127 6.717 -1.967 -0.149 1.00 0.00 C ATOM 1982 CG2 VAL A 127 5.220 -3.922 0.311 1.00 0.00 C ATOM 0 H VAL A 127 6.162 -4.851 2.595 1.00 0.00 H new ATOM 0 HA VAL A 127 8.015 -4.247 0.492 1.00 0.00 H new ATOM 0 HB VAL A 127 5.871 -2.479 1.736 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.845 -1.399 -0.475 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.445 -1.290 0.297 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.165 -2.468 -1.007 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.370 -3.326 -0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.627 -4.478 -0.534 1.00 0.00 H new ATOM 0 HG23 VAL A 127 4.894 -4.621 1.081 1.00 0.00 H new ATOM 1992 N THR A 128 8.213 -2.713 3.394 1.00 0.00 N ATOM 1993 CA THR A 128 9.053 -1.853 4.220 1.00 0.00 C ATOM 1994 C THR A 128 10.414 -2.496 4.469 1.00 0.00 C ATOM 1995 O THR A 128 11.416 -1.802 4.643 1.00 0.00 O ATOM 1996 CB THR A 128 8.362 -1.561 5.553 1.00 0.00 C ATOM 1997 OG1 THR A 128 6.964 -1.412 5.371 1.00 0.00 O ATOM 1998 CG2 THR A 128 8.872 -0.306 6.229 1.00 0.00 C ATOM 0 H THR A 128 7.434 -3.146 3.891 1.00 0.00 H new ATOM 0 HA THR A 128 9.208 -0.916 3.685 1.00 0.00 H new ATOM 0 HB THR A 128 8.589 -2.416 6.190 1.00 0.00 H new ATOM 0 HG1 THR A 128 6.542 -2.296 5.342 1.00 0.00 H new ATOM 0 HG21 THR A 128 8.340 -0.157 7.169 1.00 0.00 H new ATOM 0 HG22 THR A 128 9.939 -0.408 6.428 1.00 0.00 H new ATOM 0 HG23 THR A 128 8.704 0.552 5.578 1.00 0.00 H new ATOM 2006 N TYR A 129 10.442 -3.825 4.487 1.00 0.00 N ATOM 2007 CA TYR A 129 11.681 -4.561 4.716 1.00 0.00 C ATOM 2008 C TYR A 129 12.725 -4.209 3.661 1.00 0.00 C ATOM 2009 O TYR A 129 13.756 -3.611 3.969 1.00 0.00 O ATOM 2010 CB TYR A 129 11.416 -6.067 4.704 1.00 0.00 C ATOM 2011 CG TYR A 129 12.423 -6.865 5.500 1.00 0.00 C ATOM 2012 CD1 TYR A 129 13.754 -6.933 5.105 1.00 0.00 C ATOM 2013 CD2 TYR A 129 12.044 -7.549 6.649 1.00 0.00 C ATOM 2014 CE1 TYR A 129 14.678 -7.661 5.830 1.00 0.00 C ATOM 2015 CE2 TYR A 129 12.963 -8.278 7.380 1.00 0.00 C ATOM 2016 CZ TYR A 129 14.277 -8.331 6.967 1.00 0.00 C ATOM 2017 OH TYR A 129 15.194 -9.056 7.692 1.00 0.00 O ATOM 0 H TYR A 129 9.621 -4.414 4.346 1.00 0.00 H new ATOM 0 HA TYR A 129 12.067 -4.276 5.695 1.00 0.00 H new ATOM 0 HB2 TYR A 129 10.419 -6.255 5.102 1.00 0.00 H new ATOM 0 HB3 TYR A 129 11.419 -6.420 3.673 1.00 0.00 H new ATOM 0 HD1 TYR A 129 14.071 -6.408 4.216 1.00 0.00 H new ATOM 0 HD2 TYR A 129 11.015 -7.510 6.976 1.00 0.00 H new ATOM 0 HE1 TYR A 129 15.708 -7.705 5.508 1.00 0.00 H new ATOM 0 HE2 TYR A 129 12.653 -8.804 8.271 1.00 0.00 H new ATOM 0 HH TYR A 129 14.750 -9.466 8.464 1.00 0.00 H new ATOM 2027 N LYS A 130 12.452 -4.584 2.416 1.00 0.00 N ATOM 2028 CA LYS A 130 13.367 -4.308 1.316 1.00 0.00 C ATOM 2029 C LYS A 130 12.907 -3.094 0.515 1.00 0.00 C ATOM 2030 O LYS A 130 12.649 -3.189 -0.685 1.00 0.00 O ATOM 2031 CB LYS A 130 13.480 -5.530 0.402 1.00 0.00 C ATOM 2032 CG LYS A 130 13.703 -6.833 1.153 1.00 0.00 C ATOM 2033 CD LYS A 130 12.630 -7.860 0.824 1.00 0.00 C ATOM 2034 CE LYS A 130 12.195 -8.627 2.064 1.00 0.00 C ATOM 2035 NZ LYS A 130 10.722 -8.843 2.094 1.00 0.00 N ATOM 0 H LYS A 130 11.603 -5.080 2.144 1.00 0.00 H new ATOM 0 HA LYS A 130 14.348 -4.088 1.737 1.00 0.00 H new ATOM 0 HB2 LYS A 130 12.570 -5.614 -0.192 1.00 0.00 H new ATOM 0 HB3 LYS A 130 14.304 -5.377 -0.295 1.00 0.00 H new ATOM 0 HG2 LYS A 130 14.683 -7.236 0.900 1.00 0.00 H new ATOM 0 HG3 LYS A 130 13.705 -6.639 2.226 1.00 0.00 H new ATOM 0 HD2 LYS A 130 11.768 -7.359 0.383 1.00 0.00 H new ATOM 0 HD3 LYS A 130 13.009 -8.558 0.077 1.00 0.00 H new ATOM 0 HE2 LYS A 130 12.704 -9.590 2.092 1.00 0.00 H new ATOM 0 HE3 LYS A 130 12.500 -8.079 2.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 10.457 -9.309 2.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 10.235 -7.927 2.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 10.443 -9.445 1.293 1.00 0.00 H new ATOM 2049 N TYR A 131 12.806 -1.953 1.189 1.00 0.00 N ATOM 2050 CA TYR A 131 12.376 -0.719 0.541 1.00 0.00 C ATOM 2051 C TYR A 131 13.573 0.058 0.003 1.00 0.00 C ATOM 2052 O TYR A 131 13.676 0.305 -1.199 1.00 0.00 O ATOM 2053 CB TYR A 131 11.589 0.151 1.524 1.00 0.00 C ATOM 2054 CG TYR A 131 10.639 1.115 0.853 1.00 0.00 C ATOM 2055 CD1 TYR A 131 11.103 2.058 -0.057 1.00 0.00 C ATOM 2056 CD2 TYR A 131 9.278 1.083 1.126 1.00 0.00 C ATOM 2057 CE1 TYR A 131 10.237 2.941 -0.672 1.00 0.00 C ATOM 2058 CE2 TYR A 131 8.405 1.963 0.515 1.00 0.00 C ATOM 2059 CZ TYR A 131 8.890 2.890 -0.384 1.00 0.00 C ATOM 2060 OH TYR A 131 8.024 3.767 -0.996 1.00 0.00 O ATOM 0 H TYR A 131 13.016 -1.857 2.183 1.00 0.00 H new ATOM 0 HA TYR A 131 11.731 -0.984 -0.297 1.00 0.00 H new ATOM 0 HB2 TYR A 131 11.023 -0.495 2.195 1.00 0.00 H new ATOM 0 HB3 TYR A 131 12.290 0.714 2.139 1.00 0.00 H new ATOM 0 HD1 TYR A 131 12.157 2.101 -0.287 1.00 0.00 H new ATOM 0 HD2 TYR A 131 8.895 0.358 1.828 1.00 0.00 H new ATOM 0 HE1 TYR A 131 10.614 3.668 -1.376 1.00 0.00 H new ATOM 0 HE2 TYR A 131 7.349 1.925 0.740 1.00 0.00 H new ATOM 0 HH TYR A 131 8.367 4.681 -0.908 1.00 0.00 H new ATOM 2070 N THR A 132 14.477 0.440 0.900 1.00 0.00 N ATOM 2071 CA THR A 132 15.667 1.188 0.515 1.00 0.00 C ATOM 2072 C THR A 132 16.795 0.968 1.517 1.00 0.00 C ATOM 2073 O THR A 132 16.728 1.432 2.656 1.00 0.00 O ATOM 2074 CB THR A 132 15.346 2.679 0.412 1.00 0.00 C ATOM 2075 OG1 THR A 132 14.355 3.046 1.355 1.00 0.00 O ATOM 2076 CG2 THR A 132 14.852 3.092 -0.958 1.00 0.00 C ATOM 0 H THR A 132 14.407 0.243 1.898 1.00 0.00 H new ATOM 0 HA THR A 132 15.994 0.825 -0.459 1.00 0.00 H new ATOM 0 HB THR A 132 16.288 3.191 0.610 1.00 0.00 H new ATOM 0 HG1 THR A 132 13.466 2.903 0.968 1.00 0.00 H new ATOM 0 HG21 THR A 132 14.643 4.162 -0.962 1.00 0.00 H new ATOM 0 HG22 THR A 132 15.616 2.869 -1.703 1.00 0.00 H new ATOM 0 HG23 THR A 132 13.941 2.543 -1.197 1.00 0.00 H new ATOM 2084 N TYR A 133 17.832 0.257 1.086 1.00 0.00 N ATOM 2085 CA TYR A 133 18.976 -0.025 1.946 1.00 0.00 C ATOM 2086 C TYR A 133 19.745 1.253 2.265 1.00 0.00 C ATOM 2087 O TYR A 133 19.869 2.142 1.422 1.00 0.00 O ATOM 2088 CB TYR A 133 19.904 -1.040 1.279 1.00 0.00 C ATOM 2089 CG TYR A 133 19.334 -2.440 1.229 1.00 0.00 C ATOM 2090 CD1 TYR A 133 18.438 -2.811 0.234 1.00 0.00 C ATOM 2091 CD2 TYR A 133 19.693 -3.390 2.177 1.00 0.00 C ATOM 2092 CE1 TYR A 133 17.915 -4.089 0.186 1.00 0.00 C ATOM 2093 CE2 TYR A 133 19.174 -4.671 2.134 1.00 0.00 C ATOM 2094 CZ TYR A 133 18.286 -5.014 1.138 1.00 0.00 C ATOM 2095 OH TYR A 133 17.768 -6.288 1.092 1.00 0.00 O ATOM 0 H TYR A 133 17.904 -0.134 0.147 1.00 0.00 H new ATOM 0 HA TYR A 133 18.602 -0.445 2.880 1.00 0.00 H new ATOM 0 HB2 TYR A 133 20.121 -0.709 0.264 1.00 0.00 H new ATOM 0 HB3 TYR A 133 20.852 -1.062 1.817 1.00 0.00 H new ATOM 0 HD1 TYR A 133 18.146 -2.089 -0.514 1.00 0.00 H new ATOM 0 HD2 TYR A 133 20.388 -3.124 2.960 1.00 0.00 H new ATOM 0 HE1 TYR A 133 17.219 -4.362 -0.594 1.00 0.00 H new ATOM 0 HE2 TYR A 133 19.463 -5.399 2.877 1.00 0.00 H new ATOM 0 HH TYR A 133 18.131 -6.816 1.833 1.00 0.00 H new ATOM 2105 N ARG A 134 20.261 1.338 3.487 1.00 0.00 N ATOM 2106 CA ARG A 134 21.018 2.507 3.918 1.00 0.00 C ATOM 2107 C ARG A 134 22.476 2.141 4.183 1.00 0.00 C ATOM 2108 O ARG A 134 22.909 1.025 3.895 1.00 0.00 O ATOM 2109 CB ARG A 134 20.390 3.111 5.176 1.00 0.00 C ATOM 2110 CG ARG A 134 19.649 4.415 4.920 1.00 0.00 C ATOM 2111 CD ARG A 134 20.441 5.617 5.411 1.00 0.00 C ATOM 2112 NE ARG A 134 19.728 6.354 6.452 1.00 0.00 N ATOM 2113 CZ ARG A 134 18.633 7.078 6.231 1.00 0.00 C ATOM 2114 NH1 ARG A 134 18.122 7.164 5.009 1.00 0.00 N ATOM 2115 NH2 ARG A 134 18.046 7.716 7.234 1.00 0.00 N ATOM 0 H ARG A 134 20.168 0.611 4.196 1.00 0.00 H new ATOM 0 HA ARG A 134 20.989 3.247 3.118 1.00 0.00 H new ATOM 0 HB2 ARG A 134 19.698 2.389 5.610 1.00 0.00 H new ATOM 0 HB3 ARG A 134 21.172 3.286 5.915 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.454 4.519 3.853 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.681 4.388 5.420 1.00 0.00 H new ATOM 0 HD2 ARG A 134 21.404 5.283 5.798 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.648 6.282 4.573 1.00 0.00 H new ATOM 0 HE ARG A 134 20.091 6.311 7.404 1.00 0.00 H new ATOM 0 HH11 ARG A 134 18.569 6.674 4.234 1.00 0.00 H new ATOM 0 HH12 ARG A 134 17.283 7.720 4.845 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.433 7.652 8.175 1.00 0.00 H new ATOM 0 HH22 ARG A 134 17.207 8.271 7.064 1.00 0.00 H new ATOM 2129 N THR A 135 23.228 3.089 4.735 1.00 0.00 N ATOM 2130 CA THR A 135 24.636 2.867 5.040 1.00 0.00 C ATOM 2131 C THR A 135 24.796 2.118 6.358 1.00 0.00 C ATOM 2132 O THR A 135 24.542 2.668 7.431 1.00 0.00 O ATOM 2133 CB THR A 135 25.381 4.201 5.103 1.00 0.00 C ATOM 2134 OG1 THR A 135 24.814 5.045 6.088 1.00 0.00 O ATOM 2135 CG2 THR A 135 25.371 4.955 3.791 1.00 0.00 C ATOM 0 H THR A 135 22.885 4.018 4.980 1.00 0.00 H new ATOM 0 HA THR A 135 25.063 2.257 4.244 1.00 0.00 H new ATOM 0 HB THR A 135 26.412 3.945 5.348 1.00 0.00 H new ATOM 0 HG1 THR A 135 24.452 4.499 6.817 1.00 0.00 H new ATOM 0 HG21 THR A 135 25.917 5.892 3.905 1.00 0.00 H new ATOM 0 HG22 THR A 135 25.847 4.350 3.020 1.00 0.00 H new ATOM 0 HG23 THR A 135 24.342 5.168 3.501 1.00 0.00 H new ATOM 2143 N THR A 136 25.220 0.862 6.272 1.00 0.00 N ATOM 2144 CA THR A 136 25.415 0.038 7.459 1.00 0.00 C ATOM 2145 C THR A 136 26.454 0.659 8.387 1.00 0.00 C ATOM 2146 O THR A 136 26.348 0.561 9.609 1.00 0.00 O ATOM 2147 CB THR A 136 25.850 -1.373 7.061 1.00 0.00 C ATOM 2148 OG1 THR A 136 27.130 -1.351 6.453 1.00 0.00 O ATOM 2149 CG2 THR A 136 24.895 -2.044 6.097 1.00 0.00 C ATOM 0 H THR A 136 25.435 0.392 5.393 1.00 0.00 H new ATOM 0 HA THR A 136 24.465 -0.019 7.991 1.00 0.00 H new ATOM 0 HB THR A 136 25.864 -1.944 7.990 1.00 0.00 H new ATOM 0 HG1 THR A 136 27.391 -2.263 6.207 1.00 0.00 H new ATOM 0 HG21 THR A 136 25.263 -3.041 5.856 1.00 0.00 H new ATOM 0 HG22 THR A 136 23.909 -2.122 6.556 1.00 0.00 H new ATOM 0 HG23 THR A 136 24.824 -1.453 5.184 1.00 0.00 H new ATOM 2157 N SER A 137 27.458 1.301 7.797 1.00 0.00 N ATOM 2158 CA SER A 137 28.516 1.940 8.570 1.00 0.00 C ATOM 2159 C SER A 137 29.384 2.821 7.676 1.00 0.00 C ATOM 2160 O SER A 137 30.500 2.447 7.316 1.00 0.00 O ATOM 2161 CB SER A 137 29.379 0.883 9.262 1.00 0.00 C ATOM 2162 OG SER A 137 29.831 1.341 10.525 1.00 0.00 O ATOM 0 H SER A 137 27.560 1.392 6.786 1.00 0.00 H new ATOM 0 HA SER A 137 28.051 2.570 9.328 1.00 0.00 H new ATOM 0 HB2 SER A 137 28.804 -0.034 9.389 1.00 0.00 H new ATOM 0 HB3 SER A 137 30.235 0.639 8.633 1.00 0.00 H new ATOM 0 HG SER A 137 30.379 0.647 10.948 1.00 0.00 H new ATOM 2168 N GLY A 138 28.864 3.991 7.323 1.00 0.00 N ATOM 2169 CA GLY A 138 29.604 4.908 6.475 1.00 0.00 C ATOM 2170 C GLY A 138 30.069 6.144 7.222 1.00 0.00 C ATOM 2171 O GLY A 138 29.315 7.107 7.356 1.00 0.00 O ATOM 0 H GLY A 138 27.942 4.322 7.609 1.00 0.00 H new ATOM 0 HA2 GLY A 138 30.469 4.393 6.057 1.00 0.00 H new ATOM 0 HA3 GLY A 138 28.976 5.209 5.636 1.00 0.00 H new ATOM 2175 N PRO A 139 31.316 6.150 7.723 1.00 0.00 N ATOM 2176 CA PRO A 139 31.865 7.292 8.460 1.00 0.00 C ATOM 2177 C PRO A 139 32.079 8.509 7.566 1.00 0.00 C ATOM 2178 O PRO A 139 32.996 8.536 6.745 1.00 0.00 O ATOM 2179 CB PRO A 139 33.207 6.771 8.983 1.00 0.00 C ATOM 2180 CG PRO A 139 33.581 5.676 8.047 1.00 0.00 C ATOM 2181 CD PRO A 139 32.288 5.045 7.611 1.00 0.00 C ATOM 0 HA PRO A 139 31.190 7.630 9.246 1.00 0.00 H new ATOM 0 HB2 PRO A 139 33.961 7.558 8.992 1.00 0.00 H new ATOM 0 HB3 PRO A 139 33.117 6.404 10.005 1.00 0.00 H new ATOM 0 HG2 PRO A 139 34.133 6.065 7.192 1.00 0.00 H new ATOM 0 HG3 PRO A 139 34.226 4.946 8.537 1.00 0.00 H new ATOM 0 HD2 PRO A 139 32.350 4.665 6.591 1.00 0.00 H new ATOM 0 HD3 PRO A 139 32.016 4.204 8.248 1.00 0.00 H new ATOM 2189 N SER A 140 31.225 9.514 7.731 1.00 0.00 N ATOM 2190 CA SER A 140 31.319 10.734 6.938 1.00 0.00 C ATOM 2191 C SER A 140 32.531 11.561 7.356 1.00 0.00 C ATOM 2192 O SER A 140 33.082 11.371 8.440 1.00 0.00 O ATOM 2193 CB SER A 140 30.043 11.564 7.090 1.00 0.00 C ATOM 2194 OG SER A 140 29.908 12.057 8.411 1.00 0.00 O ATOM 0 H SER A 140 30.461 9.507 8.406 1.00 0.00 H new ATOM 0 HA SER A 140 31.438 10.451 5.892 1.00 0.00 H new ATOM 0 HB2 SER A 140 30.062 12.398 6.388 1.00 0.00 H new ATOM 0 HB3 SER A 140 29.176 10.954 6.836 1.00 0.00 H new ATOM 0 HG SER A 140 29.086 12.585 8.481 1.00 0.00 H new ATOM 2200 N SER A 141 32.939 12.481 6.488 1.00 0.00 N ATOM 2201 CA SER A 141 34.086 13.338 6.767 1.00 0.00 C ATOM 2202 C SER A 141 34.053 14.591 5.899 1.00 0.00 C ATOM 2203 O SER A 141 33.879 15.702 6.401 1.00 0.00 O ATOM 2204 CB SER A 141 35.390 12.575 6.531 1.00 0.00 C ATOM 2205 OG SER A 141 35.194 11.176 6.660 1.00 0.00 O ATOM 0 H SER A 141 32.493 12.652 5.587 1.00 0.00 H new ATOM 0 HA SER A 141 34.035 13.641 7.813 1.00 0.00 H new ATOM 0 HB2 SER A 141 35.772 12.801 5.536 1.00 0.00 H new ATOM 0 HB3 SER A 141 36.144 12.907 7.245 1.00 0.00 H new ATOM 0 HG SER A 141 36.042 10.711 6.503 1.00 0.00 H new ATOM 2211 N GLY A 142 34.220 14.405 4.594 1.00 0.00 N ATOM 2212 CA GLY A 142 34.206 15.529 3.677 1.00 0.00 C ATOM 2213 C GLY A 142 35.575 16.159 3.512 1.00 0.00 C ATOM 2214 O GLY A 142 36.560 15.580 4.014 1.00 0.00 O ATOM 2215 OXT GLY A 142 35.662 17.233 2.879 1.00 0.00 O ATOM 0 H GLY A 142 34.365 13.496 4.155 1.00 0.00 H new ATOM 0 HA2 GLY A 142 33.843 15.196 2.705 1.00 0.00 H new ATOM 0 HA3 GLY A 142 33.505 16.281 4.039 1.00 0.00 H new TER 2219 GLY A 142