USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 934 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 90 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 91 ASN : amide:sc= -0.694 K(o=-0.69,f=-0.047) USER MOD Set 2.1: A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 75 HIS : no HD1:sc= -2.17 K(o=-2.2,f=-3.1!) USER MOD Set 3.1: A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 54 HIS : no HD1:sc= -0.195 X(o=-0.2,f=-0.61) USER MOD Set 4.1: A 43 LYS NZ :NH3+ -160:sc= 0.00679 (180deg=0) USER MOD Set 4.2: A 58 GLN : amide:sc= -0.655 K(o=-0.65,f=-1.7!) USER MOD Set 5.1: A 34 LYS NZ :NH3+ 161:sc= 0.165 (180deg=0) USER MOD Set 5.2: A 37 THR OG1 : rot -50:sc= -0.641 USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.0764 (180deg=0) USER MOD Single : A 2 SER OG : rot 36:sc= 1.01 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -0.138 X(o=-0.14,f=-0.00027) USER MOD Single : A 47 SER OG : rot -54:sc= 0.676 USER MOD Single : A 48 HIS : no HD1:sc= -6.32! C(o=-6.3!,f=-5.5!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 101:sc= 1.4 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.737 K(o=-0.74,f=-4.8!) USER MOD Single : A 69 ASN : amide:sc= -2.69! C(o=-2.7!,f=-5.2!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.496 X(o=-0.5,f=-0.47) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 84 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 89 SER OG : rot -165:sc= 0.163 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 15:sc= 0.482 USER MOD Single : A 108 GLN : amide:sc= -1.91! C(o=-1.9!,f=-2.8!) USER MOD Single : A 111 THR OG1 : rot -59:sc= 0.534 USER MOD Single : A 113 SER OG : rot 180:sc= -0.0108 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.992 26.084 10.992 1.00 0.00 N ATOM 2 CA GLY A 1 3.784 25.256 9.819 1.00 0.00 C ATOM 3 C GLY A 1 5.076 24.957 9.084 1.00 0.00 C ATOM 4 O GLY A 1 6.162 25.265 9.574 1.00 0.00 O ATOM 0 H1 GLY A 1 3.653 25.581 11.837 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.006 26.290 11.096 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.466 26.975 10.886 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.315 24.319 10.118 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.092 25.757 9.142 1.00 0.00 H new ATOM 8 N SER A 2 4.959 24.354 7.905 1.00 0.00 N ATOM 9 CA SER A 2 6.127 24.009 7.103 1.00 0.00 C ATOM 10 C SER A 2 5.727 23.711 5.662 1.00 0.00 C ATOM 11 O SER A 2 4.543 23.666 5.331 1.00 0.00 O ATOM 12 CB SER A 2 6.846 22.801 7.706 1.00 0.00 C ATOM 13 OG SER A 2 7.778 23.202 8.695 1.00 0.00 O ATOM 0 H SER A 2 4.067 24.094 7.484 1.00 0.00 H new ATOM 0 HA SER A 2 6.804 24.863 7.104 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.116 22.121 8.145 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.361 22.250 6.919 1.00 0.00 H new ATOM 0 HG SER A 2 7.424 23.973 9.185 1.00 0.00 H new ATOM 19 N SER A 3 6.726 23.508 4.808 1.00 0.00 N ATOM 20 CA SER A 3 6.480 23.217 3.400 1.00 0.00 C ATOM 21 C SER A 3 7.452 22.160 2.886 1.00 0.00 C ATOM 22 O SER A 3 8.350 21.724 3.605 1.00 0.00 O ATOM 23 CB SER A 3 6.607 24.493 2.565 1.00 0.00 C ATOM 24 OG SER A 3 5.779 25.523 3.076 1.00 0.00 O ATOM 0 H SER A 3 7.712 23.540 5.066 1.00 0.00 H new ATOM 0 HA SER A 3 5.466 22.829 3.306 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.645 24.826 2.560 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.334 24.283 1.531 1.00 0.00 H new ATOM 0 HG SER A 3 5.880 26.327 2.525 1.00 0.00 H new ATOM 30 N GLY A 4 7.265 21.751 1.634 1.00 0.00 N ATOM 31 CA GLY A 4 8.132 20.748 1.044 1.00 0.00 C ATOM 32 C GLY A 4 8.576 21.118 -0.358 1.00 0.00 C ATOM 33 O GLY A 4 8.289 22.214 -0.838 1.00 0.00 O ATOM 0 H GLY A 4 6.529 22.097 1.019 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.010 20.613 1.676 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.610 19.792 1.016 1.00 0.00 H new ATOM 37 N SER A 5 9.279 20.202 -1.015 1.00 0.00 N ATOM 38 CA SER A 5 9.769 20.439 -2.368 1.00 0.00 C ATOM 39 C SER A 5 9.940 19.124 -3.122 1.00 0.00 C ATOM 40 O SER A 5 10.175 18.076 -2.520 1.00 0.00 O ATOM 41 CB SER A 5 11.099 21.193 -2.326 1.00 0.00 C ATOM 42 OG SER A 5 12.113 20.406 -1.724 1.00 0.00 O ATOM 0 H SER A 5 9.522 19.288 -0.633 1.00 0.00 H new ATOM 0 HA SER A 5 9.032 21.046 -2.894 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.398 21.465 -3.338 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.977 22.122 -1.769 1.00 0.00 H new ATOM 0 HG SER A 5 12.954 20.910 -1.711 1.00 0.00 H new ATOM 48 N SER A 6 9.819 19.188 -4.444 1.00 0.00 N ATOM 49 CA SER A 6 9.956 18.002 -5.282 1.00 0.00 C ATOM 50 C SER A 6 11.019 18.215 -6.356 1.00 0.00 C ATOM 51 O SER A 6 11.454 19.340 -6.600 1.00 0.00 O ATOM 52 CB SER A 6 8.616 17.657 -5.937 1.00 0.00 C ATOM 53 OG SER A 6 7.980 18.819 -6.440 1.00 0.00 O ATOM 0 H SER A 6 9.626 20.048 -4.958 1.00 0.00 H new ATOM 0 HA SER A 6 10.267 17.173 -4.647 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.776 16.947 -6.748 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.967 17.169 -5.210 1.00 0.00 H new ATOM 0 HG SER A 6 7.127 18.572 -6.855 1.00 0.00 H new ATOM 59 N GLY A 7 11.434 17.125 -6.994 1.00 0.00 N ATOM 60 CA GLY A 7 12.443 17.213 -8.033 1.00 0.00 C ATOM 61 C GLY A 7 13.485 16.118 -7.923 1.00 0.00 C ATOM 62 O GLY A 7 14.509 16.292 -7.263 1.00 0.00 O ATOM 0 H GLY A 7 11.089 16.183 -6.810 1.00 0.00 H new ATOM 0 HA2 GLY A 7 11.961 17.155 -9.009 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.934 18.185 -7.977 1.00 0.00 H new ATOM 66 N GLN A 8 13.224 14.987 -8.569 1.00 0.00 N ATOM 67 CA GLN A 8 14.147 13.859 -8.538 1.00 0.00 C ATOM 68 C GLN A 8 14.029 13.023 -9.809 1.00 0.00 C ATOM 69 O GLN A 8 12.981 13.004 -10.454 1.00 0.00 O ATOM 70 CB GLN A 8 13.877 12.985 -7.312 1.00 0.00 C ATOM 71 CG GLN A 8 12.503 12.334 -7.319 1.00 0.00 C ATOM 72 CD GLN A 8 12.273 11.444 -6.114 1.00 0.00 C ATOM 73 OE1 GLN A 8 12.662 10.276 -6.107 1.00 0.00 O ATOM 74 NE2 GLN A 8 11.637 11.993 -5.085 1.00 0.00 N ATOM 0 H GLN A 8 12.381 14.827 -9.120 1.00 0.00 H new ATOM 0 HA GLN A 8 15.161 14.254 -8.478 1.00 0.00 H new ATOM 0 HB2 GLN A 8 14.638 12.207 -7.256 1.00 0.00 H new ATOM 0 HB3 GLN A 8 13.977 13.594 -6.413 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.738 13.110 -7.344 1.00 0.00 H new ATOM 0 HG3 GLN A 8 12.389 11.744 -8.229 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.332 12.965 -5.134 1.00 0.00 H new ATOM 0 HE22 GLN A 8 11.454 11.442 -4.246 1.00 0.00 H new ATOM 83 N GLU A 9 15.109 12.334 -10.161 1.00 0.00 N ATOM 84 CA GLU A 9 15.125 11.497 -11.355 1.00 0.00 C ATOM 85 C GLU A 9 14.341 10.208 -11.127 1.00 0.00 C ATOM 86 O GLU A 9 14.258 9.710 -10.005 1.00 0.00 O ATOM 87 CB GLU A 9 16.565 11.167 -11.754 1.00 0.00 C ATOM 88 CG GLU A 9 17.244 12.270 -12.549 1.00 0.00 C ATOM 89 CD GLU A 9 18.754 12.127 -12.574 1.00 0.00 C ATOM 90 OE1 GLU A 9 19.315 11.582 -11.600 1.00 0.00 O ATOM 91 OE2 GLU A 9 19.374 12.559 -13.568 1.00 0.00 O ATOM 0 H GLU A 9 15.984 12.339 -9.637 1.00 0.00 H new ATOM 0 HA GLU A 9 14.650 12.053 -12.163 1.00 0.00 H new ATOM 0 HB2 GLU A 9 17.146 10.969 -10.854 1.00 0.00 H new ATOM 0 HB3 GLU A 9 16.569 10.250 -12.344 1.00 0.00 H new ATOM 0 HG2 GLU A 9 16.865 12.262 -13.571 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.981 13.237 -12.119 1.00 0.00 H new ATOM 98 N SER A 10 13.768 9.674 -12.201 1.00 0.00 N ATOM 99 CA SER A 10 12.986 8.445 -12.118 1.00 0.00 C ATOM 100 C SER A 10 13.828 7.238 -12.519 1.00 0.00 C ATOM 101 O SER A 10 14.628 7.307 -13.453 1.00 0.00 O ATOM 102 CB SER A 10 11.751 8.540 -13.015 1.00 0.00 C ATOM 103 OG SER A 10 12.087 8.311 -14.372 1.00 0.00 O ATOM 0 H SER A 10 13.830 10.072 -13.138 1.00 0.00 H new ATOM 0 HA SER A 10 12.666 8.316 -11.084 1.00 0.00 H new ATOM 0 HB2 SER A 10 11.007 7.811 -12.693 1.00 0.00 H new ATOM 0 HB3 SER A 10 11.297 9.526 -12.911 1.00 0.00 H new ATOM 0 HG SER A 10 11.280 8.376 -14.924 1.00 0.00 H new ATOM 109 N VAL A 11 13.642 6.132 -11.806 1.00 0.00 N ATOM 110 CA VAL A 11 14.383 4.907 -12.087 1.00 0.00 C ATOM 111 C VAL A 11 13.475 3.685 -12.009 1.00 0.00 C ATOM 112 O VAL A 11 12.635 3.580 -11.116 1.00 0.00 O ATOM 113 CB VAL A 11 15.557 4.724 -11.107 1.00 0.00 C ATOM 114 CG1 VAL A 11 16.333 3.458 -11.434 1.00 0.00 C ATOM 115 CG2 VAL A 11 16.469 5.941 -11.135 1.00 0.00 C ATOM 0 H VAL A 11 12.985 6.059 -11.029 1.00 0.00 H new ATOM 0 HA VAL A 11 14.776 5.000 -13.100 1.00 0.00 H new ATOM 0 HB VAL A 11 15.154 4.624 -10.099 1.00 0.00 H new ATOM 0 HG11 VAL A 11 17.159 3.345 -10.731 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.671 2.595 -11.357 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.727 3.524 -12.448 1.00 0.00 H new ATOM 0 HG21 VAL A 11 17.293 5.794 -10.437 1.00 0.00 H new ATOM 0 HG22 VAL A 11 16.866 6.075 -12.141 1.00 0.00 H new ATOM 0 HG23 VAL A 11 15.903 6.827 -10.847 1.00 0.00 H new ATOM 125 N GLU A 12 13.650 2.764 -12.951 1.00 0.00 N ATOM 126 CA GLU A 12 12.845 1.549 -12.989 1.00 0.00 C ATOM 127 C GLU A 12 13.724 0.309 -12.843 1.00 0.00 C ATOM 128 O GLU A 12 14.067 -0.342 -13.830 1.00 0.00 O ATOM 129 CB GLU A 12 12.054 1.475 -14.297 1.00 0.00 C ATOM 130 CG GLU A 12 12.753 2.141 -15.470 1.00 0.00 C ATOM 131 CD GLU A 12 12.403 3.611 -15.599 1.00 0.00 C ATOM 132 OE1 GLU A 12 11.344 4.016 -15.075 1.00 0.00 O ATOM 133 OE2 GLU A 12 13.187 4.355 -16.224 1.00 0.00 O ATOM 0 H GLU A 12 14.341 2.836 -13.697 1.00 0.00 H new ATOM 0 HA GLU A 12 12.147 1.580 -12.152 1.00 0.00 H new ATOM 0 HB2 GLU A 12 11.869 0.429 -14.541 1.00 0.00 H new ATOM 0 HB3 GLU A 12 11.081 1.945 -14.150 1.00 0.00 H new ATOM 0 HG2 GLU A 12 13.832 2.037 -15.352 1.00 0.00 H new ATOM 0 HG3 GLU A 12 12.482 1.625 -16.391 1.00 0.00 H new ATOM 140 N ASP A 13 14.085 -0.010 -11.605 1.00 0.00 N ATOM 141 CA ASP A 13 14.923 -1.171 -11.328 1.00 0.00 C ATOM 142 C ASP A 13 14.241 -2.110 -10.338 1.00 0.00 C ATOM 143 O ASP A 13 13.916 -1.717 -9.218 1.00 0.00 O ATOM 144 CB ASP A 13 16.280 -0.727 -10.778 1.00 0.00 C ATOM 145 CG ASP A 13 17.141 -0.059 -11.832 1.00 0.00 C ATOM 146 OD1 ASP A 13 16.590 0.706 -12.650 1.00 0.00 O ATOM 147 OD2 ASP A 13 18.366 -0.303 -11.839 1.00 0.00 O ATOM 0 H ASP A 13 13.810 0.519 -10.777 1.00 0.00 H new ATOM 0 HA ASP A 13 15.077 -1.709 -12.263 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.125 -0.037 -9.949 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.807 -1.593 -10.377 1.00 0.00 H new ATOM 152 N SER A 14 14.027 -3.352 -10.760 1.00 0.00 N ATOM 153 CA SER A 14 13.379 -4.345 -9.912 1.00 0.00 C ATOM 154 C SER A 14 11.973 -3.895 -9.524 1.00 0.00 C ATOM 155 O SER A 14 11.591 -3.953 -8.355 1.00 0.00 O ATOM 156 CB SER A 14 14.212 -4.595 -8.654 1.00 0.00 C ATOM 157 OG SER A 14 15.501 -5.084 -8.984 1.00 0.00 O ATOM 0 H SER A 14 14.293 -3.694 -11.683 1.00 0.00 H new ATOM 0 HA SER A 14 13.301 -5.273 -10.478 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.305 -3.669 -8.086 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.701 -5.313 -8.012 1.00 0.00 H new ATOM 0 HG SER A 14 16.014 -5.234 -8.163 1.00 0.00 H new ATOM 163 N LEU A 15 11.209 -3.447 -10.513 1.00 0.00 N ATOM 164 CA LEU A 15 9.845 -2.986 -10.277 1.00 0.00 C ATOM 165 C LEU A 15 8.852 -4.137 -10.404 1.00 0.00 C ATOM 166 O LEU A 15 8.934 -4.941 -11.332 1.00 0.00 O ATOM 167 CB LEU A 15 9.483 -1.874 -11.263 1.00 0.00 C ATOM 168 CG LEU A 15 9.907 -0.459 -10.864 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.539 0.535 -11.955 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.266 -0.064 -9.542 1.00 0.00 C ATOM 0 H LEU A 15 11.510 -3.393 -11.486 1.00 0.00 H new ATOM 0 HA LEU A 15 9.791 -2.594 -9.261 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.935 -2.109 -12.227 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.403 -1.881 -11.407 1.00 0.00 H new ATOM 0 HG LEU A 15 10.990 -0.446 -10.738 1.00 0.00 H new ATOM 0 HD11 LEU A 15 9.848 1.536 -11.654 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.044 0.262 -12.881 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.460 0.520 -12.112 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.578 0.945 -9.273 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.181 -0.094 -9.641 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.579 -0.760 -8.764 1.00 0.00 H new ATOM 182 N ALA A 16 7.912 -4.207 -9.467 1.00 0.00 N ATOM 183 CA ALA A 16 6.900 -5.256 -9.477 1.00 0.00 C ATOM 184 C ALA A 16 5.496 -4.665 -9.414 1.00 0.00 C ATOM 185 O ALA A 16 5.239 -3.725 -8.660 1.00 0.00 O ATOM 186 CB ALA A 16 7.124 -6.216 -8.318 1.00 0.00 C ATOM 0 H ALA A 16 7.830 -3.550 -8.691 1.00 0.00 H new ATOM 0 HA ALA A 16 6.992 -5.807 -10.413 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.361 -6.994 -8.338 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.110 -6.672 -8.409 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.062 -5.670 -7.376 1.00 0.00 H new ATOM 192 N THR A 17 4.588 -5.221 -10.210 1.00 0.00 N ATOM 193 CA THR A 17 3.210 -4.748 -10.245 1.00 0.00 C ATOM 194 C THR A 17 2.521 -4.960 -8.902 1.00 0.00 C ATOM 195 O THR A 17 2.183 -6.087 -8.537 1.00 0.00 O ATOM 196 CB THR A 17 2.399 -5.462 -11.344 1.00 0.00 C ATOM 197 OG1 THR A 17 3.135 -5.464 -12.572 1.00 0.00 O ATOM 198 CG2 THR A 17 1.055 -4.781 -11.553 1.00 0.00 C ATOM 0 H THR A 17 4.783 -6.000 -10.839 1.00 0.00 H new ATOM 0 HA THR A 17 3.248 -3.681 -10.466 1.00 0.00 H new ATOM 0 HB THR A 17 2.222 -6.489 -11.025 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.614 -5.921 -13.265 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.500 -5.302 -12.333 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.486 -4.807 -10.624 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.215 -3.745 -11.852 1.00 0.00 H new ATOM 206 N VAL A 18 2.314 -3.870 -8.170 1.00 0.00 N ATOM 207 CA VAL A 18 1.663 -3.937 -6.867 1.00 0.00 C ATOM 208 C VAL A 18 0.319 -3.218 -6.887 1.00 0.00 C ATOM 209 O VAL A 18 0.252 -2.010 -7.115 1.00 0.00 O ATOM 210 CB VAL A 18 2.547 -3.321 -5.766 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.793 -3.265 -4.446 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.840 -4.108 -5.618 1.00 0.00 C ATOM 0 H VAL A 18 2.588 -2.930 -8.457 1.00 0.00 H new ATOM 0 HA VAL A 18 1.504 -4.992 -6.646 1.00 0.00 H new ATOM 0 HB VAL A 18 2.801 -2.301 -6.056 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.433 -2.827 -3.680 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.898 -2.654 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.507 -4.274 -4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.452 -3.659 -4.836 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.610 -5.139 -5.351 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.386 -4.091 -6.561 1.00 0.00 H new ATOM 222 N LYS A 19 -0.751 -3.968 -6.645 1.00 0.00 N ATOM 223 CA LYS A 19 -2.095 -3.404 -6.633 1.00 0.00 C ATOM 224 C LYS A 19 -2.512 -3.021 -5.217 1.00 0.00 C ATOM 225 O LYS A 19 -2.480 -3.848 -4.305 1.00 0.00 O ATOM 226 CB LYS A 19 -3.095 -4.403 -7.218 1.00 0.00 C ATOM 227 CG LYS A 19 -2.909 -4.650 -8.705 1.00 0.00 C ATOM 228 CD LYS A 19 -3.861 -5.719 -9.216 1.00 0.00 C ATOM 229 CE LYS A 19 -3.276 -6.465 -10.405 1.00 0.00 C ATOM 230 NZ LYS A 19 -4.298 -7.298 -11.096 1.00 0.00 N ATOM 0 H LYS A 19 -0.713 -4.969 -6.454 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.089 -2.503 -7.247 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -3.003 -5.350 -6.687 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.107 -4.037 -7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -3.075 -3.722 -9.252 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.881 -4.955 -8.898 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.081 -6.425 -8.415 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.806 -5.258 -9.503 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.854 -5.749 -11.110 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -2.457 -7.101 -10.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.859 -7.790 -11.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -4.683 -7.998 -10.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.067 -6.689 -11.441 1.00 0.00 H new ATOM 244 N VAL A 20 -2.903 -1.763 -5.039 1.00 0.00 N ATOM 245 CA VAL A 20 -3.329 -1.272 -3.734 1.00 0.00 C ATOM 246 C VAL A 20 -4.845 -1.123 -3.670 1.00 0.00 C ATOM 247 O VAL A 20 -5.462 -0.552 -4.569 1.00 0.00 O ATOM 248 CB VAL A 20 -2.677 0.084 -3.405 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.205 0.624 -2.085 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.162 -0.048 -3.369 1.00 0.00 C ATOM 0 H VAL A 20 -2.933 -1.065 -5.782 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.008 -2.010 -2.998 1.00 0.00 H new ATOM 0 HB VAL A 20 -2.938 0.793 -4.190 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.733 1.583 -1.869 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.285 0.758 -2.153 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -2.976 -0.081 -1.286 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.718 0.920 -3.135 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.878 -0.772 -2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.803 -0.387 -4.341 1.00 0.00 H new ATOM 260 N VAL A 21 -5.440 -1.642 -2.601 1.00 0.00 N ATOM 261 CA VAL A 21 -6.885 -1.566 -2.418 1.00 0.00 C ATOM 262 C VAL A 21 -7.238 -0.834 -1.128 1.00 0.00 C ATOM 263 O VAL A 21 -6.713 -1.149 -0.059 1.00 0.00 O ATOM 264 CB VAL A 21 -7.521 -2.968 -2.391 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.032 -2.866 -2.244 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.151 -3.746 -3.645 1.00 0.00 C ATOM 0 H VAL A 21 -4.944 -2.120 -1.848 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.283 -1.011 -3.267 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.131 -3.508 -1.528 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.464 -3.866 -2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.273 -2.351 -1.314 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.443 -2.308 -3.085 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.609 -4.734 -3.608 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.511 -3.211 -4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.068 -3.850 -3.702 1.00 0.00 H new ATOM 276 N LEU A 22 -8.131 0.143 -1.235 1.00 0.00 N ATOM 277 CA LEU A 22 -8.556 0.921 -0.076 1.00 0.00 C ATOM 278 C LEU A 22 -9.625 0.176 0.717 1.00 0.00 C ATOM 279 O LEU A 22 -10.654 -0.220 0.170 1.00 0.00 O ATOM 280 CB LEU A 22 -9.090 2.284 -0.520 1.00 0.00 C ATOM 281 CG LEU A 22 -8.039 3.318 -0.923 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.666 4.414 -1.771 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.373 3.911 0.310 1.00 0.00 C ATOM 0 H LEU A 22 -8.575 0.416 -2.112 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.690 1.070 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.762 2.131 -1.364 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.687 2.700 0.292 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.275 2.818 -1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.903 5.141 -2.048 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.095 3.976 -2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.451 4.911 -1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.628 4.645 0.003 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.125 4.396 0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.888 3.118 0.879 1.00 0.00 H new ATOM 295 N ILE A 23 -9.374 -0.009 2.009 1.00 0.00 N ATOM 296 CA ILE A 23 -10.317 -0.702 2.878 1.00 0.00 C ATOM 297 C ILE A 23 -11.568 0.137 3.112 1.00 0.00 C ATOM 298 O ILE A 23 -12.690 -0.281 2.822 1.00 0.00 O ATOM 299 CB ILE A 23 -9.681 -1.047 4.237 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.021 -2.426 4.181 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.729 -1.000 5.339 1.00 0.00 C ATOM 302 CD1 ILE A 23 -9.977 -3.539 3.809 1.00 0.00 C ATOM 0 H ILE A 23 -8.526 0.311 2.477 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.593 -1.626 2.371 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.913 -0.307 4.460 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.206 -2.401 3.457 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.578 -2.648 5.152 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.264 -1.246 6.294 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.157 0.001 5.391 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.517 -1.721 5.123 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.441 -4.488 3.789 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -10.779 -3.591 4.546 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.401 -3.341 2.825 1.00 0.00 H new ATOM 314 N PRO A 24 -11.375 1.351 3.649 1.00 0.00 N ATOM 315 CA PRO A 24 -12.476 2.276 3.933 1.00 0.00 C ATOM 316 C PRO A 24 -13.108 2.831 2.661 1.00 0.00 C ATOM 317 O PRO A 24 -14.311 3.089 2.616 1.00 0.00 O ATOM 318 CB PRO A 24 -11.801 3.397 4.728 1.00 0.00 C ATOM 319 CG PRO A 24 -10.374 3.358 4.302 1.00 0.00 C ATOM 320 CD PRO A 24 -10.065 1.914 4.020 1.00 0.00 C ATOM 0 HA PRO A 24 -13.292 1.788 4.467 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.253 4.365 4.510 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -11.898 3.235 5.801 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.215 3.971 3.415 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.723 3.751 5.083 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.339 1.808 3.214 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.646 1.415 4.894 1.00 0.00 H new ATOM 328 N VAL A 25 -12.290 3.013 1.629 1.00 0.00 N ATOM 329 CA VAL A 25 -12.770 3.537 0.356 1.00 0.00 C ATOM 330 C VAL A 25 -13.260 2.413 -0.550 1.00 0.00 C ATOM 331 O VAL A 25 -14.381 2.454 -1.055 1.00 0.00 O ATOM 332 CB VAL A 25 -11.670 4.329 -0.375 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.283 5.278 -1.394 1.00 0.00 C ATOM 334 CG2 VAL A 25 -10.808 5.088 0.622 1.00 0.00 C ATOM 0 H VAL A 25 -11.292 2.805 1.650 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.600 4.207 0.581 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.032 3.624 -0.908 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.491 5.829 -1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.853 4.707 -2.126 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.945 5.979 -0.886 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.036 5.642 0.088 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.430 5.784 1.185 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.339 4.383 1.309 1.00 0.00 H new ATOM 344 N GLY A 26 -12.412 1.410 -0.752 1.00 0.00 N ATOM 345 CA GLY A 26 -12.777 0.288 -1.597 1.00 0.00 C ATOM 346 C GLY A 26 -12.312 0.466 -3.029 1.00 0.00 C ATOM 347 O GLY A 26 -12.602 -0.365 -3.889 1.00 0.00 O ATOM 0 H GLY A 26 -11.478 1.354 -0.345 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.345 -0.626 -1.189 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -13.860 0.163 -1.583 1.00 0.00 H new ATOM 351 N GLN A 27 -11.591 1.553 -3.285 1.00 0.00 N ATOM 352 CA GLN A 27 -11.088 1.837 -4.623 1.00 0.00 C ATOM 353 C GLN A 27 -9.808 1.055 -4.901 1.00 0.00 C ATOM 354 O GLN A 27 -9.099 0.659 -3.977 1.00 0.00 O ATOM 355 CB GLN A 27 -10.829 3.336 -4.786 1.00 0.00 C ATOM 356 CG GLN A 27 -10.763 3.789 -6.235 1.00 0.00 C ATOM 357 CD GLN A 27 -10.695 5.297 -6.374 1.00 0.00 C ATOM 358 OE1 GLN A 27 -11.718 5.965 -6.521 1.00 0.00 O ATOM 359 NE2 GLN A 27 -9.485 5.841 -6.327 1.00 0.00 N ATOM 0 H GLN A 27 -11.342 2.251 -2.584 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.846 1.526 -5.342 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.618 3.890 -4.277 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.891 3.590 -4.292 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.889 3.345 -6.711 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.639 3.418 -6.768 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.664 5.249 -6.204 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -9.376 6.851 -6.414 1.00 0.00 H new ATOM 368 N GLU A 28 -9.520 0.837 -6.181 1.00 0.00 N ATOM 369 CA GLU A 28 -8.326 0.101 -6.579 1.00 0.00 C ATOM 370 C GLU A 28 -7.331 1.019 -7.283 1.00 0.00 C ATOM 371 O GLU A 28 -7.708 1.828 -8.131 1.00 0.00 O ATOM 372 CB GLU A 28 -8.701 -1.063 -7.499 1.00 0.00 C ATOM 373 CG GLU A 28 -9.139 -2.312 -6.753 1.00 0.00 C ATOM 374 CD GLU A 28 -10.571 -2.226 -6.262 1.00 0.00 C ATOM 375 OE1 GLU A 28 -11.468 -1.975 -7.093 1.00 0.00 O ATOM 376 OE2 GLU A 28 -10.794 -2.410 -5.047 1.00 0.00 O ATOM 0 H GLU A 28 -10.096 1.159 -6.958 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.856 -0.294 -5.678 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.505 -0.746 -8.163 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.846 -1.307 -8.129 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.035 -3.177 -7.408 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.476 -2.474 -5.903 1.00 0.00 H new ATOM 383 N ILE A 29 -6.058 0.888 -6.923 1.00 0.00 N ATOM 384 CA ILE A 29 -5.009 1.705 -7.519 1.00 0.00 C ATOM 385 C ILE A 29 -3.819 0.850 -7.940 1.00 0.00 C ATOM 386 O ILE A 29 -3.434 -0.087 -7.240 1.00 0.00 O ATOM 387 CB ILE A 29 -4.523 2.796 -6.546 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.714 3.576 -5.985 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.550 3.734 -7.245 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.313 4.774 -5.152 1.00 0.00 C ATOM 0 H ILE A 29 -5.729 0.224 -6.222 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.442 2.181 -8.399 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.003 2.317 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.340 3.912 -6.812 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.322 2.907 -5.376 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.216 4.499 -6.545 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.690 3.167 -7.601 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.047 4.209 -8.091 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.207 5.279 -4.787 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.712 4.443 -4.305 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.731 5.464 -5.763 1.00 0.00 H new ATOM 402 N VAL A 30 -3.238 1.179 -9.090 1.00 0.00 N ATOM 403 CA VAL A 30 -2.089 0.442 -9.604 1.00 0.00 C ATOM 404 C VAL A 30 -0.861 1.340 -9.703 1.00 0.00 C ATOM 405 O VAL A 30 -0.903 2.399 -10.329 1.00 0.00 O ATOM 406 CB VAL A 30 -2.384 -0.160 -10.991 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.156 -0.875 -11.534 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.573 -1.106 -10.918 1.00 0.00 C ATOM 0 H VAL A 30 -3.544 1.951 -9.683 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.889 -0.366 -8.900 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.635 0.651 -11.675 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.383 -1.294 -12.514 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.333 -0.167 -11.624 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.872 -1.678 -10.853 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.768 -1.522 -11.906 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.353 -1.914 -10.221 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.452 -0.560 -10.575 1.00 0.00 H new ATOM 418 N ILE A 31 0.231 0.908 -9.082 1.00 0.00 N ATOM 419 CA ILE A 31 1.473 1.672 -9.101 1.00 0.00 C ATOM 420 C ILE A 31 2.684 0.757 -8.953 1.00 0.00 C ATOM 421 O ILE A 31 2.720 -0.133 -8.104 1.00 0.00 O ATOM 422 CB ILE A 31 1.501 2.728 -7.981 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.839 3.472 -7.985 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.258 2.073 -6.629 1.00 0.00 C ATOM 425 CD1 ILE A 31 3.041 4.358 -6.776 1.00 0.00 C ATOM 0 H ILE A 31 0.281 0.033 -8.560 1.00 0.00 H new ATOM 0 HA ILE A 31 1.518 2.177 -10.066 1.00 0.00 H new ATOM 0 HB ILE A 31 0.704 3.449 -8.162 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.650 2.745 -8.032 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.904 4.081 -8.887 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.281 2.832 -5.847 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.284 1.584 -6.631 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.035 1.333 -6.438 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.009 4.854 -6.846 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.251 5.108 -6.739 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.008 3.752 -5.871 1.00 0.00 H new ATOM 437 N PRO A 32 3.701 0.981 -9.799 1.00 0.00 N ATOM 438 CA PRO A 32 4.934 0.188 -9.781 1.00 0.00 C ATOM 439 C PRO A 32 5.778 0.457 -8.539 1.00 0.00 C ATOM 440 O PRO A 32 6.208 1.586 -8.302 1.00 0.00 O ATOM 441 CB PRO A 32 5.672 0.652 -11.039 1.00 0.00 C ATOM 442 CG PRO A 32 5.158 2.026 -11.295 1.00 0.00 C ATOM 443 CD PRO A 32 3.726 2.025 -10.837 1.00 0.00 C ATOM 0 HA PRO A 32 4.730 -0.883 -9.760 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.751 0.655 -10.886 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.471 -0.009 -11.882 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.741 2.768 -10.750 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.229 2.278 -12.353 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.431 2.996 -10.438 1.00 0.00 H new ATOM 0 HD3 PRO A 32 3.043 1.795 -11.655 1.00 0.00 H new ATOM 451 N PHE A 33 6.011 -0.586 -7.750 1.00 0.00 N ATOM 452 CA PHE A 33 6.803 -0.462 -6.532 1.00 0.00 C ATOM 453 C PHE A 33 8.003 -1.403 -6.566 1.00 0.00 C ATOM 454 O PHE A 33 7.944 -2.483 -7.155 1.00 0.00 O ATOM 455 CB PHE A 33 5.940 -0.762 -5.305 1.00 0.00 C ATOM 456 CG PHE A 33 6.522 -0.240 -4.022 1.00 0.00 C ATOM 457 CD1 PHE A 33 6.871 1.095 -3.896 1.00 0.00 C ATOM 458 CD2 PHE A 33 6.720 -1.085 -2.942 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.406 1.578 -2.716 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.254 -0.608 -1.760 1.00 0.00 C ATOM 461 CZ PHE A 33 7.598 0.725 -1.647 1.00 0.00 C ATOM 0 H PHE A 33 5.663 -1.527 -7.932 1.00 0.00 H new ATOM 0 HA PHE A 33 7.169 0.563 -6.469 1.00 0.00 H new ATOM 0 HB2 PHE A 33 4.952 -0.326 -5.450 1.00 0.00 H new ATOM 0 HB3 PHE A 33 5.804 -1.840 -5.221 1.00 0.00 H new ATOM 0 HD1 PHE A 33 6.723 1.766 -4.729 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.454 -2.128 -3.025 1.00 0.00 H new ATOM 0 HE1 PHE A 33 7.673 2.621 -2.630 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.402 -1.277 -0.925 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.016 1.099 -0.724 1.00 0.00 H new ATOM 471 N LYS A 34 9.093 -0.985 -5.931 1.00 0.00 N ATOM 472 CA LYS A 34 10.309 -1.789 -5.887 1.00 0.00 C ATOM 473 C LYS A 34 10.216 -2.857 -4.801 1.00 0.00 C ATOM 474 O LYS A 34 9.737 -2.594 -3.697 1.00 0.00 O ATOM 475 CB LYS A 34 11.526 -0.896 -5.636 1.00 0.00 C ATOM 476 CG LYS A 34 12.018 -0.175 -6.879 1.00 0.00 C ATOM 477 CD LYS A 34 13.389 0.442 -6.660 1.00 0.00 C ATOM 478 CE LYS A 34 13.284 1.828 -6.042 1.00 0.00 C ATOM 479 NZ LYS A 34 14.579 2.275 -5.458 1.00 0.00 N ATOM 0 H LYS A 34 9.159 -0.094 -5.440 1.00 0.00 H new ATOM 0 HA LYS A 34 10.422 -2.285 -6.851 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.274 -0.158 -4.874 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.336 -1.505 -5.235 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.062 -0.875 -7.713 1.00 0.00 H new ATOM 0 HG3 LYS A 34 11.307 0.604 -7.154 1.00 0.00 H new ATOM 0 HD2 LYS A 34 13.980 -0.203 -6.010 1.00 0.00 H new ATOM 0 HD3 LYS A 34 13.917 0.506 -7.612 1.00 0.00 H new ATOM 0 HE2 LYS A 34 12.963 2.541 -6.802 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.518 1.823 -5.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.569 3.308 -5.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 14.716 1.824 -4.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 15.357 2.006 -6.093 1.00 0.00 H new ATOM 493 N VAL A 35 10.678 -4.061 -5.121 1.00 0.00 N ATOM 494 CA VAL A 35 10.649 -5.168 -4.172 1.00 0.00 C ATOM 495 C VAL A 35 11.854 -5.123 -3.239 1.00 0.00 C ATOM 496 O VAL A 35 11.951 -5.909 -2.296 1.00 0.00 O ATOM 497 CB VAL A 35 10.623 -6.527 -4.895 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.435 -6.607 -5.841 1.00 0.00 C ATOM 499 CG2 VAL A 35 11.927 -6.756 -5.644 1.00 0.00 C ATOM 0 H VAL A 35 11.077 -4.295 -6.030 1.00 0.00 H new ATOM 0 HA VAL A 35 9.736 -5.060 -3.587 1.00 0.00 H new ATOM 0 HB VAL A 35 10.515 -7.314 -4.148 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.434 -7.575 -6.343 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.511 -6.491 -5.275 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.508 -5.813 -6.584 1.00 0.00 H new ATOM 0 HG21 VAL A 35 11.892 -7.721 -6.149 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.067 -5.965 -6.381 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.758 -6.746 -4.939 1.00 0.00 H new ATOM 509 N ASP A 36 12.769 -4.199 -3.508 1.00 0.00 N ATOM 510 CA ASP A 36 13.969 -4.050 -2.692 1.00 0.00 C ATOM 511 C ASP A 36 13.941 -2.735 -1.920 1.00 0.00 C ATOM 512 O ASP A 36 14.864 -2.424 -1.167 1.00 0.00 O ATOM 513 CB ASP A 36 15.220 -4.115 -3.569 1.00 0.00 C ATOM 514 CG ASP A 36 16.422 -3.467 -2.911 1.00 0.00 C ATOM 515 OD1 ASP A 36 17.148 -4.171 -2.178 1.00 0.00 O ATOM 516 OD2 ASP A 36 16.637 -2.256 -3.128 1.00 0.00 O ATOM 0 H ASP A 36 12.703 -3.541 -4.285 1.00 0.00 H new ATOM 0 HA ASP A 36 13.995 -4.871 -1.975 1.00 0.00 H new ATOM 0 HB2 ASP A 36 15.450 -5.157 -3.793 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.020 -3.621 -4.520 1.00 0.00 H new ATOM 521 N THR A 37 12.875 -1.964 -2.112 1.00 0.00 N ATOM 522 CA THR A 37 12.727 -0.681 -1.437 1.00 0.00 C ATOM 523 C THR A 37 11.725 -0.775 -0.292 1.00 0.00 C ATOM 524 O THR A 37 10.581 -1.186 -0.488 1.00 0.00 O ATOM 525 CB THR A 37 12.272 0.420 -2.414 1.00 0.00 C ATOM 526 OG1 THR A 37 13.284 0.647 -3.401 1.00 0.00 O ATOM 527 CG2 THR A 37 11.981 1.715 -1.671 1.00 0.00 C ATOM 0 H THR A 37 12.101 -2.207 -2.730 1.00 0.00 H new ATOM 0 HA THR A 37 13.707 -0.419 -1.038 1.00 0.00 H new ATOM 0 HB THR A 37 11.357 0.087 -2.903 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.149 0.774 -2.959 1.00 0.00 H new ATOM 0 HG21 THR A 37 11.661 2.478 -2.381 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.190 1.545 -0.940 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.883 2.051 -1.159 1.00 0.00 H new ATOM 535 N ILE A 38 12.161 -0.390 0.903 1.00 0.00 N ATOM 536 CA ILE A 38 11.300 -0.430 2.079 1.00 0.00 C ATOM 537 C ILE A 38 9.887 0.034 1.741 1.00 0.00 C ATOM 538 O ILE A 38 9.697 0.956 0.946 1.00 0.00 O ATOM 539 CB ILE A 38 11.858 0.447 3.215 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.090 1.876 2.718 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.150 -0.147 3.757 1.00 0.00 C ATOM 542 CD1 ILE A 38 13.051 2.666 3.579 1.00 0.00 C ATOM 0 H ILE A 38 13.105 -0.047 1.082 1.00 0.00 H new ATOM 0 HA ILE A 38 11.270 -1.467 2.413 1.00 0.00 H new ATOM 0 HB ILE A 38 11.128 0.477 4.023 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.474 1.840 1.698 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.134 2.399 2.680 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.532 0.484 4.559 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.956 -1.148 4.143 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.888 -0.204 2.957 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.168 3.669 3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 38 12.659 2.733 4.594 1.00 0.00 H new ATOM 0 HD13 ILE A 38 14.019 2.166 3.597 1.00 0.00 H new ATOM 554 N LEU A 39 8.898 -0.610 2.351 1.00 0.00 N ATOM 555 CA LEU A 39 7.500 -0.263 2.117 1.00 0.00 C ATOM 556 C LEU A 39 7.217 1.173 2.547 1.00 0.00 C ATOM 557 O LEU A 39 6.194 1.752 2.179 1.00 0.00 O ATOM 558 CB LEU A 39 6.582 -1.224 2.874 1.00 0.00 C ATOM 559 CG LEU A 39 6.596 -2.678 2.400 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.228 -3.614 3.540 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.647 -2.866 1.225 1.00 0.00 C ATOM 0 H LEU A 39 9.038 -1.375 3.011 1.00 0.00 H new ATOM 0 HA LEU A 39 7.304 -0.349 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.858 -1.204 3.928 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.561 -0.850 2.804 1.00 0.00 H new ATOM 0 HG LEU A 39 7.605 -2.922 2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.243 -4.644 3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.947 -3.500 4.351 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.230 -3.370 3.903 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.670 -3.907 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.634 -2.603 1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.956 -2.223 0.401 1.00 0.00 H new ATOM 573 N LYS A 40 8.130 1.744 3.325 1.00 0.00 N ATOM 574 CA LYS A 40 7.981 3.113 3.802 1.00 0.00 C ATOM 575 C LYS A 40 7.699 4.066 2.645 1.00 0.00 C ATOM 576 O LYS A 40 6.789 4.892 2.716 1.00 0.00 O ATOM 577 CB LYS A 40 9.244 3.557 4.545 1.00 0.00 C ATOM 578 CG LYS A 40 8.984 4.597 5.621 1.00 0.00 C ATOM 579 CD LYS A 40 8.940 6.000 5.040 1.00 0.00 C ATOM 580 CE LYS A 40 9.356 7.042 6.068 1.00 0.00 C ATOM 581 NZ LYS A 40 8.291 7.275 7.082 1.00 0.00 N ATOM 0 H LYS A 40 8.982 1.279 3.639 1.00 0.00 H new ATOM 0 HA LYS A 40 7.134 3.141 4.487 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.713 2.685 5.001 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.955 3.962 3.825 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.039 4.378 6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.765 4.540 6.379 1.00 0.00 H new ATOM 0 HD2 LYS A 40 9.600 6.057 4.174 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.932 6.218 4.687 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.268 6.716 6.568 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.587 7.979 5.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.612 7.991 7.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.428 7.611 6.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 8.088 6.386 7.582 1.00 0.00 H new ATOM 595 N TYR A 41 8.483 3.944 1.580 1.00 0.00 N ATOM 596 CA TYR A 41 8.318 4.794 0.407 1.00 0.00 C ATOM 597 C TYR A 41 6.849 4.893 0.009 1.00 0.00 C ATOM 598 O TYR A 41 6.241 5.962 0.092 1.00 0.00 O ATOM 599 CB TYR A 41 9.139 4.250 -0.763 1.00 0.00 C ATOM 600 CG TYR A 41 10.591 4.670 -0.731 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.425 4.279 0.309 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.130 5.458 -1.741 1.00 0.00 C ATOM 603 CE1 TYR A 41 12.752 4.661 0.343 1.00 0.00 C ATOM 604 CE2 TYR A 41 12.456 5.844 -1.716 1.00 0.00 C ATOM 605 CZ TYR A 41 13.263 5.443 -0.672 1.00 0.00 C ATOM 606 OH TYR A 41 14.585 5.825 -0.642 1.00 0.00 O ATOM 0 H TYR A 41 9.240 3.264 1.505 1.00 0.00 H new ATOM 0 HA TYR A 41 8.676 5.792 0.660 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.084 3.161 -0.759 1.00 0.00 H new ATOM 0 HB3 TYR A 41 8.692 4.588 -1.698 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.029 3.666 1.105 1.00 0.00 H new ATOM 0 HD2 TYR A 41 10.501 5.774 -2.560 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.386 4.349 1.160 1.00 0.00 H new ATOM 0 HE2 TYR A 41 12.858 6.456 -2.509 1.00 0.00 H new ATOM 0 HH TYR A 41 14.786 6.372 -1.430 1.00 0.00 H new ATOM 616 N LEU A 42 6.283 3.772 -0.424 1.00 0.00 N ATOM 617 CA LEU A 42 4.884 3.730 -0.835 1.00 0.00 C ATOM 618 C LEU A 42 3.975 4.253 0.273 1.00 0.00 C ATOM 619 O LEU A 42 2.955 4.889 0.006 1.00 0.00 O ATOM 620 CB LEU A 42 4.483 2.301 -1.206 1.00 0.00 C ATOM 621 CG LEU A 42 3.126 2.141 -1.892 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.219 2.534 -3.358 1.00 0.00 C ATOM 623 CD2 LEU A 42 2.623 0.712 -1.752 1.00 0.00 C ATOM 0 H LEU A 42 6.771 2.880 -0.500 1.00 0.00 H new ATOM 0 HA LEU A 42 4.769 4.372 -1.708 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.250 1.888 -1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.482 1.698 -0.298 1.00 0.00 H new ATOM 0 HG LEU A 42 2.413 2.805 -1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.244 2.414 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.534 3.575 -3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.946 1.896 -3.860 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.656 0.617 -2.246 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.336 0.029 -2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.516 0.466 -0.696 1.00 0.00 H new ATOM 635 N LYS A 43 4.352 3.984 1.518 1.00 0.00 N ATOM 636 CA LYS A 43 3.575 4.429 2.668 1.00 0.00 C ATOM 637 C LYS A 43 3.517 5.953 2.728 1.00 0.00 C ATOM 638 O LYS A 43 2.466 6.533 3.000 1.00 0.00 O ATOM 639 CB LYS A 43 4.178 3.879 3.962 1.00 0.00 C ATOM 640 CG LYS A 43 3.250 3.987 5.160 1.00 0.00 C ATOM 641 CD LYS A 43 3.795 3.228 6.358 1.00 0.00 C ATOM 642 CE LYS A 43 3.392 1.762 6.320 1.00 0.00 C ATOM 643 NZ LYS A 43 3.510 1.120 7.658 1.00 0.00 N ATOM 0 H LYS A 43 5.193 3.459 1.757 1.00 0.00 H new ATOM 0 HA LYS A 43 2.560 4.048 2.558 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.444 2.833 3.813 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.102 4.415 4.179 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.115 5.036 5.423 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.267 3.596 4.897 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.882 3.307 6.376 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.427 3.684 7.277 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.365 1.677 5.966 1.00 0.00 H new ATOM 0 HE3 LYS A 43 4.021 1.231 5.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.562 0.088 7.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 4.371 1.460 8.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 2.679 1.363 8.234 1.00 0.00 H new ATOM 657 N ASP A 44 4.653 6.593 2.473 1.00 0.00 N ATOM 658 CA ASP A 44 4.731 8.049 2.496 1.00 0.00 C ATOM 659 C ASP A 44 3.948 8.654 1.335 1.00 0.00 C ATOM 660 O ASP A 44 3.140 9.564 1.524 1.00 0.00 O ATOM 661 CB ASP A 44 6.190 8.504 2.434 1.00 0.00 C ATOM 662 CG ASP A 44 6.326 10.014 2.423 1.00 0.00 C ATOM 663 OD1 ASP A 44 6.359 10.614 3.517 1.00 0.00 O ATOM 664 OD2 ASP A 44 6.399 10.595 1.320 1.00 0.00 O ATOM 0 H ASP A 44 5.532 6.127 2.248 1.00 0.00 H new ATOM 0 HA ASP A 44 4.289 8.397 3.430 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.730 8.100 3.290 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.658 8.094 1.539 1.00 0.00 H new ATOM 669 N HIS A 45 4.192 8.142 0.133 1.00 0.00 N ATOM 670 CA HIS A 45 3.510 8.633 -1.060 1.00 0.00 C ATOM 671 C HIS A 45 2.021 8.832 -0.791 1.00 0.00 C ATOM 672 O HIS A 45 1.408 9.770 -1.300 1.00 0.00 O ATOM 673 CB HIS A 45 3.704 7.658 -2.221 1.00 0.00 C ATOM 674 CG HIS A 45 3.381 8.248 -3.559 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.324 8.435 -4.547 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.209 8.692 -4.071 1.00 0.00 C ATOM 677 CE1 HIS A 45 3.748 8.971 -5.608 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.464 9.136 -5.345 1.00 0.00 N ATOM 0 H HIS A 45 4.856 7.388 -0.041 1.00 0.00 H new ATOM 0 HA HIS A 45 3.945 9.596 -1.327 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.738 7.312 -2.226 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.076 6.782 -2.058 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.252 8.696 -3.571 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.242 9.230 -6.533 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.774 9.529 -5.985 1.00 0.00 H new ATOM 687 N PHE A 46 1.446 7.942 0.012 1.00 0.00 N ATOM 688 CA PHE A 46 0.029 8.019 0.347 1.00 0.00 C ATOM 689 C PHE A 46 -0.190 8.875 1.592 1.00 0.00 C ATOM 690 O PHE A 46 -1.255 9.466 1.772 1.00 0.00 O ATOM 691 CB PHE A 46 -0.541 6.617 0.572 1.00 0.00 C ATOM 692 CG PHE A 46 -0.901 5.905 -0.700 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.071 5.259 -1.447 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.211 5.882 -1.149 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.257 4.602 -2.618 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.545 5.227 -2.320 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.567 4.587 -3.055 1.00 0.00 C ATOM 0 H PHE A 46 1.939 7.160 0.442 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.491 8.485 -0.490 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.189 6.020 1.119 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.428 6.691 1.201 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.097 5.269 -1.110 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.980 6.381 -0.578 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.510 4.101 -3.190 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.570 5.216 -2.659 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.826 4.075 -3.970 1.00 0.00 H new ATOM 707 N SER A 47 0.826 8.936 2.447 1.00 0.00 N ATOM 708 CA SER A 47 0.744 9.715 3.677 1.00 0.00 C ATOM 709 C SER A 47 0.648 11.206 3.369 1.00 0.00 C ATOM 710 O SER A 47 -0.076 11.945 4.038 1.00 0.00 O ATOM 711 CB SER A 47 1.962 9.442 4.560 1.00 0.00 C ATOM 712 OG SER A 47 3.044 10.289 4.212 1.00 0.00 O ATOM 0 H SER A 47 1.715 8.455 2.311 1.00 0.00 H new ATOM 0 HA SER A 47 -0.157 9.413 4.211 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.698 9.595 5.606 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.264 8.400 4.457 1.00 0.00 H new ATOM 0 HG SER A 47 3.230 10.206 3.253 1.00 0.00 H new ATOM 718 N HIS A 48 1.384 11.643 2.352 1.00 0.00 N ATOM 719 CA HIS A 48 1.382 13.046 1.954 1.00 0.00 C ATOM 720 C HIS A 48 0.111 13.391 1.183 1.00 0.00 C ATOM 721 O HIS A 48 -0.613 14.320 1.543 1.00 0.00 O ATOM 722 CB HIS A 48 2.611 13.358 1.100 1.00 0.00 C ATOM 723 CG HIS A 48 2.397 13.126 -0.364 1.00 0.00 C ATOM 724 ND1 HIS A 48 2.917 12.041 -1.038 1.00 0.00 N ATOM 725 CD2 HIS A 48 1.713 13.846 -1.284 1.00 0.00 C ATOM 726 CE1 HIS A 48 2.564 12.104 -2.310 1.00 0.00 C ATOM 727 NE2 HIS A 48 1.832 13.190 -2.485 1.00 0.00 N ATOM 0 H HIS A 48 1.989 11.046 1.789 1.00 0.00 H new ATOM 0 HA HIS A 48 1.414 13.654 2.858 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.898 14.398 1.257 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.445 12.743 1.439 1.00 0.00 H new ATOM 0 HD2 HIS A 48 1.174 14.765 -1.107 1.00 0.00 H new ATOM 0 HE1 HIS A 48 2.829 11.390 -3.076 1.00 0.00 H new ATOM 0 HE2 HIS A 48 1.422 13.492 -3.369 1.00 0.00 H new ATOM 736 N LEU A 49 -0.153 12.638 0.121 1.00 0.00 N ATOM 737 CA LEU A 49 -1.336 12.864 -0.702 1.00 0.00 C ATOM 738 C LEU A 49 -2.590 12.954 0.161 1.00 0.00 C ATOM 739 O LEU A 49 -3.318 13.947 0.116 1.00 0.00 O ATOM 740 CB LEU A 49 -1.489 11.741 -1.729 1.00 0.00 C ATOM 741 CG LEU A 49 -2.523 11.976 -2.831 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.903 12.192 -2.231 1.00 0.00 C ATOM 743 CD2 LEU A 49 -2.123 13.164 -3.694 1.00 0.00 C ATOM 0 H LEU A 49 0.436 11.866 -0.190 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.209 13.812 -1.226 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.520 11.570 -2.198 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.753 10.825 -1.200 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.559 11.089 -3.463 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.625 12.358 -3.030 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.192 11.312 -1.657 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.882 13.062 -1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.870 13.316 -4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.058 14.058 -3.074 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -1.154 12.970 -4.154 1.00 0.00 H new ATOM 755 N LEU A 50 -2.837 11.913 0.948 1.00 0.00 N ATOM 756 CA LEU A 50 -4.002 11.874 1.824 1.00 0.00 C ATOM 757 C LEU A 50 -3.952 13.005 2.846 1.00 0.00 C ATOM 758 O LEU A 50 -4.965 13.642 3.133 1.00 0.00 O ATOM 759 CB LEU A 50 -4.081 10.526 2.541 1.00 0.00 C ATOM 760 CG LEU A 50 -4.271 9.300 1.647 1.00 0.00 C ATOM 761 CD1 LEU A 50 -3.928 8.027 2.406 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.697 9.240 1.119 1.00 0.00 C ATOM 0 H LEU A 50 -2.245 11.084 0.997 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.893 12.003 1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.167 10.391 3.119 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.906 10.563 3.252 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.594 9.386 0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.069 7.165 1.754 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.889 8.068 2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.579 7.935 3.275 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.814 8.361 0.485 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.393 9.178 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.908 10.138 0.537 1.00 0.00 H new ATOM 774 N GLY A 51 -2.765 13.251 3.392 1.00 0.00 N ATOM 775 CA GLY A 51 -2.604 14.307 4.375 1.00 0.00 C ATOM 776 C GLY A 51 -2.479 13.770 5.787 1.00 0.00 C ATOM 777 O GLY A 51 -2.336 14.537 6.739 1.00 0.00 O ATOM 0 H GLY A 51 -1.912 12.738 3.171 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.717 14.893 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.457 14.983 4.321 1.00 0.00 H new ATOM 781 N ILE A 52 -2.535 12.449 5.923 1.00 0.00 N ATOM 782 CA ILE A 52 -2.427 11.812 7.229 1.00 0.00 C ATOM 783 C ILE A 52 -1.051 11.184 7.423 1.00 0.00 C ATOM 784 O ILE A 52 -0.396 10.758 6.471 1.00 0.00 O ATOM 785 CB ILE A 52 -3.505 10.727 7.417 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.243 9.549 6.477 1.00 0.00 C ATOM 787 CG2 ILE A 52 -4.889 11.309 7.173 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.321 8.489 6.521 1.00 0.00 C ATOM 0 H ILE A 52 -2.654 11.800 5.145 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.575 12.594 7.974 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.460 10.364 8.444 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.153 9.922 5.457 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.287 9.094 6.736 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.640 10.531 7.309 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.073 12.119 7.879 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.947 11.695 6.155 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.069 7.685 5.830 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.396 8.088 7.532 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.276 8.929 6.233 1.00 0.00 H new ATOM 800 N PRO A 53 -0.601 11.122 8.685 1.00 0.00 N ATOM 801 CA PRO A 53 0.701 10.546 9.034 1.00 0.00 C ATOM 802 C PRO A 53 0.734 9.033 8.845 1.00 0.00 C ATOM 803 O PRO A 53 -0.227 8.335 9.169 1.00 0.00 O ATOM 804 CB PRO A 53 0.862 10.903 10.514 1.00 0.00 C ATOM 805 CG PRO A 53 -0.531 11.062 11.019 1.00 0.00 C ATOM 806 CD PRO A 53 -1.329 11.611 9.869 1.00 0.00 C ATOM 0 HA PRO A 53 1.500 10.930 8.400 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.392 10.119 11.055 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.436 11.821 10.640 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -0.936 10.107 11.354 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.561 11.738 11.873 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.358 11.251 9.885 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.372 12.700 9.893 1.00 0.00 H new ATOM 814 N HIS A 54 1.847 8.532 8.318 1.00 0.00 N ATOM 815 CA HIS A 54 2.006 7.100 8.087 1.00 0.00 C ATOM 816 C HIS A 54 1.863 6.320 9.390 1.00 0.00 C ATOM 817 O HIS A 54 1.739 5.095 9.382 1.00 0.00 O ATOM 818 CB HIS A 54 3.367 6.813 7.453 1.00 0.00 C ATOM 819 CG HIS A 54 4.502 7.524 8.122 1.00 0.00 C ATOM 820 ND1 HIS A 54 5.054 7.107 9.315 1.00 0.00 N ATOM 821 CD2 HIS A 54 5.191 8.631 7.758 1.00 0.00 C ATOM 822 CE1 HIS A 54 6.031 7.927 9.657 1.00 0.00 C ATOM 823 NE2 HIS A 54 6.135 8.861 8.728 1.00 0.00 N ATOM 0 H HIS A 54 2.651 9.096 8.043 1.00 0.00 H new ATOM 0 HA HIS A 54 1.220 6.777 7.404 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.553 5.739 7.483 1.00 0.00 H new ATOM 0 HB3 HIS A 54 3.337 7.102 6.402 1.00 0.00 H new ATOM 0 HD2 HIS A 54 5.028 9.223 6.870 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.641 7.848 10.545 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.807 9.628 8.731 1.00 0.00 H new ATOM 832 N SER A 55 1.884 7.038 10.509 1.00 0.00 N ATOM 833 CA SER A 55 1.761 6.412 11.821 1.00 0.00 C ATOM 834 C SER A 55 0.453 5.636 11.932 1.00 0.00 C ATOM 835 O SER A 55 0.450 4.441 12.229 1.00 0.00 O ATOM 836 CB SER A 55 1.835 7.470 12.923 1.00 0.00 C ATOM 837 OG SER A 55 3.180 7.747 13.275 1.00 0.00 O ATOM 0 H SER A 55 1.985 8.053 10.533 1.00 0.00 H new ATOM 0 HA SER A 55 2.589 5.713 11.942 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.348 8.385 12.586 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.290 7.124 13.801 1.00 0.00 H new ATOM 0 HG SER A 55 3.200 8.427 13.980 1.00 0.00 H new ATOM 843 N VAL A 56 -0.659 6.324 11.692 1.00 0.00 N ATOM 844 CA VAL A 56 -1.975 5.700 11.764 1.00 0.00 C ATOM 845 C VAL A 56 -2.222 4.798 10.561 1.00 0.00 C ATOM 846 O VAL A 56 -2.973 3.825 10.644 1.00 0.00 O ATOM 847 CB VAL A 56 -3.093 6.757 11.839 1.00 0.00 C ATOM 848 CG1 VAL A 56 -3.146 7.382 13.224 1.00 0.00 C ATOM 849 CG2 VAL A 56 -2.891 7.822 10.772 1.00 0.00 C ATOM 0 H VAL A 56 -0.675 7.314 11.446 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.992 5.099 12.673 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.047 6.265 11.653 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.942 8.126 13.257 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.342 6.607 13.965 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.192 7.861 13.444 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.690 8.561 10.839 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.930 8.312 10.925 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -2.909 7.357 9.786 1.00 0.00 H new ATOM 859 N LEU A 57 -1.586 5.127 9.442 1.00 0.00 N ATOM 860 CA LEU A 57 -1.736 4.346 8.219 1.00 0.00 C ATOM 861 C LEU A 57 -0.855 3.101 8.256 1.00 0.00 C ATOM 862 O LEU A 57 0.310 3.166 8.648 1.00 0.00 O ATOM 863 CB LEU A 57 -1.383 5.198 6.999 1.00 0.00 C ATOM 864 CG LEU A 57 -0.805 4.447 5.799 1.00 0.00 C ATOM 865 CD1 LEU A 57 -1.876 3.595 5.136 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.202 5.423 4.799 1.00 0.00 C ATOM 0 H LEU A 57 -0.962 5.929 9.356 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.777 4.030 8.145 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.282 5.722 6.675 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.664 5.957 7.307 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.014 3.787 6.155 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.446 3.068 4.284 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.261 2.871 5.854 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.690 4.235 4.794 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.205 4.871 3.952 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.974 6.108 4.449 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.596 5.990 5.279 1.00 0.00 H new ATOM 878 N GLN A 58 -1.419 1.971 7.843 1.00 0.00 N ATOM 879 CA GLN A 58 -0.683 0.712 7.828 1.00 0.00 C ATOM 880 C GLN A 58 -0.942 -0.055 6.535 1.00 0.00 C ATOM 881 O GLN A 58 -1.807 0.320 5.743 1.00 0.00 O ATOM 882 CB GLN A 58 -1.075 -0.147 9.032 1.00 0.00 C ATOM 883 CG GLN A 58 -0.993 0.592 10.358 1.00 0.00 C ATOM 884 CD GLN A 58 0.433 0.765 10.842 1.00 0.00 C ATOM 885 OE1 GLN A 58 1.281 1.305 10.131 1.00 0.00 O ATOM 886 NE2 GLN A 58 0.706 0.307 12.059 1.00 0.00 N ATOM 0 H GLN A 58 -2.382 1.901 7.515 1.00 0.00 H new ATOM 0 HA GLN A 58 0.381 0.942 7.886 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.092 -0.513 8.891 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.425 -1.021 9.072 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.458 1.572 10.253 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.564 0.047 11.109 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.027 -0.134 12.614 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.649 0.396 12.438 1.00 0.00 H new ATOM 895 N ILE A 59 -0.189 -1.130 6.329 1.00 0.00 N ATOM 896 CA ILE A 59 -0.338 -1.949 5.133 1.00 0.00 C ATOM 897 C ILE A 59 -0.537 -3.417 5.494 1.00 0.00 C ATOM 898 O ILE A 59 0.091 -3.929 6.422 1.00 0.00 O ATOM 899 CB ILE A 59 0.885 -1.821 4.206 1.00 0.00 C ATOM 900 CG1 ILE A 59 1.051 -0.372 3.744 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.743 -2.751 3.010 1.00 0.00 C ATOM 902 CD1 ILE A 59 2.270 -0.151 2.875 1.00 0.00 C ATOM 0 H ILE A 59 0.531 -1.454 6.975 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.220 -1.583 4.608 1.00 0.00 H new ATOM 0 HB ILE A 59 1.777 -2.110 4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.161 -0.071 3.191 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.116 0.275 4.619 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.615 -2.649 2.364 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.667 -3.781 3.357 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.155 -2.490 2.451 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.324 0.898 2.584 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.167 -0.420 3.432 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.197 -0.771 1.982 1.00 0.00 H new ATOM 914 N ARG A 60 -1.412 -4.090 4.754 1.00 0.00 N ATOM 915 CA ARG A 60 -1.692 -5.500 4.996 1.00 0.00 C ATOM 916 C ARG A 60 -1.447 -6.327 3.736 1.00 0.00 C ATOM 917 O ARG A 60 -1.876 -5.954 2.644 1.00 0.00 O ATOM 918 CB ARG A 60 -3.137 -5.682 5.465 1.00 0.00 C ATOM 919 CG ARG A 60 -3.334 -6.879 6.380 1.00 0.00 C ATOM 920 CD ARG A 60 -4.756 -7.413 6.301 1.00 0.00 C ATOM 921 NE ARG A 60 -5.650 -6.728 7.231 1.00 0.00 N ATOM 922 CZ ARG A 60 -6.869 -7.161 7.532 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.337 -8.271 6.978 1.00 0.00 N ATOM 924 NH2 ARG A 60 -7.623 -6.483 8.388 1.00 0.00 N ATOM 0 H ARG A 60 -1.939 -3.682 3.982 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.017 -5.850 5.777 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.457 -4.780 5.987 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.782 -5.792 4.593 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -2.633 -7.667 6.106 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.108 -6.594 7.407 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.131 -7.296 5.284 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -4.755 -8.481 6.519 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.320 -5.870 7.673 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.761 -8.794 6.319 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.273 -8.602 7.211 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -7.267 -5.628 8.816 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.559 -6.817 8.618 1.00 0.00 H new ATOM 938 N TYR A 61 -0.756 -7.450 3.897 1.00 0.00 N ATOM 939 CA TYR A 61 -0.452 -8.327 2.773 1.00 0.00 C ATOM 940 C TYR A 61 -0.320 -9.776 3.234 1.00 0.00 C ATOM 941 O TYR A 61 0.268 -10.056 4.278 1.00 0.00 O ATOM 942 CB TYR A 61 0.839 -7.880 2.085 1.00 0.00 C ATOM 943 CG TYR A 61 1.312 -8.831 1.009 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.790 -8.772 -0.277 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.283 -9.788 1.279 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.219 -9.640 -1.263 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.719 -10.659 0.299 1.00 0.00 C ATOM 948 CZ TYR A 61 2.184 -10.581 -0.970 1.00 0.00 C ATOM 949 OH TYR A 61 2.615 -11.446 -1.949 1.00 0.00 O ATOM 0 H TYR A 61 -0.396 -7.774 4.795 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.276 -8.264 2.062 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.684 -6.895 1.645 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.623 -7.774 2.835 1.00 0.00 H new ATOM 0 HD1 TYR A 61 0.036 -8.035 -0.510 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.704 -9.852 2.272 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.801 -9.582 -2.257 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.475 -11.397 0.525 1.00 0.00 H new ATOM 0 HH TYR A 61 3.297 -12.045 -1.579 1.00 0.00 H new ATOM 959 N SER A 62 -0.873 -10.693 2.445 1.00 0.00 N ATOM 960 CA SER A 62 -0.821 -12.113 2.772 1.00 0.00 C ATOM 961 C SER A 62 -1.403 -12.373 4.158 1.00 0.00 C ATOM 962 O SER A 62 -0.986 -13.297 4.855 1.00 0.00 O ATOM 963 CB SER A 62 0.621 -12.620 2.709 1.00 0.00 C ATOM 964 OG SER A 62 0.993 -12.935 1.378 1.00 0.00 O ATOM 0 H SER A 62 -1.362 -10.478 1.576 1.00 0.00 H new ATOM 0 HA SER A 62 -1.421 -12.652 2.038 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.294 -11.862 3.108 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.727 -13.504 3.338 1.00 0.00 H new ATOM 0 HG SER A 62 1.534 -12.206 1.008 1.00 0.00 H new ATOM 970 N GLY A 63 -2.371 -11.551 4.550 1.00 0.00 N ATOM 971 CA GLY A 63 -2.996 -11.707 5.851 1.00 0.00 C ATOM 972 C GLY A 63 -2.048 -11.391 6.991 1.00 0.00 C ATOM 973 O GLY A 63 -2.383 -11.588 8.159 1.00 0.00 O ATOM 0 H GLY A 63 -2.734 -10.780 3.990 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.866 -11.053 5.914 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.358 -12.730 5.956 1.00 0.00 H new ATOM 977 N LYS A 64 -0.860 -10.902 6.653 1.00 0.00 N ATOM 978 CA LYS A 64 0.140 -10.558 7.656 1.00 0.00 C ATOM 979 C LYS A 64 0.559 -9.097 7.529 1.00 0.00 C ATOM 980 O LYS A 64 0.764 -8.594 6.424 1.00 0.00 O ATOM 981 CB LYS A 64 1.366 -11.464 7.515 1.00 0.00 C ATOM 982 CG LYS A 64 2.366 -10.978 6.481 1.00 0.00 C ATOM 983 CD LYS A 64 3.605 -11.857 6.447 1.00 0.00 C ATOM 984 CE LYS A 64 3.296 -13.233 5.877 1.00 0.00 C ATOM 985 NZ LYS A 64 4.529 -13.937 5.428 1.00 0.00 N ATOM 0 H LYS A 64 -0.566 -10.735 5.691 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.304 -10.706 8.640 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.864 -11.540 8.482 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.037 -12.468 7.246 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.898 -10.969 5.497 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.653 -9.951 6.706 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.376 -11.377 5.845 1.00 0.00 H new ATOM 0 HD3 LYS A 64 4.006 -11.961 7.455 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.790 -13.834 6.633 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.609 -13.132 5.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.276 -14.871 5.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.999 -13.376 4.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.174 -14.056 6.235 1.00 0.00 H new ATOM 999 N ILE A 65 0.684 -8.421 8.666 1.00 0.00 N ATOM 1000 CA ILE A 65 1.081 -7.019 8.681 1.00 0.00 C ATOM 1001 C ILE A 65 2.561 -6.862 8.350 1.00 0.00 C ATOM 1002 O ILE A 65 3.404 -7.600 8.861 1.00 0.00 O ATOM 1003 CB ILE A 65 0.801 -6.369 10.050 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.693 -6.432 10.373 1.00 0.00 C ATOM 1005 CG2 ILE A 65 1.291 -4.929 10.062 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.562 -5.725 9.356 1.00 0.00 C ATOM 0 H ILE A 65 0.516 -8.822 9.589 1.00 0.00 H new ATOM 0 HA ILE A 65 0.486 -6.515 7.919 1.00 0.00 H new ATOM 0 HB ILE A 65 1.343 -6.923 10.817 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.999 -7.476 10.437 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.863 -5.989 11.354 1.00 0.00 H new ATOM 0 HG21 ILE A 65 1.086 -4.483 11.035 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.364 -4.908 9.872 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.774 -4.362 9.287 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.608 -5.811 9.649 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.283 -4.672 9.308 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.421 -6.182 8.377 1.00 0.00 H new ATOM 1018 N LEU A 66 2.870 -5.895 7.493 1.00 0.00 N ATOM 1019 CA LEU A 66 4.250 -5.640 7.093 1.00 0.00 C ATOM 1020 C LEU A 66 4.775 -4.361 7.738 1.00 0.00 C ATOM 1021 O LEU A 66 4.001 -3.497 8.150 1.00 0.00 O ATOM 1022 CB LEU A 66 4.350 -5.535 5.571 1.00 0.00 C ATOM 1023 CG LEU A 66 3.375 -6.403 4.773 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.622 -6.248 3.280 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.498 -7.862 5.187 1.00 0.00 C ATOM 0 H LEU A 66 2.184 -5.275 7.062 1.00 0.00 H new ATOM 0 HA LEU A 66 4.862 -6.475 7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.194 -4.494 5.288 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.365 -5.798 5.275 1.00 0.00 H new ATOM 0 HG LEU A 66 2.360 -6.069 4.989 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.919 -6.873 2.728 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.482 -5.205 2.994 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.641 -6.555 3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.797 -8.465 4.609 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.514 -8.209 5.000 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.271 -7.959 6.249 1.00 0.00 H new ATOM 1037 N LYS A 67 6.096 -4.245 7.820 1.00 0.00 N ATOM 1038 CA LYS A 67 6.726 -3.070 8.410 1.00 0.00 C ATOM 1039 C LYS A 67 7.516 -2.292 7.363 1.00 0.00 C ATOM 1040 O LYS A 67 7.908 -2.841 6.334 1.00 0.00 O ATOM 1041 CB LYS A 67 7.651 -3.485 9.558 1.00 0.00 C ATOM 1042 CG LYS A 67 6.925 -3.705 10.874 1.00 0.00 C ATOM 1043 CD LYS A 67 7.632 -4.740 11.733 1.00 0.00 C ATOM 1044 CE LYS A 67 8.677 -4.097 12.633 1.00 0.00 C ATOM 1045 NZ LYS A 67 9.770 -5.047 12.980 1.00 0.00 N ATOM 0 H LYS A 67 6.751 -4.951 7.485 1.00 0.00 H new ATOM 0 HA LYS A 67 5.939 -2.424 8.800 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.171 -4.402 9.281 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.412 -2.717 9.696 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.860 -2.762 11.417 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.903 -4.030 10.677 1.00 0.00 H new ATOM 0 HD2 LYS A 67 6.900 -5.269 12.344 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.109 -5.482 11.092 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.099 -3.225 12.134 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.200 -3.742 13.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.462 -4.571 13.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.371 -5.868 13.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.242 -5.366 12.110 1.00 0.00 H new ATOM 1059 N ASN A 68 7.748 -1.012 7.633 1.00 0.00 N ATOM 1060 CA ASN A 68 8.492 -0.159 6.714 1.00 0.00 C ATOM 1061 C ASN A 68 9.892 -0.714 6.469 1.00 0.00 C ATOM 1062 O ASN A 68 10.246 -1.058 5.343 1.00 0.00 O ATOM 1063 CB ASN A 68 8.585 1.265 7.267 1.00 0.00 C ATOM 1064 CG ASN A 68 8.859 1.288 8.759 1.00 0.00 C ATOM 1065 OD1 ASN A 68 10.003 1.161 9.193 1.00 0.00 O ATOM 1066 ND2 ASN A 68 7.805 1.451 9.551 1.00 0.00 N ATOM 0 H ASN A 68 7.431 -0.542 8.481 1.00 0.00 H new ATOM 0 HA ASN A 68 7.957 -0.138 5.764 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.377 1.803 6.746 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.653 1.793 7.063 1.00 0.00 H new ATOM 0 HD21 ASN A 68 7.927 1.475 10.563 1.00 0.00 H new ATOM 0 HD22 ASN A 68 6.874 1.552 9.147 1.00 0.00 H new ATOM 1073 N ASN A 69 10.683 -0.798 7.534 1.00 0.00 N ATOM 1074 CA ASN A 69 12.045 -1.311 7.436 1.00 0.00 C ATOM 1075 C ASN A 69 12.075 -2.629 6.668 1.00 0.00 C ATOM 1076 O ASN A 69 13.109 -3.020 6.128 1.00 0.00 O ATOM 1077 CB ASN A 69 12.640 -1.507 8.831 1.00 0.00 C ATOM 1078 CG ASN A 69 13.912 -2.333 8.807 1.00 0.00 C ATOM 1079 OD1 ASN A 69 13.913 -3.478 8.355 1.00 0.00 O ATOM 1080 ND2 ASN A 69 15.003 -1.754 9.294 1.00 0.00 N ATOM 0 H ASN A 69 10.404 -0.518 8.474 1.00 0.00 H new ATOM 0 HA ASN A 69 12.644 -0.580 6.893 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.851 -0.533 9.273 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.905 -1.995 9.471 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.888 -2.261 9.303 1.00 0.00 H new ATOM 0 HD22 ASN A 69 14.956 -0.803 9.659 1.00 0.00 H new ATOM 1087 N GLU A 70 10.933 -3.309 6.624 1.00 0.00 N ATOM 1088 CA GLU A 70 10.830 -4.583 5.923 1.00 0.00 C ATOM 1089 C GLU A 70 10.593 -4.365 4.431 1.00 0.00 C ATOM 1090 O GLU A 70 10.111 -3.312 4.014 1.00 0.00 O ATOM 1091 CB GLU A 70 9.697 -5.425 6.513 1.00 0.00 C ATOM 1092 CG GLU A 70 10.126 -6.283 7.691 1.00 0.00 C ATOM 1093 CD GLU A 70 11.058 -5.552 8.637 1.00 0.00 C ATOM 1094 OE1 GLU A 70 12.280 -5.547 8.379 1.00 0.00 O ATOM 1095 OE2 GLU A 70 10.566 -4.985 9.635 1.00 0.00 O ATOM 0 H GLU A 70 10.067 -2.999 7.065 1.00 0.00 H new ATOM 0 HA GLU A 70 11.772 -5.116 6.050 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.891 -4.763 6.831 1.00 0.00 H new ATOM 0 HB3 GLU A 70 9.291 -6.070 5.734 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.242 -6.610 8.238 1.00 0.00 H new ATOM 0 HG3 GLU A 70 10.621 -7.180 7.321 1.00 0.00 H new ATOM 1102 N THR A 71 10.937 -5.369 3.630 1.00 0.00 N ATOM 1103 CA THR A 71 10.764 -5.288 2.186 1.00 0.00 C ATOM 1104 C THR A 71 9.929 -6.453 1.666 1.00 0.00 C ATOM 1105 O THR A 71 9.635 -7.396 2.401 1.00 0.00 O ATOM 1106 CB THR A 71 12.121 -5.279 1.457 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.089 -6.015 2.215 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.612 -3.855 1.245 1.00 0.00 C ATOM 0 H THR A 71 11.337 -6.248 3.958 1.00 0.00 H new ATOM 0 HA THR A 71 10.244 -4.352 1.982 1.00 0.00 H new ATOM 0 HB THR A 71 11.988 -5.749 0.483 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.949 -6.006 1.744 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.572 -3.874 0.729 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.887 -3.306 0.644 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.729 -3.363 2.211 1.00 0.00 H new ATOM 1116 N LEU A 72 9.549 -6.381 0.395 1.00 0.00 N ATOM 1117 CA LEU A 72 8.747 -7.431 -0.224 1.00 0.00 C ATOM 1118 C LEU A 72 9.559 -8.712 -0.386 1.00 0.00 C ATOM 1119 O LEU A 72 9.037 -9.815 -0.223 1.00 0.00 O ATOM 1120 CB LEU A 72 8.228 -6.967 -1.587 1.00 0.00 C ATOM 1121 CG LEU A 72 7.151 -5.882 -1.560 1.00 0.00 C ATOM 1122 CD1 LEU A 72 5.902 -6.388 -0.856 1.00 0.00 C ATOM 1123 CD2 LEU A 72 7.676 -4.625 -0.882 1.00 0.00 C ATOM 0 H LEU A 72 9.783 -5.607 -0.227 1.00 0.00 H new ATOM 0 HA LEU A 72 7.900 -7.640 0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.073 -6.598 -2.169 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.830 -7.833 -2.116 1.00 0.00 H new ATOM 0 HG LEU A 72 6.888 -5.632 -2.588 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.146 -5.603 -0.846 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.514 -7.259 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.149 -6.666 0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.896 -3.864 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.968 -4.859 0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.541 -4.251 -1.429 1.00 0.00 H new ATOM 1135 N VAL A 73 10.840 -8.559 -0.707 1.00 0.00 N ATOM 1136 CA VAL A 73 11.725 -9.703 -0.887 1.00 0.00 C ATOM 1137 C VAL A 73 11.819 -10.532 0.389 1.00 0.00 C ATOM 1138 O VAL A 73 11.808 -11.762 0.343 1.00 0.00 O ATOM 1139 CB VAL A 73 13.140 -9.258 -1.302 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.138 -8.735 -2.730 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.671 -8.205 -0.341 1.00 0.00 C ATOM 0 H VAL A 73 11.288 -7.653 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 73 11.296 -10.313 -1.682 1.00 0.00 H new ATOM 0 HB VAL A 73 13.801 -10.123 -1.258 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.146 -8.425 -3.005 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.803 -9.522 -3.405 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.463 -7.882 -2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.672 -7.902 -0.650 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.011 -7.338 -0.350 1.00 0.00 H new ATOM 0 HG23 VAL A 73 13.712 -8.619 0.666 1.00 0.00 H new ATOM 1151 N GLN A 74 11.910 -9.850 1.526 1.00 0.00 N ATOM 1152 CA GLN A 74 12.006 -10.524 2.815 1.00 0.00 C ATOM 1153 C GLN A 74 10.733 -11.309 3.115 1.00 0.00 C ATOM 1154 O GLN A 74 10.689 -12.107 4.052 1.00 0.00 O ATOM 1155 CB GLN A 74 12.266 -9.507 3.928 1.00 0.00 C ATOM 1156 CG GLN A 74 13.712 -9.046 4.004 1.00 0.00 C ATOM 1157 CD GLN A 74 14.698 -10.172 3.764 1.00 0.00 C ATOM 1158 OE1 GLN A 74 14.855 -11.064 4.600 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.368 -10.139 2.619 1.00 0.00 N ATOM 0 H GLN A 74 11.919 -8.832 1.581 1.00 0.00 H new ATOM 0 HA GLN A 74 12.841 -11.224 2.769 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.624 -8.640 3.773 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.983 -9.947 4.884 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.878 -8.260 3.267 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.898 -8.608 4.985 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.207 -9.381 1.955 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.044 -10.871 2.403 1.00 0.00 H new ATOM 1168 N HIS A 75 9.698 -11.077 2.313 1.00 0.00 N ATOM 1169 CA HIS A 75 8.423 -11.763 2.493 1.00 0.00 C ATOM 1170 C HIS A 75 8.223 -12.828 1.418 1.00 0.00 C ATOM 1171 O HIS A 75 7.350 -13.686 1.536 1.00 0.00 O ATOM 1172 CB HIS A 75 7.270 -10.760 2.453 1.00 0.00 C ATOM 1173 CG HIS A 75 7.050 -10.050 3.753 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.507 -10.662 4.863 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.303 -8.771 4.118 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.435 -9.791 5.853 1.00 0.00 C ATOM 1177 NE2 HIS A 75 6.912 -8.636 5.427 1.00 0.00 N ATOM 0 H HIS A 75 9.717 -10.420 1.533 1.00 0.00 H new ATOM 0 HA HIS A 75 8.436 -12.252 3.467 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.467 -10.023 1.674 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.355 -11.282 2.174 1.00 0.00 H new ATOM 0 HD2 HIS A 75 7.733 -8.000 3.495 1.00 0.00 H new ATOM 0 HE1 HIS A 75 6.051 -9.990 6.843 1.00 0.00 H new ATOM 0 HE2 HIS A 75 6.979 -7.782 5.981 1.00 0.00 H new ATOM 1186 N GLY A 76 9.040 -12.766 0.371 1.00 0.00 N ATOM 1187 CA GLY A 76 8.935 -13.729 -0.709 1.00 0.00 C ATOM 1188 C GLY A 76 8.278 -13.147 -1.945 1.00 0.00 C ATOM 1189 O GLY A 76 7.199 -13.583 -2.346 1.00 0.00 O ATOM 0 H GLY A 76 9.772 -12.066 0.252 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.930 -14.091 -0.967 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.361 -14.591 -0.368 1.00 0.00 H new ATOM 1193 N VAL A 77 8.928 -12.158 -2.549 1.00 0.00 N ATOM 1194 CA VAL A 77 8.400 -11.514 -3.746 1.00 0.00 C ATOM 1195 C VAL A 77 9.505 -11.251 -4.762 1.00 0.00 C ATOM 1196 O VAL A 77 10.594 -10.798 -4.408 1.00 0.00 O ATOM 1197 CB VAL A 77 7.702 -10.183 -3.406 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.089 -9.567 -4.654 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.646 -10.395 -2.332 1.00 0.00 C ATOM 0 H VAL A 77 9.822 -11.785 -2.229 1.00 0.00 H new ATOM 0 HA VAL A 77 7.670 -12.199 -4.178 1.00 0.00 H new ATOM 0 HB VAL A 77 8.448 -9.490 -3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.601 -8.628 -4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 77 7.872 -9.378 -5.388 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.355 -10.253 -5.075 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.163 -9.445 -2.104 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.900 -11.104 -2.690 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.117 -10.788 -1.431 1.00 0.00 H new ATOM 1209 N LYS A 78 9.218 -11.536 -6.027 1.00 0.00 N ATOM 1210 CA LYS A 78 10.187 -11.329 -7.097 1.00 0.00 C ATOM 1211 C LYS A 78 9.815 -10.113 -7.939 1.00 0.00 C ATOM 1212 O LYS A 78 8.657 -9.701 -8.001 1.00 0.00 O ATOM 1213 CB LYS A 78 10.269 -12.572 -7.987 1.00 0.00 C ATOM 1214 CG LYS A 78 9.328 -12.531 -9.178 1.00 0.00 C ATOM 1215 CD LYS A 78 8.865 -13.923 -9.572 1.00 0.00 C ATOM 1216 CE LYS A 78 9.972 -14.705 -10.262 1.00 0.00 C ATOM 1217 NZ LYS A 78 9.458 -15.949 -10.899 1.00 0.00 N ATOM 0 H LYS A 78 8.322 -11.911 -6.337 1.00 0.00 H new ATOM 0 HA LYS A 78 11.161 -11.151 -6.642 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.292 -12.684 -8.347 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.044 -13.454 -7.387 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.463 -11.913 -8.938 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.830 -12.061 -10.023 1.00 0.00 H new ATOM 0 HD2 LYS A 78 8.536 -14.463 -8.684 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.004 -13.847 -10.236 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.443 -14.077 -11.019 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.743 -14.961 -9.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.243 -16.454 -11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.031 -16.560 -10.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.740 -15.704 -11.611 1.00 0.00 H new ATOM 1231 N PRO A 79 10.820 -9.524 -8.605 1.00 0.00 N ATOM 1232 CA PRO A 79 10.623 -8.347 -9.457 1.00 0.00 C ATOM 1233 C PRO A 79 9.843 -8.675 -10.726 1.00 0.00 C ATOM 1234 O PRO A 79 10.045 -9.725 -11.335 1.00 0.00 O ATOM 1235 CB PRO A 79 12.050 -7.916 -9.803 1.00 0.00 C ATOM 1236 CG PRO A 79 12.862 -9.159 -9.679 1.00 0.00 C ATOM 1237 CD PRO A 79 12.226 -9.961 -8.578 1.00 0.00 C ATOM 0 HA PRO A 79 10.040 -7.574 -8.956 1.00 0.00 H new ATOM 0 HB2 PRO A 79 12.106 -7.506 -10.811 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.405 -7.142 -9.123 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.867 -9.717 -10.615 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.900 -8.925 -9.442 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.317 -11.032 -8.757 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.691 -9.758 -7.613 1.00 0.00 H new ATOM 1245 N GLN A 80 8.953 -7.769 -11.119 1.00 0.00 N ATOM 1246 CA GLN A 80 8.143 -7.964 -12.316 1.00 0.00 C ATOM 1247 C GLN A 80 7.054 -9.003 -12.074 1.00 0.00 C ATOM 1248 O GLN A 80 6.825 -9.881 -12.905 1.00 0.00 O ATOM 1249 CB GLN A 80 9.025 -8.395 -13.489 1.00 0.00 C ATOM 1250 CG GLN A 80 10.336 -7.631 -13.578 1.00 0.00 C ATOM 1251 CD GLN A 80 11.424 -8.418 -14.282 1.00 0.00 C ATOM 1252 OE1 GLN A 80 11.302 -8.749 -15.462 1.00 0.00 O ATOM 1253 NE2 GLN A 80 12.496 -8.722 -13.560 1.00 0.00 N ATOM 0 H GLN A 80 8.775 -6.894 -10.627 1.00 0.00 H new ATOM 0 HA GLN A 80 7.665 -7.015 -12.559 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.240 -9.460 -13.399 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.471 -8.259 -14.418 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.170 -6.693 -14.108 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.671 -7.374 -12.573 1.00 0.00 H new ATOM 0 HE21 GLN A 80 12.555 -8.427 -12.585 1.00 0.00 H new ATOM 0 HE22 GLN A 80 13.261 -9.250 -13.980 1.00 0.00 H new ATOM 1262 N GLU A 81 6.386 -8.898 -10.929 1.00 0.00 N ATOM 1263 CA GLU A 81 5.322 -9.830 -10.578 1.00 0.00 C ATOM 1264 C GLU A 81 4.042 -9.083 -10.214 1.00 0.00 C ATOM 1265 O GLU A 81 4.052 -7.865 -10.034 1.00 0.00 O ATOM 1266 CB GLU A 81 5.756 -10.718 -9.410 1.00 0.00 C ATOM 1267 CG GLU A 81 5.417 -10.140 -8.046 1.00 0.00 C ATOM 1268 CD GLU A 81 5.695 -11.110 -6.915 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.698 -11.849 -6.999 1.00 0.00 O ATOM 1270 OE2 GLU A 81 4.908 -11.131 -5.945 1.00 0.00 O ATOM 0 H GLU A 81 6.563 -8.177 -10.230 1.00 0.00 H new ATOM 0 HA GLU A 81 5.122 -10.457 -11.447 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.280 -11.694 -9.510 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.832 -10.881 -9.469 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.994 -9.229 -7.888 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.364 -9.858 -8.027 1.00 0.00 H new ATOM 1277 N ILE A 82 2.942 -9.822 -10.109 1.00 0.00 N ATOM 1278 CA ILE A 82 1.655 -9.230 -9.767 1.00 0.00 C ATOM 1279 C ILE A 82 1.208 -9.655 -8.373 1.00 0.00 C ATOM 1280 O ILE A 82 1.229 -10.839 -8.036 1.00 0.00 O ATOM 1281 CB ILE A 82 0.567 -9.622 -10.785 1.00 0.00 C ATOM 1282 CG1 ILE A 82 0.933 -9.107 -12.178 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.785 -9.076 -10.351 1.00 0.00 C ATOM 1284 CD1 ILE A 82 0.028 -9.630 -13.272 1.00 0.00 C ATOM 0 H ILE A 82 2.917 -10.831 -10.256 1.00 0.00 H new ATOM 0 HA ILE A 82 1.789 -8.148 -9.789 1.00 0.00 H new ATOM 0 HB ILE A 82 0.502 -10.709 -10.825 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.895 -8.018 -12.176 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.962 -9.389 -12.402 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.544 -9.361 -11.080 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.047 -9.486 -9.376 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.735 -7.989 -10.286 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.346 -9.224 -14.232 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.084 -10.718 -13.302 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.999 -9.325 -13.071 1.00 0.00 H new ATOM 1296 N VAL A 83 0.800 -8.681 -7.565 1.00 0.00 N ATOM 1297 CA VAL A 83 0.344 -8.953 -6.207 1.00 0.00 C ATOM 1298 C VAL A 83 -0.844 -8.072 -5.839 1.00 0.00 C ATOM 1299 O VAL A 83 -1.331 -7.296 -6.661 1.00 0.00 O ATOM 1300 CB VAL A 83 1.472 -8.731 -5.182 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.790 -9.275 -5.710 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.595 -7.254 -4.837 1.00 0.00 C ATOM 0 H VAL A 83 0.776 -7.696 -7.828 1.00 0.00 H new ATOM 0 HA VAL A 83 0.038 -9.999 -6.179 1.00 0.00 H new ATOM 0 HB VAL A 83 1.222 -9.274 -4.271 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.574 -9.109 -4.972 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.692 -10.344 -5.901 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.050 -8.763 -6.637 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.397 -7.115 -4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.821 -6.687 -5.740 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.656 -6.900 -4.412 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.305 -8.198 -4.599 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.437 -7.412 -4.122 1.00 0.00 C ATOM 1314 C GLN A 84 -2.284 -7.080 -2.641 1.00 0.00 C ATOM 1315 O GLN A 84 -2.241 -7.973 -1.795 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.745 -8.170 -4.354 1.00 0.00 C ATOM 1317 CG GLN A 84 -4.970 -7.447 -3.820 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.258 -8.195 -4.102 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.379 -8.888 -5.113 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.231 -8.058 -3.209 1.00 0.00 N ATOM 0 H GLN A 84 -0.913 -8.836 -3.907 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.461 -6.479 -4.684 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.872 -8.341 -5.423 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.676 -9.149 -3.881 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.864 -7.306 -2.744 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.025 -6.455 -4.267 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.088 -7.474 -2.385 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.121 -8.537 -3.347 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.201 -5.789 -2.335 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.053 -5.338 -0.956 1.00 0.00 C ATOM 1331 C VAL A 85 -3.167 -4.371 -0.572 1.00 0.00 C ATOM 1332 O VAL A 85 -3.618 -3.572 -1.391 1.00 0.00 O ATOM 1333 CB VAL A 85 -0.693 -4.651 -0.733 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.439 -5.523 -1.256 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -0.672 -3.282 -1.397 1.00 0.00 C ATOM 0 H VAL A 85 -2.234 -5.037 -3.023 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.111 -6.225 -0.325 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.548 -4.513 0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.392 -5.021 -1.090 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.435 -6.478 -0.730 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.302 -5.696 -2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.297 -2.811 -1.229 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.840 -3.394 -2.468 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.457 -2.658 -0.970 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.606 -4.451 0.680 1.00 0.00 N ATOM 1346 CA GLU A 86 -4.669 -3.583 1.173 1.00 0.00 C ATOM 1347 C GLU A 86 -4.099 -2.463 2.039 1.00 0.00 C ATOM 1348 O GLU A 86 -2.985 -2.568 2.553 1.00 0.00 O ATOM 1349 CB GLU A 86 -5.690 -4.393 1.975 1.00 0.00 C ATOM 1350 CG GLU A 86 -6.784 -5.010 1.120 1.00 0.00 C ATOM 1351 CD GLU A 86 -7.976 -4.090 0.945 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -7.831 -2.876 1.201 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -9.054 -4.582 0.552 1.00 0.00 O ATOM 0 H GLU A 86 -3.242 -5.107 1.371 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.166 -3.137 0.312 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.170 -5.186 2.513 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.147 -3.746 2.724 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -6.377 -5.261 0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.114 -5.943 1.577 1.00 0.00 H new ATOM 1360 N ILE A 87 -4.871 -1.393 2.196 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.444 -0.255 3.000 1.00 0.00 C ATOM 1362 C ILE A 87 -5.584 0.264 3.869 1.00 0.00 C ATOM 1363 O ILE A 87 -6.735 0.317 3.435 1.00 0.00 O ATOM 1364 CB ILE A 87 -3.924 0.895 2.116 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.543 0.551 1.555 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -3.871 2.191 2.911 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -1.928 1.665 0.737 1.00 0.00 C ATOM 0 H ILE A 87 -5.795 -1.291 1.777 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.634 -0.607 3.639 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.611 1.032 1.281 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.875 0.306 2.381 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.624 -0.342 0.935 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.502 2.994 2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.871 2.441 3.267 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.203 2.068 3.763 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.950 1.351 0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.575 1.895 -0.109 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.815 2.553 1.359 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.257 0.646 5.099 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.253 1.162 6.030 1.00 0.00 C ATOM 1381 C PHE A 88 -5.589 1.943 7.160 1.00 0.00 C ATOM 1382 O PHE A 88 -4.370 1.903 7.324 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.084 0.014 6.608 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.308 -0.883 7.529 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -5.989 -0.470 8.813 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -5.899 -2.139 7.112 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.275 -1.293 9.663 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.184 -2.967 7.958 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.873 -2.544 9.235 1.00 0.00 C ATOM 0 H PHE A 88 -4.309 0.608 5.474 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.910 1.838 5.483 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.935 0.428 7.149 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.487 -0.581 5.788 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.302 0.506 9.153 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.141 -2.476 6.115 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.031 -0.959 10.661 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.869 -3.943 7.620 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.317 -3.190 9.898 1.00 0.00 H new ATOM 1399 N SER A 89 -6.401 2.652 7.938 1.00 0.00 N ATOM 1400 CA SER A 89 -5.893 3.446 9.051 1.00 0.00 C ATOM 1401 C SER A 89 -6.492 2.976 10.372 1.00 0.00 C ATOM 1402 O SER A 89 -7.704 2.795 10.489 1.00 0.00 O ATOM 1403 CB SER A 89 -6.208 4.928 8.834 1.00 0.00 C ATOM 1404 OG SER A 89 -5.629 5.727 9.850 1.00 0.00 O ATOM 0 H SER A 89 -7.413 2.693 7.818 1.00 0.00 H new ATOM 0 HA SER A 89 -4.812 3.314 9.095 1.00 0.00 H new ATOM 0 HB2 SER A 89 -5.833 5.244 7.861 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.288 5.075 8.822 1.00 0.00 H new ATOM 0 HG SER A 89 -6.033 6.620 9.834 1.00 0.00 H new ATOM 1410 N THR A 90 -5.632 2.778 11.367 1.00 0.00 N ATOM 1411 CA THR A 90 -6.074 2.327 12.681 1.00 0.00 C ATOM 1412 C THR A 90 -7.022 3.336 13.318 1.00 0.00 C ATOM 1413 O THR A 90 -7.887 2.972 14.114 1.00 0.00 O ATOM 1414 CB THR A 90 -4.880 2.093 13.626 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.191 3.327 13.858 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.918 1.071 13.039 1.00 0.00 C ATOM 0 H THR A 90 -4.625 2.923 11.287 1.00 0.00 H new ATOM 0 HA THR A 90 -6.599 1.384 12.531 1.00 0.00 H new ATOM 0 HB THR A 90 -5.262 1.707 14.571 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.434 3.171 14.461 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.083 0.922 13.724 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.438 0.125 12.890 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.542 1.433 12.082 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.854 4.606 12.963 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.696 5.668 13.501 1.00 0.00 C ATOM 1426 C ASN A 91 -8.386 6.436 12.378 1.00 0.00 C ATOM 1427 O ASN A 91 -7.943 7.506 11.961 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.861 6.627 14.352 1.00 0.00 C ATOM 1429 CG ASN A 91 -6.777 6.191 15.802 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -6.131 5.193 16.125 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.431 6.938 16.683 1.00 0.00 N ATOM 0 H ASN A 91 -6.142 4.924 12.305 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.461 5.209 14.127 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.855 6.695 13.937 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -7.295 7.626 14.300 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.411 6.694 17.673 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.953 7.756 16.370 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.499 5.879 11.877 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.276 6.495 10.797 1.00 0.00 C ATOM 1440 C PRO A 92 -10.996 7.760 11.250 1.00 0.00 C ATOM 1441 O PRO A 92 -11.244 8.664 10.451 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.287 5.408 10.424 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.430 4.584 11.657 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.085 4.605 12.328 1.00 0.00 C ATOM 0 HA PRO A 92 -9.643 6.810 9.968 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.241 5.841 10.124 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.932 4.808 9.586 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.199 4.993 12.312 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.728 3.564 11.413 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.177 4.567 13.413 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.474 3.753 12.030 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.328 7.819 12.535 1.00 0.00 N ATOM 1453 CA ASP A 93 -12.018 8.975 13.094 1.00 0.00 C ATOM 1454 C ASP A 93 -11.098 10.191 13.133 1.00 0.00 C ATOM 1455 O ASP A 93 -11.478 11.285 12.713 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.528 8.660 14.501 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.803 7.840 14.485 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -14.858 8.390 14.105 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -13.746 6.648 14.853 1.00 0.00 O ATOM 0 H ASP A 93 -11.130 7.079 13.209 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.868 9.206 12.451 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.758 8.118 15.050 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.706 9.592 15.037 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.886 9.994 13.642 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.911 11.074 13.737 1.00 0.00 C ATOM 1466 C LEU A 94 -8.236 11.319 12.391 1.00 0.00 C ATOM 1467 O LEU A 94 -8.079 12.463 11.963 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.858 10.745 14.796 1.00 0.00 C ATOM 1469 CG LEU A 94 -8.228 11.087 16.240 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -7.225 10.476 17.207 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -8.303 12.595 16.428 1.00 0.00 C ATOM 0 H LEU A 94 -9.556 9.096 13.995 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.439 11.982 14.028 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.638 9.679 14.741 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.939 11.274 14.543 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.210 10.665 16.453 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.504 10.730 18.230 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.221 9.392 17.090 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.230 10.868 16.995 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.567 12.820 17.461 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.335 13.039 16.196 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.060 13.008 15.762 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.842 10.238 11.728 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.184 10.335 10.430 1.00 0.00 C ATOM 1485 C TYR A 95 -7.773 9.331 9.444 1.00 0.00 C ATOM 1486 O TYR A 95 -7.231 8.248 9.224 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.680 10.099 10.579 1.00 0.00 C ATOM 1488 CG TYR A 95 -5.024 10.999 11.601 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -5.108 10.719 12.959 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.318 12.130 11.209 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.511 11.539 13.897 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.716 12.955 12.140 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.816 12.656 13.482 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.219 13.474 14.413 1.00 0.00 O ATOM 0 H TYR A 95 -7.967 9.284 12.068 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.351 11.339 10.040 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.510 9.060 10.860 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.200 10.250 9.612 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.650 9.844 13.288 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.238 12.368 10.159 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.588 11.307 14.949 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.170 13.829 11.818 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.769 14.215 13.956 1.00 0.00 H new ATOM 1504 N PRO A 96 -8.910 9.698 8.836 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.598 8.845 7.862 1.00 0.00 C ATOM 1506 C PRO A 96 -8.824 8.718 6.554 1.00 0.00 C ATOM 1507 O PRO A 96 -7.934 9.518 6.268 1.00 0.00 O ATOM 1508 CB PRO A 96 -10.925 9.571 7.629 1.00 0.00 C ATOM 1509 CG PRO A 96 -10.638 10.997 7.952 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.612 10.975 9.051 1.00 0.00 C ATOM 0 HA PRO A 96 -9.713 7.824 8.225 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.262 9.459 6.599 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.713 9.171 8.268 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.261 11.527 7.077 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.542 11.514 8.273 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.932 11.824 8.983 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.077 11.017 10.036 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.170 7.706 5.764 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.508 7.475 4.485 1.00 0.00 C ATOM 1520 C VAL A 97 -9.380 7.939 3.323 1.00 0.00 C ATOM 1521 O VAL A 97 -10.559 7.591 3.242 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.164 5.986 4.292 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.433 5.773 2.975 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.335 5.476 5.461 1.00 0.00 C ATOM 0 H VAL A 97 -9.904 7.034 5.987 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.585 8.055 4.497 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.093 5.417 4.260 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.198 4.715 2.856 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.067 6.099 2.150 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.509 6.352 2.974 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.101 4.422 5.309 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.409 6.048 5.527 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.900 5.592 6.386 1.00 0.00 H new ATOM 1534 N ARG A 98 -8.794 8.724 2.427 1.00 0.00 N ATOM 1535 CA ARG A 98 -9.517 9.236 1.269 1.00 0.00 C ATOM 1536 C ARG A 98 -8.977 8.629 -0.022 1.00 0.00 C ATOM 1537 O ARG A 98 -7.847 8.142 -0.066 1.00 0.00 O ATOM 1538 CB ARG A 98 -9.414 10.761 1.210 1.00 0.00 C ATOM 1539 CG ARG A 98 -10.067 11.462 2.391 1.00 0.00 C ATOM 1540 CD ARG A 98 -11.549 11.701 2.147 1.00 0.00 C ATOM 1541 NE ARG A 98 -11.781 12.574 1.000 1.00 0.00 N ATOM 1542 CZ ARG A 98 -11.534 13.879 1.008 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -11.048 14.459 2.097 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -11.771 14.608 -0.075 1.00 0.00 N ATOM 0 H ARG A 98 -7.819 9.020 2.480 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.564 8.953 1.373 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.362 11.044 1.166 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -9.877 11.113 0.288 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.938 10.859 3.290 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -9.569 12.414 2.571 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -12.048 10.746 1.982 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -11.996 12.145 3.037 1.00 0.00 H new ATOM 0 HE ARG A 98 -12.153 12.159 0.146 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -10.863 13.903 2.932 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -10.859 15.461 2.100 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.144 14.166 -0.916 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -11.581 15.610 -0.067 1.00 0.00 H new ATOM 1558 N ARG A 99 -9.792 8.660 -1.071 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.397 8.111 -2.363 1.00 0.00 C ATOM 1560 C ARG A 99 -8.311 8.968 -3.008 1.00 0.00 C ATOM 1561 O ARG A 99 -8.166 10.148 -2.688 1.00 0.00 O ATOM 1562 CB ARG A 99 -10.608 8.018 -3.293 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.247 9.363 -3.598 1.00 0.00 C ATOM 1564 CD ARG A 99 -12.735 9.221 -3.878 1.00 0.00 C ATOM 1565 NE ARG A 99 -13.229 10.278 -4.757 1.00 0.00 N ATOM 1566 CZ ARG A 99 -14.508 10.420 -5.088 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -15.416 9.579 -4.615 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -14.880 11.407 -5.893 1.00 0.00 N ATOM 0 H ARG A 99 -10.730 9.060 -1.052 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.997 7.111 -2.198 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -10.302 7.550 -4.229 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.354 7.365 -2.840 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.097 10.038 -2.755 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -10.755 9.814 -4.460 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.927 8.250 -4.335 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.285 9.245 -2.937 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.556 10.943 -5.137 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -15.134 8.820 -3.995 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -16.397 9.691 -4.871 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -14.184 12.057 -6.258 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.862 11.516 -6.147 1.00 0.00 H new ATOM 1582 N ILE A 100 -7.551 8.365 -3.916 1.00 0.00 N ATOM 1583 CA ILE A 100 -6.480 9.072 -4.606 1.00 0.00 C ATOM 1584 C ILE A 100 -6.958 9.624 -5.945 1.00 0.00 C ATOM 1585 O ILE A 100 -7.331 8.867 -6.842 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.264 8.157 -4.845 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -4.656 7.721 -3.510 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.226 8.869 -5.699 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.433 8.865 -2.546 1.00 0.00 C ATOM 0 H ILE A 100 -7.657 7.388 -4.191 1.00 0.00 H new ATOM 0 HA ILE A 100 -6.181 9.899 -3.961 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.597 7.267 -5.379 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.312 6.986 -3.044 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -3.704 7.224 -3.698 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.373 8.210 -5.859 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.666 9.134 -6.661 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -3.895 9.774 -5.190 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.000 8.483 -1.622 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.753 9.590 -2.993 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.386 9.348 -2.328 1.00 0.00 H new ATOM 1601 N ASP A 101 -6.942 10.946 -6.073 1.00 0.00 N ATOM 1602 CA ASP A 101 -7.371 11.599 -7.304 1.00 0.00 C ATOM 1603 C ASP A 101 -6.578 11.082 -8.500 1.00 0.00 C ATOM 1604 O ASP A 101 -5.365 10.891 -8.417 1.00 0.00 O ATOM 1605 CB ASP A 101 -7.207 13.115 -7.185 1.00 0.00 C ATOM 1606 CG ASP A 101 -8.278 13.747 -6.318 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -9.441 13.298 -6.390 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -7.953 14.692 -5.567 1.00 0.00 O ATOM 0 H ASP A 101 -6.637 11.586 -5.340 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.424 11.365 -7.462 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.226 13.340 -6.767 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -7.239 13.560 -8.179 1.00 0.00 H new ATOM 1613 N GLY A 102 -7.272 10.854 -9.611 1.00 0.00 N ATOM 1614 CA GLY A 102 -6.616 10.359 -10.807 1.00 0.00 C ATOM 1615 C GLY A 102 -7.526 9.485 -11.647 1.00 0.00 C ATOM 1616 O GLY A 102 -8.263 8.652 -11.117 1.00 0.00 O ATOM 0 H GLY A 102 -8.277 11.003 -9.704 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.274 11.203 -11.406 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.731 9.790 -10.523 1.00 0.00 H new ATOM 1620 N LEU A 103 -7.477 9.674 -12.961 1.00 0.00 N ATOM 1621 CA LEU A 103 -8.304 8.897 -13.877 1.00 0.00 C ATOM 1622 C LEU A 103 -7.970 7.412 -13.786 1.00 0.00 C ATOM 1623 O LEU A 103 -6.810 7.016 -13.902 1.00 0.00 O ATOM 1624 CB LEU A 103 -8.109 9.388 -15.313 1.00 0.00 C ATOM 1625 CG LEU A 103 -8.947 8.686 -16.382 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -10.381 9.193 -16.354 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -8.335 8.891 -17.760 1.00 0.00 C ATOM 0 H LEU A 103 -6.873 10.359 -13.416 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.347 9.034 -13.591 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -8.335 10.454 -15.345 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -7.057 9.277 -15.574 1.00 0.00 H new ATOM 0 HG LEU A 103 -8.956 7.618 -16.165 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.963 8.682 -17.122 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -10.818 8.994 -15.375 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.391 10.266 -16.545 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.945 8.384 -18.508 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.295 9.957 -17.986 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -7.326 8.479 -17.775 1.00 0.00 H new ATOM 1639 N THR A 104 -8.996 6.592 -13.579 1.00 0.00 N ATOM 1640 CA THR A 104 -8.813 5.150 -13.473 1.00 0.00 C ATOM 1641 C THR A 104 -9.679 4.409 -14.485 1.00 0.00 C ATOM 1642 O THR A 104 -10.688 4.936 -14.956 1.00 0.00 O ATOM 1643 CB THR A 104 -9.149 4.643 -12.058 1.00 0.00 C ATOM 1644 OG1 THR A 104 -10.313 5.313 -11.562 1.00 0.00 O ATOM 1645 CG2 THR A 104 -7.982 4.873 -11.109 1.00 0.00 C ATOM 0 H THR A 104 -9.963 6.903 -13.481 1.00 0.00 H new ATOM 0 HA THR A 104 -7.762 4.949 -13.683 1.00 0.00 H new ATOM 0 HB THR A 104 -9.343 3.572 -12.116 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.521 4.984 -10.663 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.243 4.507 -10.116 1.00 0.00 H new ATOM 0 HG22 THR A 104 -7.105 4.338 -11.474 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.761 5.939 -11.056 1.00 0.00 H new ATOM 1653 N ASP A 105 -9.281 3.186 -14.815 1.00 0.00 N ATOM 1654 CA ASP A 105 -10.023 2.372 -15.771 1.00 0.00 C ATOM 1655 C ASP A 105 -10.731 1.218 -15.068 1.00 0.00 C ATOM 1656 O ASP A 105 -10.423 0.050 -15.306 1.00 0.00 O ATOM 1657 CB ASP A 105 -9.084 1.829 -16.849 1.00 0.00 C ATOM 1658 CG ASP A 105 -7.847 1.176 -16.264 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -6.951 1.911 -15.798 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -7.776 -0.071 -16.272 1.00 0.00 O ATOM 0 H ASP A 105 -8.448 2.736 -14.435 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.776 3.005 -16.241 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -9.619 1.103 -17.461 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.784 2.643 -17.509 1.00 0.00 H new ATOM 1665 N VAL A 106 -11.679 1.553 -14.199 1.00 0.00 N ATOM 1666 CA VAL A 106 -12.431 0.545 -13.461 1.00 0.00 C ATOM 1667 C VAL A 106 -13.830 0.369 -14.040 1.00 0.00 C ATOM 1668 O VAL A 106 -14.339 1.246 -14.738 1.00 0.00 O ATOM 1669 CB VAL A 106 -12.547 0.912 -11.969 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -11.177 0.900 -11.308 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -13.215 2.269 -11.805 1.00 0.00 C ATOM 0 H VAL A 106 -11.945 2.515 -13.989 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.882 -0.392 -13.556 1.00 0.00 H new ATOM 0 HB VAL A 106 -13.168 0.164 -11.476 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -11.279 1.162 -10.255 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.740 -0.095 -11.394 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -10.529 1.625 -11.801 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -13.289 2.512 -10.745 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -12.622 3.030 -12.312 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -14.214 2.238 -12.241 1.00 0.00 H new ATOM 1681 N SER A 107 -14.448 -0.770 -13.744 1.00 0.00 N ATOM 1682 CA SER A 107 -15.789 -1.063 -14.238 1.00 0.00 C ATOM 1683 C SER A 107 -16.503 -2.049 -13.319 1.00 0.00 C ATOM 1684 O SER A 107 -15.932 -3.062 -12.916 1.00 0.00 O ATOM 1685 CB SER A 107 -15.719 -1.629 -15.657 1.00 0.00 C ATOM 1686 OG SER A 107 -15.504 -0.599 -16.607 1.00 0.00 O ATOM 0 H SER A 107 -14.042 -1.505 -13.165 1.00 0.00 H new ATOM 0 HA SER A 107 -16.356 -0.132 -14.253 1.00 0.00 H new ATOM 0 HB2 SER A 107 -14.914 -2.361 -15.721 1.00 0.00 H new ATOM 0 HB3 SER A 107 -16.646 -2.154 -15.889 1.00 0.00 H new ATOM 0 HG SER A 107 -15.213 0.215 -16.146 1.00 0.00 H new ATOM 1692 N GLN A 108 -17.754 -1.745 -12.992 1.00 0.00 N ATOM 1693 CA GLN A 108 -18.547 -2.604 -12.120 1.00 0.00 C ATOM 1694 C GLN A 108 -19.737 -3.192 -12.871 1.00 0.00 C ATOM 1695 O GLN A 108 -20.791 -2.564 -12.973 1.00 0.00 O ATOM 1696 CB GLN A 108 -19.035 -1.818 -10.902 1.00 0.00 C ATOM 1697 CG GLN A 108 -19.365 -0.366 -11.207 1.00 0.00 C ATOM 1698 CD GLN A 108 -18.126 0.496 -11.350 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -17.131 0.293 -10.655 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -18.182 1.466 -12.256 1.00 0.00 N ATOM 0 H GLN A 108 -18.241 -0.910 -13.318 1.00 0.00 H new ATOM 0 HA GLN A 108 -17.912 -3.424 -11.784 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -19.921 -2.306 -10.497 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -18.269 -1.853 -10.127 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -19.947 -0.315 -12.127 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -19.992 0.035 -10.411 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -19.028 1.598 -12.810 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -17.379 2.079 -12.397 1.00 0.00 H new ATOM 1709 N ILE A 109 -19.561 -4.401 -13.395 1.00 0.00 N ATOM 1710 CA ILE A 109 -20.621 -5.073 -14.135 1.00 0.00 C ATOM 1711 C ILE A 109 -21.057 -6.353 -13.430 1.00 0.00 C ATOM 1712 O ILE A 109 -21.323 -7.368 -14.074 1.00 0.00 O ATOM 1713 CB ILE A 109 -20.175 -5.417 -15.569 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -18.977 -6.368 -15.540 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -19.832 -4.148 -16.335 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -18.877 -7.251 -16.764 1.00 0.00 C ATOM 0 H ILE A 109 -18.695 -4.934 -13.320 1.00 0.00 H new ATOM 0 HA ILE A 109 -21.462 -4.381 -14.180 1.00 0.00 H new ATOM 0 HB ILE A 109 -20.998 -5.916 -16.080 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -18.062 -5.784 -15.448 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -19.044 -6.997 -14.652 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -19.519 -4.407 -17.346 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -20.709 -3.502 -16.381 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -19.022 -3.624 -15.827 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -18.005 -7.899 -16.675 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -19.776 -7.862 -16.846 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -18.778 -6.629 -17.654 1.00 0.00 H new ATOM 1728 N ILE A 110 -21.129 -6.297 -12.105 1.00 0.00 N ATOM 1729 CA ILE A 110 -21.536 -7.450 -11.312 1.00 0.00 C ATOM 1730 C ILE A 110 -21.927 -7.036 -9.898 1.00 0.00 C ATOM 1731 O ILE A 110 -21.550 -5.962 -9.427 1.00 0.00 O ATOM 1732 CB ILE A 110 -20.416 -8.504 -11.235 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -20.938 -9.789 -10.590 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -19.228 -7.958 -10.456 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -20.205 -11.033 -11.042 1.00 0.00 C ATOM 0 H ILE A 110 -20.911 -5.465 -11.557 1.00 0.00 H new ATOM 0 HA ILE A 110 -22.401 -7.886 -11.812 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.086 -8.737 -12.247 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -20.855 -9.702 -9.507 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -21.998 -9.897 -10.821 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -18.444 -8.714 -10.410 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -18.844 -7.068 -10.954 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -19.543 -7.700 -9.445 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -20.628 -11.906 -10.544 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.309 -11.145 -12.121 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -19.149 -10.946 -10.786 1.00 0.00 H new ATOM 1747 N THR A 111 -22.685 -7.895 -9.223 1.00 0.00 N ATOM 1748 CA THR A 111 -23.126 -7.619 -7.862 1.00 0.00 C ATOM 1749 C THR A 111 -22.114 -8.126 -6.842 1.00 0.00 C ATOM 1750 O THR A 111 -22.467 -8.839 -5.903 1.00 0.00 O ATOM 1751 CB THR A 111 -24.495 -8.264 -7.574 1.00 0.00 C ATOM 1752 OG1 THR A 111 -24.955 -7.878 -6.274 1.00 0.00 O ATOM 1753 CG2 THR A 111 -24.407 -9.780 -7.657 1.00 0.00 C ATOM 0 H THR A 111 -23.006 -8.788 -9.597 1.00 0.00 H new ATOM 0 HA THR A 111 -23.216 -6.536 -7.773 1.00 0.00 H new ATOM 0 HB THR A 111 -25.202 -7.915 -8.327 1.00 0.00 H new ATOM 0 HG1 THR A 111 -24.305 -8.165 -5.599 1.00 0.00 H new ATOM 0 HG21 THR A 111 -25.386 -10.213 -7.450 1.00 0.00 H new ATOM 0 HG22 THR A 111 -24.085 -10.072 -8.657 1.00 0.00 H new ATOM 0 HG23 THR A 111 -23.687 -10.143 -6.924 1.00 0.00 H new ATOM 1761 N VAL A 112 -20.852 -7.754 -7.032 1.00 0.00 N ATOM 1762 CA VAL A 112 -19.787 -8.170 -6.127 1.00 0.00 C ATOM 1763 C VAL A 112 -20.153 -7.876 -4.676 1.00 0.00 C ATOM 1764 O VAL A 112 -20.512 -6.750 -4.332 1.00 0.00 O ATOM 1765 CB VAL A 112 -18.458 -7.468 -6.462 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -18.604 -5.959 -6.331 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -17.342 -7.984 -5.567 1.00 0.00 C ATOM 0 H VAL A 112 -20.542 -7.165 -7.805 1.00 0.00 H new ATOM 0 HA VAL A 112 -19.663 -9.245 -6.257 1.00 0.00 H new ATOM 0 HB VAL A 112 -18.197 -7.696 -7.496 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -17.655 -5.479 -6.571 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -19.373 -5.607 -7.018 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -18.889 -5.708 -5.309 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -16.410 -7.477 -5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -17.592 -7.789 -4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -17.223 -9.057 -5.716 1.00 0.00 H new ATOM 1777 N SER A 113 -20.058 -8.895 -3.829 1.00 0.00 N ATOM 1778 CA SER A 113 -20.383 -8.747 -2.415 1.00 0.00 C ATOM 1779 C SER A 113 -19.129 -8.873 -1.554 1.00 0.00 C ATOM 1780 O SER A 113 -18.106 -9.391 -2.000 1.00 0.00 O ATOM 1781 CB SER A 113 -21.412 -9.797 -1.993 1.00 0.00 C ATOM 1782 OG SER A 113 -21.869 -9.562 -0.672 1.00 0.00 O ATOM 0 H SER A 113 -19.759 -9.833 -4.097 1.00 0.00 H new ATOM 0 HA SER A 113 -20.807 -7.754 -2.267 1.00 0.00 H new ATOM 0 HB2 SER A 113 -22.257 -9.780 -2.682 1.00 0.00 H new ATOM 0 HB3 SER A 113 -20.969 -10.791 -2.056 1.00 0.00 H new ATOM 0 HG SER A 113 -22.527 -10.246 -0.427 1.00 0.00 H new ATOM 1788 N GLY A 114 -19.218 -8.395 -0.317 1.00 0.00 N ATOM 1789 CA GLY A 114 -18.085 -8.463 0.588 1.00 0.00 C ATOM 1790 C GLY A 114 -18.199 -7.477 1.734 1.00 0.00 C ATOM 1791 O GLY A 114 -17.617 -6.392 1.708 1.00 0.00 O ATOM 0 H GLY A 114 -20.054 -7.962 0.075 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -18.004 -9.473 0.989 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -17.168 -8.266 0.033 1.00 0.00 H new ATOM 1795 N PRO A 115 -18.965 -7.852 2.769 1.00 0.00 N ATOM 1796 CA PRO A 115 -19.172 -7.007 3.948 1.00 0.00 C ATOM 1797 C PRO A 115 -17.913 -6.882 4.800 1.00 0.00 C ATOM 1798 O PRO A 115 -16.976 -7.667 4.658 1.00 0.00 O ATOM 1799 CB PRO A 115 -20.270 -7.741 4.722 1.00 0.00 C ATOM 1800 CG PRO A 115 -20.146 -9.164 4.299 1.00 0.00 C ATOM 1801 CD PRO A 115 -19.689 -9.131 2.867 1.00 0.00 C ATOM 0 HA PRO A 115 -19.434 -5.985 3.676 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -20.134 -7.635 5.798 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -21.256 -7.342 4.484 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -19.430 -9.696 4.925 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -21.100 -9.684 4.393 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -19.043 -9.977 2.632 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -20.531 -9.170 2.176 1.00 0.00 H new ATOM 1809 N SER A 116 -17.899 -5.890 5.685 1.00 0.00 N ATOM 1810 CA SER A 116 -16.753 -5.661 6.557 1.00 0.00 C ATOM 1811 C SER A 116 -17.168 -5.718 8.024 1.00 0.00 C ATOM 1812 O SER A 116 -18.291 -5.360 8.378 1.00 0.00 O ATOM 1813 CB SER A 116 -16.114 -4.305 6.249 1.00 0.00 C ATOM 1814 OG SER A 116 -15.155 -4.418 5.212 1.00 0.00 O ATOM 0 H SER A 116 -18.668 -5.233 5.817 1.00 0.00 H new ATOM 0 HA SER A 116 -16.023 -6.449 6.372 1.00 0.00 H new ATOM 0 HB2 SER A 116 -16.886 -3.593 5.959 1.00 0.00 H new ATOM 0 HB3 SER A 116 -15.639 -3.911 7.147 1.00 0.00 H new ATOM 0 HG SER A 116 -14.762 -3.538 5.032 1.00 0.00 H new ATOM 1820 N SER A 117 -16.251 -6.172 8.874 1.00 0.00 N ATOM 1821 CA SER A 117 -16.522 -6.281 10.303 1.00 0.00 C ATOM 1822 C SER A 117 -15.629 -5.333 11.098 1.00 0.00 C ATOM 1823 O SER A 117 -16.114 -4.435 11.785 1.00 0.00 O ATOM 1824 CB SER A 117 -16.306 -7.720 10.776 1.00 0.00 C ATOM 1825 OG SER A 117 -16.939 -7.946 12.023 1.00 0.00 O ATOM 0 H SER A 117 -15.315 -6.470 8.598 1.00 0.00 H new ATOM 0 HA SER A 117 -17.562 -6.002 10.474 1.00 0.00 H new ATOM 0 HB2 SER A 117 -16.700 -8.414 10.033 1.00 0.00 H new ATOM 0 HB3 SER A 117 -15.238 -7.921 10.865 1.00 0.00 H new ATOM 0 HG SER A 117 -16.788 -8.873 12.303 1.00 0.00 H new ATOM 1831 N GLY A 118 -14.319 -5.541 10.999 1.00 0.00 N ATOM 1832 CA GLY A 118 -13.378 -4.698 11.714 1.00 0.00 C ATOM 1833 C GLY A 118 -13.547 -4.787 13.217 1.00 0.00 C ATOM 1834 O GLY A 118 -12.567 -4.764 13.961 1.00 0.00 O ATOM 0 H GLY A 118 -13.893 -6.278 10.437 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.361 -4.987 11.448 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -13.509 -3.663 11.397 1.00 0.00 H new TER 1838 GLY A 118