USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 679 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 45 LYS NZ :NH3+ 158:sc= 2.17 (180deg=0.919) USER MOD Set 1.2: A 59 MET CE :methyl -147:sc= -0.0616 (180deg=-1.19) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -139:sc= -0.48! (180deg=-4.14!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.304 X(o=-0.3,f=-0.14) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -76:sc= 0.811 USER MOD Single : A 35 HIS : no HD1:sc= -1.15 K(o=-1.2,f=-6.5!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 144:sc= -0.0821 (180deg=-0.628) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 169:sc= 1.3 (180deg=1.08) USER MOD Single : A 48 LYS NZ :NH3+ 160:sc= 2.22 (180deg=1.86) USER MOD Single : A 50 SER OG : rot 68:sc= 1.28 USER MOD Single : A 51 TYR OH : rot 30:sc= 0 USER MOD Single : A 52 CYS SG : rot 81:sc= 1.26 USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 55 GLN : amide:sc= 0.418 K(o=0.42,f=-2.6!) USER MOD Single : A 60 ASN : amide:sc= -0.0717 X(o=-0.072,f=0) USER MOD Single : A 61 SER OG : rot -113:sc= 1.27 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 74 ASN : amide:sc= -0.0556 X(o=-0.056,f=-0.39) USER MOD Single : A 75 HIS : no HD1:sc= 0.366 K(o=0.37,f=-7.4!) USER MOD Single : A 76 THR OG1 : rot 73:sc= 1.19 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 161:sc= 1.25 USER MOD Single : A 92 GLN : amide:sc= 0.916 K(o=0.92,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.00718 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 13.956 -5.490 -0.782 1.00 10.00 N ATOM 2 CA TYR A 21 12.750 -4.639 -0.850 1.00 10.00 C ATOM 3 C TYR A 21 11.875 -4.890 0.368 1.00 10.00 C ATOM 4 O TYR A 21 12.263 -5.630 1.269 1.00 10.00 O ATOM 5 CB TYR A 21 11.968 -4.933 -2.134 1.00 10.00 C ATOM 6 CG TYR A 21 12.637 -4.421 -3.393 1.00 10.00 C ATOM 7 CD1 TYR A 21 12.352 -3.153 -3.886 1.00 10.00 C ATOM 8 CD2 TYR A 21 13.551 -5.205 -4.087 1.00 10.00 C ATOM 9 CE1 TYR A 21 12.959 -2.681 -5.035 1.00 10.00 C ATOM 10 CE2 TYR A 21 14.161 -4.739 -5.236 1.00 10.00 C ATOM 11 CZ TYR A 21 13.864 -3.478 -5.705 1.00 10.00 C ATOM 12 OH TYR A 21 14.473 -3.012 -6.848 1.00 10.00 O ATOM 0 HA TYR A 21 13.053 -3.592 -0.860 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.826 -6.010 -2.222 1.00 10.00 H new ATOM 0 HB3 TYR A 21 10.977 -4.486 -2.054 1.00 10.00 H new ATOM 0 HD1 TYR A 21 11.645 -2.526 -3.363 1.00 10.00 H new ATOM 0 HD2 TYR A 21 13.788 -6.194 -3.723 1.00 10.00 H new ATOM 0 HE1 TYR A 21 12.726 -1.694 -5.406 1.00 10.00 H new ATOM 0 HE2 TYR A 21 14.868 -5.361 -5.765 1.00 10.00 H new ATOM 0 HH TYR A 21 15.083 -3.696 -7.196 1.00 10.00 H new ATOM 22 N ILE A 22 10.711 -4.261 0.407 1.00 10.00 N ATOM 23 CA ILE A 22 9.788 -4.439 1.516 1.00 10.00 C ATOM 24 C ILE A 22 8.441 -4.930 0.996 1.00 10.00 C ATOM 25 O ILE A 22 7.787 -4.248 0.210 1.00 10.00 O ATOM 26 CB ILE A 22 9.592 -3.125 2.311 1.00 10.00 C ATOM 27 CG1 ILE A 22 10.919 -2.650 2.919 1.00 10.00 C ATOM 28 CG2 ILE A 22 8.542 -3.307 3.399 1.00 10.00 C ATOM 29 CD1 ILE A 22 11.487 -3.585 3.967 1.00 10.00 C ATOM 0 H ILE A 22 10.383 -3.622 -0.317 1.00 10.00 H new ATOM 0 HA ILE A 22 10.216 -5.181 2.190 1.00 10.00 H new ATOM 0 HB ILE A 22 9.242 -2.360 1.618 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.650 -2.530 2.120 1.00 10.00 H new ATOM 0 HG13 ILE A 22 10.771 -1.667 3.366 1.00 10.00 H new ATOM 0 HG21 ILE A 22 8.419 -2.372 3.946 1.00 10.00 H new ATOM 0 HG22 ILE A 22 7.592 -3.589 2.945 1.00 10.00 H new ATOM 0 HG23 ILE A 22 8.862 -4.090 4.086 1.00 10.00 H new ATOM 0 HD11 ILE A 22 12.424 -3.179 4.347 1.00 10.00 H new ATOM 0 HD12 ILE A 22 10.776 -3.687 4.787 1.00 10.00 H new ATOM 0 HD13 ILE A 22 11.670 -4.563 3.521 1.00 10.00 H new ATOM 41 N LYS A 23 8.046 -6.126 1.407 1.00 10.00 N ATOM 42 CA LYS A 23 6.774 -6.689 0.982 1.00 10.00 C ATOM 43 C LYS A 23 5.668 -6.306 1.954 1.00 10.00 C ATOM 44 O LYS A 23 5.655 -6.749 3.101 1.00 10.00 O ATOM 45 CB LYS A 23 6.859 -8.214 0.870 1.00 10.00 C ATOM 46 CG LYS A 23 7.444 -8.703 -0.448 1.00 10.00 C ATOM 47 CD LYS A 23 8.964 -8.798 -0.396 1.00 10.00 C ATOM 48 CE LYS A 23 9.431 -10.132 0.177 1.00 10.00 C ATOM 49 NZ LYS A 23 9.124 -10.260 1.624 1.00 10.00 N ATOM 0 H LYS A 23 8.587 -6.723 2.033 1.00 10.00 H new ATOM 0 HA LYS A 23 6.541 -6.280 -0.001 1.00 10.00 H new ATOM 0 HB2 LYS A 23 7.467 -8.596 1.690 1.00 10.00 H new ATOM 0 HB3 LYS A 23 5.860 -8.634 0.991 1.00 10.00 H new ATOM 0 HG2 LYS A 23 7.027 -9.681 -0.689 1.00 10.00 H new ATOM 0 HG3 LYS A 23 7.150 -8.025 -1.249 1.00 10.00 H new ATOM 0 HD2 LYS A 23 9.370 -8.672 -1.400 1.00 10.00 H new ATOM 0 HD3 LYS A 23 9.358 -7.984 0.212 1.00 10.00 H new ATOM 0 HE2 LYS A 23 8.953 -10.946 -0.367 1.00 10.00 H new ATOM 0 HE3 LYS A 23 10.505 -10.234 0.025 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 9.929 -10.702 2.112 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 8.950 -9.317 2.027 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 8.277 -10.851 1.748 1.00 10.00 H new ATOM 63 N LEU A 24 4.760 -5.462 1.499 1.00 10.00 N ATOM 64 CA LEU A 24 3.642 -5.032 2.318 1.00 10.00 C ATOM 65 C LEU A 24 2.427 -5.900 2.024 1.00 10.00 C ATOM 66 O LEU A 24 1.946 -5.943 0.890 1.00 10.00 O ATOM 67 CB LEU A 24 3.318 -3.559 2.055 1.00 10.00 C ATOM 68 CG LEU A 24 4.402 -2.564 2.475 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.003 -1.151 2.084 1.00 10.00 C ATOM 70 CD2 LEU A 24 4.659 -2.645 3.972 1.00 10.00 C ATOM 0 H LEU A 24 4.776 -5.059 0.562 1.00 10.00 H new ATOM 0 HA LEU A 24 3.913 -5.140 3.368 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.125 -3.432 0.990 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.396 -3.308 2.579 1.00 10.00 H new ATOM 0 HG LEU A 24 5.324 -2.824 1.955 1.00 10.00 H new ATOM 0 HD11 LEU A 24 4.784 -0.455 2.389 1.00 10.00 H new ATOM 0 HD12 LEU A 24 3.870 -1.096 1.004 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.068 -0.887 2.578 1.00 10.00 H new ATOM 0 HD21 LEU A 24 5.433 -1.929 4.248 1.00 10.00 H new ATOM 0 HD22 LEU A 24 3.741 -2.413 4.512 1.00 10.00 H new ATOM 0 HD23 LEU A 24 4.987 -3.652 4.231 1.00 10.00 H new ATOM 82 N LYS A 25 1.950 -6.599 3.041 1.00 10.00 N ATOM 83 CA LYS A 25 0.796 -7.472 2.897 1.00 10.00 C ATOM 84 C LYS A 25 -0.491 -6.676 3.073 1.00 10.00 C ATOM 85 O LYS A 25 -0.856 -6.304 4.193 1.00 10.00 O ATOM 86 CB LYS A 25 0.858 -8.613 3.920 1.00 10.00 C ATOM 87 CG LYS A 25 2.205 -9.315 3.961 1.00 10.00 C ATOM 88 CD LYS A 25 2.215 -10.466 4.953 1.00 10.00 C ATOM 89 CE LYS A 25 1.457 -11.674 4.422 1.00 10.00 C ATOM 90 NZ LYS A 25 1.488 -12.809 5.381 1.00 10.00 N ATOM 0 H LYS A 25 2.347 -6.578 3.980 1.00 10.00 H new ATOM 0 HA LYS A 25 0.808 -7.902 1.896 1.00 10.00 H new ATOM 0 HB2 LYS A 25 0.633 -8.216 4.910 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.083 -9.343 3.686 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.449 -9.690 2.967 1.00 10.00 H new ATOM 0 HG3 LYS A 25 2.980 -8.597 4.230 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.245 -10.750 5.171 1.00 10.00 H new ATOM 0 HD3 LYS A 25 1.768 -10.140 5.893 1.00 10.00 H new ATOM 0 HE2 LYS A 25 0.422 -11.395 4.222 1.00 10.00 H new ATOM 0 HE3 LYS A 25 1.892 -11.988 3.473 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 0.961 -13.613 4.984 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 2.474 -13.092 5.553 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 1.050 -12.517 6.278 1.00 10.00 H new ATOM 104 N VAL A 26 -1.163 -6.402 1.963 1.00 10.00 N ATOM 105 CA VAL A 26 -2.409 -5.648 1.987 1.00 10.00 C ATOM 106 C VAL A 26 -3.593 -6.595 2.111 1.00 10.00 C ATOM 107 O VAL A 26 -3.727 -7.543 1.334 1.00 10.00 O ATOM 108 CB VAL A 26 -2.592 -4.774 0.725 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.494 -3.589 1.026 1.00 10.00 C ATOM 110 CG2 VAL A 26 -1.250 -4.302 0.181 1.00 10.00 C ATOM 0 H VAL A 26 -0.865 -6.692 1.032 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.361 -4.986 2.852 1.00 10.00 H new ATOM 0 HB VAL A 26 -3.066 -5.386 -0.042 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.612 -2.984 0.127 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.470 -3.948 1.353 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -3.048 -2.983 1.815 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.412 -3.690 -0.706 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.737 -3.712 0.940 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.639 -5.166 -0.081 1.00 10.00 H new ATOM 120 N ILE A 27 -4.441 -6.341 3.095 1.00 10.00 N ATOM 121 CA ILE A 27 -5.612 -7.173 3.334 1.00 10.00 C ATOM 122 C ILE A 27 -6.774 -6.758 2.436 1.00 10.00 C ATOM 123 O ILE A 27 -7.394 -5.715 2.652 1.00 10.00 O ATOM 124 CB ILE A 27 -6.061 -7.099 4.813 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.867 -7.310 5.753 1.00 10.00 C ATOM 126 CG2 ILE A 27 -7.154 -8.123 5.092 1.00 10.00 C ATOM 127 CD1 ILE A 27 -4.199 -8.664 5.610 1.00 10.00 C ATOM 0 H ILE A 27 -4.340 -5.561 3.745 1.00 10.00 H new ATOM 0 HA ILE A 27 -5.327 -8.199 3.100 1.00 10.00 H new ATOM 0 HB ILE A 27 -6.468 -6.105 4.998 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -4.128 -6.531 5.565 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -5.203 -7.189 6.783 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.457 -8.056 6.137 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -8.013 -7.922 4.452 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.775 -9.124 4.887 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -3.365 -8.734 6.308 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.921 -9.451 5.827 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.830 -8.782 4.591 1.00 10.00 H new ATOM 139 N GLY A 28 -7.051 -7.570 1.422 1.00 10.00 N ATOM 140 CA GLY A 28 -8.147 -7.280 0.518 1.00 10.00 C ATOM 141 C GLY A 28 -9.497 -7.583 1.145 1.00 10.00 C ATOM 142 O GLY A 28 -9.593 -8.425 2.043 1.00 10.00 O ATOM 0 H GLY A 28 -6.536 -8.424 1.210 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.109 -6.230 0.228 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.030 -7.867 -0.393 1.00 10.00 H new ATOM 146 N GLN A 29 -10.542 -6.914 0.664 1.00 10.00 N ATOM 147 CA GLN A 29 -11.892 -7.107 1.193 1.00 10.00 C ATOM 148 C GLN A 29 -12.376 -8.534 0.955 1.00 10.00 C ATOM 149 O GLN A 29 -13.127 -9.086 1.757 1.00 10.00 O ATOM 150 CB GLN A 29 -12.862 -6.111 0.554 1.00 10.00 C ATOM 151 CG GLN A 29 -14.162 -5.931 1.327 1.00 10.00 C ATOM 152 CD GLN A 29 -13.952 -5.294 2.686 1.00 10.00 C ATOM 153 OE1 GLN A 29 -13.918 -4.070 2.812 1.00 10.00 O ATOM 154 NE2 GLN A 29 -13.827 -6.118 3.716 1.00 10.00 N ATOM 0 H GLN A 29 -10.481 -6.232 -0.092 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.859 -6.932 2.268 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.367 -5.144 0.465 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -13.095 -6.444 -0.457 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -14.845 -5.314 0.743 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.641 -6.902 1.456 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.861 -7.127 3.569 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -13.697 -5.744 4.656 1.00 10.00 H new ATOM 163 N ASP A 30 -11.927 -9.130 -0.141 1.00 10.00 N ATOM 164 CA ASP A 30 -12.308 -10.498 -0.485 1.00 10.00 C ATOM 165 C ASP A 30 -11.335 -11.499 0.128 1.00 10.00 C ATOM 166 O ASP A 30 -11.298 -12.665 -0.269 1.00 10.00 O ATOM 167 CB ASP A 30 -12.343 -10.683 -2.005 1.00 10.00 C ATOM 168 CG ASP A 30 -11.032 -10.310 -2.667 1.00 10.00 C ATOM 169 OD1 ASP A 30 -10.870 -9.129 -3.041 1.00 10.00 O ATOM 170 OD2 ASP A 30 -10.157 -11.185 -2.811 1.00 10.00 O ATOM 0 H ASP A 30 -11.297 -8.688 -0.810 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.304 -10.679 -0.081 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.580 -11.722 -2.236 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -13.144 -10.073 -2.423 1.00 10.00 H new ATOM 175 N SER A 31 -10.559 -11.028 1.102 1.00 10.00 N ATOM 176 CA SER A 31 -9.572 -11.850 1.792 1.00 10.00 C ATOM 177 C SER A 31 -8.475 -12.299 0.831 1.00 10.00 C ATOM 178 O SER A 31 -8.356 -13.480 0.502 1.00 10.00 O ATOM 179 CB SER A 31 -10.242 -13.051 2.470 1.00 10.00 C ATOM 180 OG SER A 31 -11.247 -12.618 3.376 1.00 10.00 O ATOM 0 H SER A 31 -10.598 -10.064 1.434 1.00 10.00 H new ATOM 0 HA SER A 31 -9.107 -11.245 2.570 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.682 -13.703 1.715 1.00 10.00 H new ATOM 0 HB3 SER A 31 -9.494 -13.639 3.002 1.00 10.00 H new ATOM 0 HG SER A 31 -11.665 -13.398 3.798 1.00 10.00 H new ATOM 186 N SER A 32 -7.697 -11.330 0.368 1.00 10.00 N ATOM 187 CA SER A 32 -6.598 -11.586 -0.548 1.00 10.00 C ATOM 188 C SER A 32 -5.283 -11.129 0.081 1.00 10.00 C ATOM 189 O SER A 32 -5.241 -10.098 0.757 1.00 10.00 O ATOM 190 CB SER A 32 -6.845 -10.852 -1.870 1.00 10.00 C ATOM 191 OG SER A 32 -7.981 -10.003 -1.771 1.00 10.00 O ATOM 0 H SER A 32 -7.811 -10.347 0.617 1.00 10.00 H new ATOM 0 HA SER A 32 -6.535 -12.655 -0.749 1.00 10.00 H new ATOM 0 HB2 SER A 32 -5.967 -10.263 -2.134 1.00 10.00 H new ATOM 0 HB3 SER A 32 -6.995 -11.576 -2.671 1.00 10.00 H new ATOM 0 HG SER A 32 -8.798 -10.543 -1.818 1.00 10.00 H new ATOM 197 N GLU A 33 -4.222 -11.902 -0.127 1.00 10.00 N ATOM 198 CA GLU A 33 -2.911 -11.575 0.423 1.00 10.00 C ATOM 199 C GLU A 33 -2.085 -10.801 -0.600 1.00 10.00 C ATOM 200 O GLU A 33 -1.189 -11.351 -1.237 1.00 10.00 O ATOM 201 CB GLU A 33 -2.169 -12.853 0.836 1.00 10.00 C ATOM 202 CG GLU A 33 -3.032 -13.852 1.590 1.00 10.00 C ATOM 203 CD GLU A 33 -2.416 -15.234 1.644 1.00 10.00 C ATOM 204 OE1 GLU A 33 -2.126 -15.714 2.761 1.00 10.00 O ATOM 205 OE2 GLU A 33 -2.208 -15.847 0.573 1.00 10.00 O ATOM 0 H GLU A 33 -4.245 -12.762 -0.674 1.00 10.00 H new ATOM 0 HA GLU A 33 -3.054 -10.952 1.306 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -1.770 -13.334 -0.057 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -1.317 -12.581 1.459 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -3.195 -13.491 2.606 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -4.010 -13.913 1.113 1.00 10.00 H new ATOM 212 N ILE A 34 -2.394 -9.529 -0.765 1.00 10.00 N ATOM 213 CA ILE A 34 -1.678 -8.701 -1.722 1.00 10.00 C ATOM 214 C ILE A 34 -0.278 -8.374 -1.205 1.00 10.00 C ATOM 215 O ILE A 34 -0.125 -7.689 -0.199 1.00 10.00 O ATOM 216 CB ILE A 34 -2.443 -7.396 -2.021 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.916 -7.691 -2.344 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.785 -6.650 -3.170 1.00 10.00 C ATOM 219 CD1 ILE A 34 -4.113 -8.560 -3.574 1.00 10.00 C ATOM 0 H ILE A 34 -3.132 -9.046 -0.252 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.595 -9.268 -2.649 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.409 -6.766 -1.132 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.375 -8.183 -1.486 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.442 -6.748 -2.489 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.336 -5.731 -3.370 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.756 -6.406 -2.904 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.790 -7.277 -4.061 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.178 -8.724 -3.737 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.685 -8.062 -4.444 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.617 -9.519 -3.425 1.00 10.00 H new ATOM 231 N HIS A 35 0.738 -8.877 -1.894 1.00 10.00 N ATOM 232 CA HIS A 35 2.119 -8.645 -1.493 1.00 10.00 C ATOM 233 C HIS A 35 2.746 -7.534 -2.328 1.00 10.00 C ATOM 234 O HIS A 35 3.265 -7.779 -3.414 1.00 10.00 O ATOM 235 CB HIS A 35 2.942 -9.926 -1.649 1.00 10.00 C ATOM 236 CG HIS A 35 3.209 -10.639 -0.360 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.025 -11.994 -0.241 1.00 10.00 N ATOM 238 CD2 HIS A 35 3.673 -10.151 0.815 1.00 10.00 C ATOM 239 CE1 HIS A 35 3.374 -12.299 0.994 1.00 10.00 C ATOM 240 NE2 HIS A 35 3.779 -11.217 1.676 1.00 10.00 N ATOM 0 H HIS A 35 0.632 -9.448 -2.733 1.00 10.00 H new ATOM 0 HA HIS A 35 2.118 -8.342 -0.446 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.418 -10.602 -2.325 1.00 10.00 H new ATOM 0 HB3 HIS A 35 3.894 -9.679 -2.120 1.00 10.00 H new ATOM 0 HD2 HIS A 35 3.914 -9.121 1.034 1.00 10.00 H new ATOM 0 HE1 HIS A 35 3.338 -13.297 1.405 1.00 10.00 H new ATOM 0 HE2 HIS A 35 4.102 -11.191 2.643 1.00 10.00 H new ATOM 248 N PHE A 36 2.696 -6.314 -1.828 1.00 10.00 N ATOM 249 CA PHE A 36 3.263 -5.187 -2.552 1.00 10.00 C ATOM 250 C PHE A 36 4.752 -5.049 -2.255 1.00 10.00 C ATOM 251 O PHE A 36 5.146 -4.837 -1.111 1.00 10.00 O ATOM 252 CB PHE A 36 2.538 -3.888 -2.196 1.00 10.00 C ATOM 253 CG PHE A 36 2.372 -2.964 -3.367 1.00 10.00 C ATOM 254 CD1 PHE A 36 1.147 -2.382 -3.638 1.00 10.00 C ATOM 255 CD2 PHE A 36 3.442 -2.686 -4.203 1.00 10.00 C ATOM 256 CE1 PHE A 36 0.990 -1.540 -4.721 1.00 10.00 C ATOM 257 CE2 PHE A 36 3.292 -1.846 -5.284 1.00 10.00 C ATOM 258 CZ PHE A 36 2.064 -1.272 -5.546 1.00 10.00 C ATOM 0 H PHE A 36 2.273 -6.077 -0.931 1.00 10.00 H new ATOM 0 HA PHE A 36 3.133 -5.377 -3.617 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.556 -4.128 -1.788 1.00 10.00 H new ATOM 0 HB3 PHE A 36 3.092 -3.373 -1.411 1.00 10.00 H new ATOM 0 HD1 PHE A 36 0.304 -2.588 -2.995 1.00 10.00 H new ATOM 0 HD2 PHE A 36 4.405 -3.133 -4.004 1.00 10.00 H new ATOM 0 HE1 PHE A 36 0.028 -1.092 -4.922 1.00 10.00 H new ATOM 0 HE2 PHE A 36 4.134 -1.636 -5.926 1.00 10.00 H new ATOM 0 HZ PHE A 36 1.944 -0.615 -6.395 1.00 10.00 H new ATOM 268 N LYS A 37 5.571 -5.177 -3.287 1.00 10.00 N ATOM 269 CA LYS A 37 7.013 -5.055 -3.137 1.00 10.00 C ATOM 270 C LYS A 37 7.434 -3.598 -3.316 1.00 10.00 C ATOM 271 O LYS A 37 7.552 -3.110 -4.441 1.00 10.00 O ATOM 272 CB LYS A 37 7.718 -5.948 -4.159 1.00 10.00 C ATOM 273 CG LYS A 37 9.194 -6.183 -3.871 1.00 10.00 C ATOM 274 CD LYS A 37 9.837 -7.083 -4.919 1.00 10.00 C ATOM 275 CE LYS A 37 9.188 -8.458 -4.950 1.00 10.00 C ATOM 276 NZ LYS A 37 9.931 -9.411 -5.817 1.00 10.00 N ATOM 0 H LYS A 37 5.261 -5.366 -4.240 1.00 10.00 H new ATOM 0 HA LYS A 37 7.300 -5.378 -2.136 1.00 10.00 H new ATOM 0 HB2 LYS A 37 7.209 -6.911 -4.195 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.619 -5.498 -5.147 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.716 -5.227 -3.843 1.00 10.00 H new ATOM 0 HG3 LYS A 37 9.305 -6.635 -2.886 1.00 10.00 H new ATOM 0 HD2 LYS A 37 9.752 -6.618 -5.901 1.00 10.00 H new ATOM 0 HD3 LYS A 37 10.901 -7.187 -4.707 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.136 -8.856 -3.937 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.163 -8.366 -5.309 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.453 -10.334 -5.808 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.959 -9.045 -6.790 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 10.902 -9.521 -5.460 1.00 10.00 H new ATOM 290 N VAL A 38 7.641 -2.907 -2.204 1.00 10.00 N ATOM 291 CA VAL A 38 8.026 -1.502 -2.239 1.00 10.00 C ATOM 292 C VAL A 38 9.531 -1.324 -2.027 1.00 10.00 C ATOM 293 O VAL A 38 10.216 -2.231 -1.544 1.00 10.00 O ATOM 294 CB VAL A 38 7.248 -0.674 -1.188 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.753 -0.949 -1.289 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.745 -0.961 0.220 1.00 10.00 C ATOM 0 H VAL A 38 7.549 -3.296 -1.266 1.00 10.00 H new ATOM 0 HA VAL A 38 7.770 -1.133 -3.232 1.00 10.00 H new ATOM 0 HB VAL A 38 7.425 0.381 -1.399 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.223 -0.358 -0.542 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.400 -0.678 -2.284 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.565 -2.008 -1.113 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.178 -0.364 0.935 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.611 -2.019 0.444 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.802 -0.706 0.292 1.00 10.00 H new ATOM 306 N LYS A 39 10.032 -0.149 -2.385 1.00 10.00 N ATOM 307 CA LYS A 39 11.450 0.166 -2.253 1.00 10.00 C ATOM 308 C LYS A 39 11.664 1.156 -1.109 1.00 10.00 C ATOM 309 O LYS A 39 10.966 2.169 -1.019 1.00 10.00 O ATOM 310 CB LYS A 39 11.974 0.756 -3.568 1.00 10.00 C ATOM 311 CG LYS A 39 13.487 0.711 -3.712 1.00 10.00 C ATOM 312 CD LYS A 39 13.947 1.441 -4.966 1.00 10.00 C ATOM 313 CE LYS A 39 15.459 1.385 -5.116 1.00 10.00 C ATOM 314 NZ LYS A 39 15.947 2.289 -6.194 1.00 10.00 N ATOM 0 H LYS A 39 9.471 0.609 -2.773 1.00 10.00 H new ATOM 0 HA LYS A 39 11.999 -0.749 -2.030 1.00 10.00 H new ATOM 0 HB2 LYS A 39 11.525 0.215 -4.401 1.00 10.00 H new ATOM 0 HB3 LYS A 39 11.643 1.792 -3.646 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.951 1.163 -2.835 1.00 10.00 H new ATOM 0 HG3 LYS A 39 13.820 -0.326 -3.750 1.00 10.00 H new ATOM 0 HD2 LYS A 39 13.476 0.995 -5.842 1.00 10.00 H new ATOM 0 HD3 LYS A 39 13.622 2.481 -4.924 1.00 10.00 H new ATOM 0 HE2 LYS A 39 15.927 1.662 -4.171 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.764 0.362 -5.335 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 16.982 2.220 -6.263 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 15.521 2.010 -7.101 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 15.679 3.269 -5.973 1.00 10.00 H new ATOM 328 N MET A 40 12.624 0.861 -0.237 1.00 10.00 N ATOM 329 CA MET A 40 12.919 1.730 0.901 1.00 10.00 C ATOM 330 C MET A 40 13.689 2.977 0.462 1.00 10.00 C ATOM 331 O MET A 40 14.912 3.047 0.589 1.00 10.00 O ATOM 332 CB MET A 40 13.709 0.968 1.972 1.00 10.00 C ATOM 333 CG MET A 40 14.038 1.802 3.205 1.00 10.00 C ATOM 334 SD MET A 40 12.566 2.426 4.048 1.00 10.00 S ATOM 335 CE MET A 40 11.867 0.899 4.675 1.00 10.00 C ATOM 0 H MET A 40 13.211 0.029 -0.295 1.00 10.00 H new ATOM 0 HA MET A 40 11.969 2.051 1.328 1.00 10.00 H new ATOM 0 HB2 MET A 40 13.136 0.093 2.279 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.638 0.603 1.534 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.620 1.198 3.901 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.666 2.643 2.911 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.416 1.079 5.651 1.00 10.00 H new ATOM 0 HE2 MET A 40 11.105 0.537 3.984 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.654 0.151 4.771 1.00 10.00 H new ATOM 345 N THR A 41 12.952 3.944 -0.074 1.00 10.00 N ATOM 346 CA THR A 41 13.516 5.211 -0.531 1.00 10.00 C ATOM 347 C THR A 41 12.452 6.014 -1.272 1.00 10.00 C ATOM 348 O THR A 41 12.493 7.244 -1.296 1.00 10.00 O ATOM 349 CB THR A 41 14.752 5.022 -1.446 1.00 10.00 C ATOM 350 OG1 THR A 41 15.318 6.295 -1.783 1.00 10.00 O ATOM 351 CG2 THR A 41 14.396 4.273 -2.724 1.00 10.00 C ATOM 0 H THR A 41 11.943 3.872 -0.205 1.00 10.00 H new ATOM 0 HA THR A 41 13.849 5.749 0.356 1.00 10.00 H new ATOM 0 HB THR A 41 15.480 4.429 -0.893 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.099 6.163 -2.360 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.288 4.160 -3.340 1.00 10.00 H new ATOM 0 HG22 THR A 41 14.002 3.289 -2.471 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.642 4.834 -3.277 1.00 10.00 H new ATOM 359 N THR A 42 11.503 5.306 -1.868 1.00 10.00 N ATOM 360 CA THR A 42 10.426 5.936 -2.609 1.00 10.00 C ATOM 361 C THR A 42 9.278 6.310 -1.680 1.00 10.00 C ATOM 362 O THR A 42 8.961 5.572 -0.745 1.00 10.00 O ATOM 363 CB THR A 42 9.902 4.991 -3.704 1.00 10.00 C ATOM 364 OG1 THR A 42 11.010 4.381 -4.379 1.00 10.00 O ATOM 365 CG2 THR A 42 9.036 5.737 -4.710 1.00 10.00 C ATOM 0 H THR A 42 11.460 4.287 -1.851 1.00 10.00 H new ATOM 0 HA THR A 42 10.823 6.841 -3.070 1.00 10.00 H new ATOM 0 HB THR A 42 9.287 4.225 -3.231 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.677 3.778 -5.076 1.00 10.00 H new ATOM 0 HG21 THR A 42 8.681 5.042 -5.471 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.182 6.180 -4.197 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.624 6.524 -5.183 1.00 10.00 H new ATOM 373 N HIS A 43 8.675 7.465 -1.927 1.00 10.00 N ATOM 374 CA HIS A 43 7.550 7.921 -1.124 1.00 10.00 C ATOM 375 C HIS A 43 6.349 7.017 -1.354 1.00 10.00 C ATOM 376 O HIS A 43 6.130 6.537 -2.470 1.00 10.00 O ATOM 377 CB HIS A 43 7.184 9.369 -1.462 1.00 10.00 C ATOM 378 CG HIS A 43 7.715 10.366 -0.481 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.890 11.038 -0.710 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.203 10.763 0.711 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.071 11.820 0.338 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.073 11.688 1.227 1.00 10.00 N ATOM 0 H HIS A 43 8.946 8.102 -2.676 1.00 10.00 H new ATOM 0 HA HIS A 43 7.841 7.878 -0.074 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.566 9.609 -2.454 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.099 9.459 -1.508 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.287 10.417 1.166 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.915 12.482 0.465 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.980 12.181 2.115 1.00 10.00 H new ATOM 390 N LEU A 44 5.561 6.805 -0.305 1.00 10.00 N ATOM 391 CA LEU A 44 4.386 5.943 -0.386 1.00 10.00 C ATOM 392 C LEU A 44 3.336 6.505 -1.341 1.00 10.00 C ATOM 393 O LEU A 44 2.398 5.808 -1.715 1.00 10.00 O ATOM 394 CB LEU A 44 3.787 5.724 1.005 1.00 10.00 C ATOM 395 CG LEU A 44 4.542 4.710 1.865 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.207 4.894 3.332 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.216 3.294 1.419 1.00 10.00 C ATOM 0 H LEU A 44 5.715 7.220 0.614 1.00 10.00 H new ATOM 0 HA LEU A 44 4.709 4.982 -0.785 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.760 6.679 1.530 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.755 5.392 0.895 1.00 10.00 H new ATOM 0 HG LEU A 44 5.611 4.879 1.736 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.755 4.162 3.925 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.488 5.899 3.646 1.00 10.00 H new ATOM 0 HD13 LEU A 44 3.136 4.753 3.481 1.00 10.00 H new ATOM 0 HD21 LEU A 44 4.760 2.583 2.040 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.145 3.118 1.520 1.00 10.00 H new ATOM 0 HD23 LEU A 44 4.508 3.164 0.377 1.00 10.00 H new ATOM 409 N LYS A 45 3.508 7.763 -1.737 1.00 10.00 N ATOM 410 CA LYS A 45 2.595 8.417 -2.670 1.00 10.00 C ATOM 411 C LYS A 45 2.506 7.625 -3.970 1.00 10.00 C ATOM 412 O LYS A 45 1.414 7.329 -4.457 1.00 10.00 O ATOM 413 CB LYS A 45 3.078 9.846 -2.961 1.00 10.00 C ATOM 414 CG LYS A 45 2.423 10.501 -4.175 1.00 10.00 C ATOM 415 CD LYS A 45 0.936 10.724 -3.958 1.00 10.00 C ATOM 416 CE LYS A 45 0.298 11.441 -5.140 1.00 10.00 C ATOM 417 NZ LYS A 45 -1.138 11.750 -4.897 1.00 10.00 N ATOM 0 H LYS A 45 4.278 8.354 -1.423 1.00 10.00 H new ATOM 0 HA LYS A 45 1.604 8.459 -2.217 1.00 10.00 H new ATOM 0 HB2 LYS A 45 2.890 10.465 -2.084 1.00 10.00 H new ATOM 0 HB3 LYS A 45 4.157 9.827 -3.112 1.00 10.00 H new ATOM 0 HG2 LYS A 45 2.908 11.455 -4.380 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.573 9.872 -5.053 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.442 9.764 -3.804 1.00 10.00 H new ATOM 0 HD3 LYS A 45 0.784 11.310 -3.051 1.00 10.00 H new ATOM 0 HE2 LYS A 45 0.839 12.366 -5.338 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.389 10.821 -6.032 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.435 12.531 -5.516 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.714 10.908 -5.102 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.270 12.027 -3.903 1.00 10.00 H new ATOM 431 N LYS A 46 3.666 7.254 -4.503 1.00 10.00 N ATOM 432 CA LYS A 46 3.735 6.512 -5.753 1.00 10.00 C ATOM 433 C LYS A 46 3.198 5.094 -5.580 1.00 10.00 C ATOM 434 O LYS A 46 2.715 4.483 -6.530 1.00 10.00 O ATOM 435 CB LYS A 46 5.180 6.473 -6.269 1.00 10.00 C ATOM 436 CG LYS A 46 5.291 6.223 -7.766 1.00 10.00 C ATOM 437 CD LYS A 46 4.701 7.373 -8.565 1.00 10.00 C ATOM 438 CE LYS A 46 4.631 7.049 -10.046 1.00 10.00 C ATOM 439 NZ LYS A 46 3.681 7.939 -10.761 1.00 10.00 N ATOM 0 H LYS A 46 4.574 7.457 -4.085 1.00 10.00 H new ATOM 0 HA LYS A 46 3.111 7.024 -6.485 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.667 7.419 -6.031 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.725 5.692 -5.738 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.338 6.089 -8.037 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.774 5.298 -8.021 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.701 7.599 -8.194 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.306 8.268 -8.416 1.00 10.00 H new ATOM 0 HE2 LYS A 46 5.623 7.147 -10.487 1.00 10.00 H new ATOM 0 HE3 LYS A 46 4.325 6.011 -10.177 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.796 7.816 -11.787 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 2.707 7.696 -10.490 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 3.874 8.929 -10.507 1.00 10.00 H new ATOM 453 N LEU A 47 3.281 4.576 -4.365 1.00 10.00 N ATOM 454 CA LEU A 47 2.800 3.233 -4.073 1.00 10.00 C ATOM 455 C LEU A 47 1.281 3.225 -3.943 1.00 10.00 C ATOM 456 O LEU A 47 0.609 2.326 -4.452 1.00 10.00 O ATOM 457 CB LEU A 47 3.444 2.699 -2.785 1.00 10.00 C ATOM 458 CG LEU A 47 4.864 2.135 -2.937 1.00 10.00 C ATOM 459 CD1 LEU A 47 4.923 1.132 -4.077 1.00 10.00 C ATOM 460 CD2 LEU A 47 5.878 3.252 -3.156 1.00 10.00 C ATOM 0 H LEU A 47 3.678 5.066 -3.563 1.00 10.00 H new ATOM 0 HA LEU A 47 3.082 2.582 -4.900 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.469 3.505 -2.052 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.804 1.917 -2.377 1.00 10.00 H new ATOM 0 HG LEU A 47 5.121 1.622 -2.010 1.00 10.00 H new ATOM 0 HD11 LEU A 47 5.938 0.744 -4.168 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.237 0.310 -3.874 1.00 10.00 H new ATOM 0 HD13 LEU A 47 4.637 1.622 -5.008 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.875 2.823 -3.260 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.623 3.802 -4.062 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.862 3.930 -2.303 1.00 10.00 H new ATOM 472 N LYS A 48 0.750 4.241 -3.275 1.00 10.00 N ATOM 473 CA LYS A 48 -0.688 4.362 -3.066 1.00 10.00 C ATOM 474 C LYS A 48 -1.438 4.467 -4.391 1.00 10.00 C ATOM 475 O LYS A 48 -2.450 3.793 -4.598 1.00 10.00 O ATOM 476 CB LYS A 48 -0.999 5.587 -2.200 1.00 10.00 C ATOM 477 CG LYS A 48 -0.556 5.452 -0.749 1.00 10.00 C ATOM 478 CD LYS A 48 -0.768 6.745 0.025 1.00 10.00 C ATOM 479 CE LYS A 48 -2.245 7.044 0.226 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.460 8.353 0.896 1.00 10.00 N ATOM 0 H LYS A 48 1.298 4.998 -2.866 1.00 10.00 H new ATOM 0 HA LYS A 48 -1.023 3.460 -2.554 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.514 6.460 -2.637 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.073 5.773 -2.225 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.113 4.646 -0.271 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.498 5.175 -0.714 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.276 6.673 0.995 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.299 7.571 -0.510 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.750 7.043 -0.740 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.698 6.252 0.823 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.431 8.679 0.718 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.313 8.247 1.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -1.786 9.050 0.520 1.00 10.00 H new ATOM 494 N GLU A 49 -0.944 5.315 -5.285 1.00 10.00 N ATOM 495 CA GLU A 49 -1.583 5.505 -6.580 1.00 10.00 C ATOM 496 C GLU A 49 -1.473 4.249 -7.444 1.00 10.00 C ATOM 497 O GLU A 49 -2.445 3.844 -8.080 1.00 10.00 O ATOM 498 CB GLU A 49 -0.986 6.709 -7.310 1.00 10.00 C ATOM 499 CG GLU A 49 0.521 6.644 -7.478 1.00 10.00 C ATOM 500 CD GLU A 49 1.062 7.802 -8.283 1.00 10.00 C ATOM 501 OE1 GLU A 49 1.132 8.923 -7.744 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.426 7.591 -9.459 1.00 10.00 O ATOM 0 H GLU A 49 -0.107 5.879 -5.138 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.640 5.699 -6.400 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.448 6.790 -8.294 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.241 7.616 -6.762 1.00 10.00 H new ATOM 0 HG2 GLU A 49 0.993 6.636 -6.496 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.789 5.708 -7.968 1.00 10.00 H new ATOM 509 N SER A 50 -0.296 3.625 -7.448 1.00 10.00 N ATOM 510 CA SER A 50 -0.068 2.417 -8.235 1.00 10.00 C ATOM 511 C SER A 50 -1.023 1.298 -7.821 1.00 10.00 C ATOM 512 O SER A 50 -1.489 0.526 -8.661 1.00 10.00 O ATOM 513 CB SER A 50 1.385 1.962 -8.097 1.00 10.00 C ATOM 514 OG SER A 50 2.273 2.946 -8.607 1.00 10.00 O ATOM 0 H SER A 50 0.515 3.938 -6.914 1.00 10.00 H new ATOM 0 HA SER A 50 -0.265 2.652 -9.281 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.612 1.769 -7.049 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.529 1.023 -8.632 1.00 10.00 H new ATOM 0 HG SER A 50 2.242 3.742 -8.036 1.00 10.00 H new ATOM 520 N TYR A 51 -1.322 1.221 -6.529 1.00 10.00 N ATOM 521 CA TYR A 51 -2.237 0.208 -6.022 1.00 10.00 C ATOM 522 C TYR A 51 -3.630 0.435 -6.603 1.00 10.00 C ATOM 523 O TYR A 51 -4.287 -0.502 -7.060 1.00 10.00 O ATOM 524 CB TYR A 51 -2.290 0.256 -4.493 1.00 10.00 C ATOM 525 CG TYR A 51 -3.084 -0.874 -3.867 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.515 -2.127 -3.680 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.400 -0.687 -3.459 1.00 10.00 C ATOM 528 CE1 TYR A 51 -3.231 -3.159 -3.106 1.00 10.00 C ATOM 529 CE2 TYR A 51 -5.123 -1.716 -2.885 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.534 -2.950 -2.711 1.00 10.00 C ATOM 531 OH TYR A 51 -5.249 -3.977 -2.140 1.00 10.00 O ATOM 0 H TYR A 51 -0.945 1.846 -5.817 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.879 -0.776 -6.325 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.272 0.230 -4.104 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.725 1.206 -4.185 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.494 -2.297 -3.989 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.865 0.278 -3.593 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.771 -4.126 -2.967 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -6.145 -1.554 -2.574 1.00 10.00 H new ATOM 0 HH TYR A 51 -4.637 -4.575 -1.661 1.00 10.00 H new ATOM 541 N CYS A 52 -4.056 1.693 -6.599 1.00 10.00 N ATOM 542 CA CYS A 52 -5.363 2.065 -7.121 1.00 10.00 C ATOM 543 C CYS A 52 -5.442 1.781 -8.619 1.00 10.00 C ATOM 544 O CYS A 52 -6.415 1.199 -9.102 1.00 10.00 O ATOM 545 CB CYS A 52 -5.635 3.551 -6.851 1.00 10.00 C ATOM 546 SG CYS A 52 -5.388 4.053 -5.132 1.00 10.00 S ATOM 0 H CYS A 52 -3.511 2.476 -6.238 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.121 1.468 -6.615 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.984 4.149 -7.489 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.661 3.779 -7.140 1.00 10.00 H new ATOM 0 HG CYS A 52 -4.121 4.248 -4.915 1.00 10.00 H new ATOM 552 N GLN A 53 -4.394 2.163 -9.342 1.00 10.00 N ATOM 553 CA GLN A 53 -4.335 1.968 -10.790 1.00 10.00 C ATOM 554 C GLN A 53 -4.388 0.485 -11.159 1.00 10.00 C ATOM 555 O GLN A 53 -4.959 0.117 -12.187 1.00 10.00 O ATOM 556 CB GLN A 53 -3.067 2.608 -11.363 1.00 10.00 C ATOM 557 CG GLN A 53 -2.973 4.102 -11.095 1.00 10.00 C ATOM 558 CD GLN A 53 -1.653 4.705 -11.536 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.627 4.023 -11.601 1.00 10.00 O ATOM 560 NE2 GLN A 53 -1.665 5.994 -11.834 1.00 10.00 N ATOM 0 H GLN A 53 -3.568 2.613 -8.947 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.209 2.454 -11.225 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.194 2.114 -10.936 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.036 2.436 -12.439 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -3.788 4.609 -11.612 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -3.110 4.283 -10.029 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -2.534 6.525 -11.768 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -0.806 6.457 -12.130 1.00 10.00 H new ATOM 569 N ARG A 54 -3.802 -0.362 -10.319 1.00 10.00 N ATOM 570 CA ARG A 54 -3.795 -1.796 -10.575 1.00 10.00 C ATOM 571 C ARG A 54 -5.177 -2.394 -10.345 1.00 10.00 C ATOM 572 O ARG A 54 -5.623 -3.256 -11.100 1.00 10.00 O ATOM 573 CB ARG A 54 -2.777 -2.509 -9.685 1.00 10.00 C ATOM 574 CG ARG A 54 -2.378 -3.877 -10.217 1.00 10.00 C ATOM 575 CD ARG A 54 -1.706 -4.725 -9.152 1.00 10.00 C ATOM 576 NE ARG A 54 -2.647 -5.632 -8.495 1.00 10.00 N ATOM 577 CZ ARG A 54 -2.390 -6.914 -8.240 1.00 10.00 C ATOM 578 NH1 ARG A 54 -1.225 -7.448 -8.591 1.00 10.00 N ATOM 579 NH2 ARG A 54 -3.306 -7.663 -7.645 1.00 10.00 N ATOM 0 H ARG A 54 -3.329 -0.082 -9.460 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.513 -1.940 -11.618 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.886 -1.888 -9.591 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.194 -2.622 -8.684 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -3.263 -4.394 -10.588 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -1.702 -3.754 -11.063 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -0.901 -5.304 -9.605 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -1.250 -4.074 -8.406 1.00 10.00 H new ATOM 0 HE ARG A 54 -3.555 -5.260 -8.215 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -0.522 -6.876 -9.058 1.00 10.00 H new ATOM 0 HH12 ARG A 54 -1.034 -8.430 -8.393 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -4.205 -7.258 -7.384 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -3.113 -8.645 -7.448 1.00 10.00 H new ATOM 593 N GLN A 55 -5.856 -1.932 -9.302 1.00 10.00 N ATOM 594 CA GLN A 55 -7.189 -2.434 -8.985 1.00 10.00 C ATOM 595 C GLN A 55 -8.237 -1.800 -9.901 1.00 10.00 C ATOM 596 O GLN A 55 -9.388 -2.240 -9.953 1.00 10.00 O ATOM 597 CB GLN A 55 -7.533 -2.167 -7.514 1.00 10.00 C ATOM 598 CG GLN A 55 -6.533 -2.754 -6.521 1.00 10.00 C ATOM 599 CD GLN A 55 -6.228 -4.220 -6.780 1.00 10.00 C ATOM 600 OE1 GLN A 55 -5.275 -4.555 -7.489 1.00 10.00 O ATOM 601 NE2 GLN A 55 -7.032 -5.106 -6.212 1.00 10.00 N ATOM 0 H GLN A 55 -5.509 -1.215 -8.665 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.194 -3.511 -9.150 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.595 -1.090 -7.357 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.521 -2.577 -7.303 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.606 -2.182 -6.567 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -6.926 -2.644 -5.510 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -7.810 -4.791 -5.632 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -6.873 -6.103 -6.354 1.00 10.00 H new ATOM 610 N GLY A 56 -7.833 -0.759 -10.619 1.00 10.00 N ATOM 611 CA GLY A 56 -8.732 -0.087 -11.536 1.00 10.00 C ATOM 612 C GLY A 56 -9.649 0.904 -10.846 1.00 10.00 C ATOM 613 O GLY A 56 -10.789 1.104 -11.267 1.00 10.00 O ATOM 0 H GLY A 56 -6.892 -0.367 -10.581 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.147 0.434 -12.294 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.335 -0.831 -12.056 1.00 10.00 H new ATOM 617 N VAL A 57 -9.153 1.528 -9.791 1.00 10.00 N ATOM 618 CA VAL A 57 -9.932 2.505 -9.045 1.00 10.00 C ATOM 619 C VAL A 57 -9.167 3.818 -8.942 1.00 10.00 C ATOM 620 O VAL A 57 -7.938 3.819 -8.903 1.00 10.00 O ATOM 621 CB VAL A 57 -10.281 2.006 -7.620 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.296 0.873 -7.676 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.030 1.567 -6.871 1.00 10.00 C ATOM 0 H VAL A 57 -8.211 1.376 -9.430 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.864 2.656 -9.590 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.726 2.839 -7.076 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -11.525 0.539 -6.664 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.208 1.225 -8.157 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -10.882 0.042 -8.247 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.305 1.222 -5.874 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -8.546 0.756 -7.415 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.342 2.408 -6.787 1.00 10.00 H new ATOM 633 N PRO A 58 -9.875 4.955 -8.926 1.00 10.00 N ATOM 634 CA PRO A 58 -9.238 6.267 -8.813 1.00 10.00 C ATOM 635 C PRO A 58 -8.671 6.482 -7.416 1.00 10.00 C ATOM 636 O PRO A 58 -9.121 5.857 -6.458 1.00 10.00 O ATOM 637 CB PRO A 58 -10.386 7.244 -9.083 1.00 10.00 C ATOM 638 CG PRO A 58 -11.615 6.500 -8.699 1.00 10.00 C ATOM 639 CD PRO A 58 -11.345 5.056 -9.020 1.00 10.00 C ATOM 0 HA PRO A 58 -8.399 6.389 -9.498 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -10.276 8.156 -8.496 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.415 7.541 -10.131 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.834 6.629 -7.639 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.481 6.867 -9.250 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.840 4.388 -8.315 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.703 4.791 -10.015 1.00 10.00 H new ATOM 647 N MET A 59 -7.686 7.353 -7.295 1.00 10.00 N ATOM 648 CA MET A 59 -7.085 7.625 -5.998 1.00 10.00 C ATOM 649 C MET A 59 -8.094 8.332 -5.093 1.00 10.00 C ATOM 650 O MET A 59 -9.030 8.960 -5.588 1.00 10.00 O ATOM 651 CB MET A 59 -5.815 8.465 -6.155 1.00 10.00 C ATOM 652 CG MET A 59 -4.848 8.321 -4.990 1.00 10.00 C ATOM 653 SD MET A 59 -3.345 9.296 -5.195 1.00 10.00 S ATOM 654 CE MET A 59 -2.408 8.739 -3.773 1.00 10.00 C ATOM 0 H MET A 59 -7.286 7.881 -8.071 1.00 10.00 H new ATOM 0 HA MET A 59 -6.805 6.678 -5.536 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.309 8.176 -7.076 1.00 10.00 H new ATOM 0 HB3 MET A 59 -6.093 9.514 -6.260 1.00 10.00 H new ATOM 0 HG2 MET A 59 -5.348 8.624 -4.070 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.580 7.271 -4.875 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.793 9.558 -3.399 1.00 10.00 H new ATOM 0 HE2 MET A 59 -3.093 8.413 -2.991 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.767 7.907 -4.063 1.00 10.00 H new ATOM 664 N ASN A 60 -7.909 8.180 -3.776 1.00 10.00 N ATOM 665 CA ASN A 60 -8.782 8.789 -2.758 1.00 10.00 C ATOM 666 C ASN A 60 -10.045 7.951 -2.538 1.00 10.00 C ATOM 667 O ASN A 60 -10.887 8.289 -1.711 1.00 10.00 O ATOM 668 CB ASN A 60 -9.155 10.240 -3.118 1.00 10.00 C ATOM 669 CG ASN A 60 -9.496 11.087 -1.904 1.00 10.00 C ATOM 670 OD1 ASN A 60 -8.620 11.691 -1.287 1.00 10.00 O ATOM 671 ND2 ASN A 60 -10.772 11.152 -1.563 1.00 10.00 N ATOM 0 H ASN A 60 -7.147 7.629 -3.382 1.00 10.00 H new ATOM 0 HA ASN A 60 -8.217 8.812 -1.826 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -8.324 10.700 -3.653 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -10.007 10.232 -3.798 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -11.058 11.717 -0.764 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -11.470 10.637 -2.099 1.00 10.00 H new ATOM 678 N SER A 61 -10.172 6.850 -3.271 1.00 10.00 N ATOM 679 CA SER A 61 -11.331 5.977 -3.124 1.00 10.00 C ATOM 680 C SER A 61 -11.084 4.964 -2.011 1.00 10.00 C ATOM 681 O SER A 61 -12.006 4.563 -1.299 1.00 10.00 O ATOM 682 CB SER A 61 -11.630 5.253 -4.439 1.00 10.00 C ATOM 683 OG SER A 61 -10.538 4.442 -4.835 1.00 10.00 O ATOM 0 H SER A 61 -9.493 6.543 -3.967 1.00 10.00 H new ATOM 0 HA SER A 61 -12.195 6.588 -2.863 1.00 10.00 H new ATOM 0 HB2 SER A 61 -12.522 4.637 -4.324 1.00 10.00 H new ATOM 0 HB3 SER A 61 -11.846 5.983 -5.219 1.00 10.00 H new ATOM 0 HG SER A 61 -10.137 4.808 -5.651 1.00 10.00 H new ATOM 689 N LEU A 62 -9.829 4.564 -1.863 1.00 10.00 N ATOM 690 CA LEU A 62 -9.442 3.600 -0.845 1.00 10.00 C ATOM 691 C LEU A 62 -8.451 4.223 0.130 1.00 10.00 C ATOM 692 O LEU A 62 -7.547 4.960 -0.274 1.00 10.00 O ATOM 693 CB LEU A 62 -8.815 2.359 -1.491 1.00 10.00 C ATOM 694 CG LEU A 62 -9.683 1.636 -2.527 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.914 0.481 -3.150 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.970 1.131 -1.892 1.00 10.00 C ATOM 0 H LEU A 62 -9.057 4.896 -2.441 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.339 3.304 -0.301 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.881 2.654 -1.970 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.559 1.652 -0.702 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.942 2.347 -3.311 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.544 -0.022 -3.883 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -8.019 0.863 -3.641 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.627 -0.227 -2.372 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.571 0.621 -2.645 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.730 0.436 -1.087 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.532 1.974 -1.489 1.00 10.00 H new ATOM 708 N ARG A 63 -8.625 3.928 1.408 1.00 10.00 N ATOM 709 CA ARG A 63 -7.745 4.444 2.441 1.00 10.00 C ATOM 710 C ARG A 63 -6.849 3.334 2.974 1.00 10.00 C ATOM 711 O ARG A 63 -7.319 2.246 3.313 1.00 10.00 O ATOM 712 CB ARG A 63 -8.547 5.081 3.585 1.00 10.00 C ATOM 713 CG ARG A 63 -9.533 4.138 4.262 1.00 10.00 C ATOM 714 CD ARG A 63 -10.171 4.785 5.480 1.00 10.00 C ATOM 715 NE ARG A 63 -11.225 3.952 6.061 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.530 4.165 5.881 1.00 10.00 C ATOM 717 NH1 ARG A 63 -12.952 5.168 5.122 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.416 3.372 6.468 1.00 10.00 N ATOM 0 H ARG A 63 -9.374 3.329 1.756 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.120 5.219 1.997 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -7.851 5.459 4.334 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.093 5.940 3.195 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.309 3.850 3.553 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -9.019 3.224 4.561 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.405 4.975 6.232 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.588 5.752 5.199 1.00 10.00 H new ATOM 0 HE ARG A 63 -10.945 3.160 6.639 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.277 5.785 4.670 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -13.952 5.323 4.991 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -13.100 2.601 7.056 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.414 3.533 6.332 1.00 10.00 H new ATOM 732 N PHE A 64 -5.558 3.611 3.024 1.00 10.00 N ATOM 733 CA PHE A 64 -4.585 2.649 3.512 1.00 10.00 C ATOM 734 C PHE A 64 -4.364 2.853 5.001 1.00 10.00 C ATOM 735 O PHE A 64 -3.960 3.935 5.432 1.00 10.00 O ATOM 736 CB PHE A 64 -3.262 2.803 2.761 1.00 10.00 C ATOM 737 CG PHE A 64 -3.372 2.549 1.285 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.780 3.555 0.422 1.00 10.00 C ATOM 739 CD2 PHE A 64 -3.070 1.304 0.760 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.883 3.322 -0.935 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.171 1.067 -0.596 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.579 2.078 -1.444 1.00 10.00 C ATOM 0 H PHE A 64 -5.157 4.501 2.730 1.00 10.00 H new ATOM 0 HA PHE A 64 -4.967 1.643 3.340 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.880 3.811 2.920 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.531 2.115 3.186 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -4.020 4.532 0.816 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.752 0.509 1.419 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -4.201 4.114 -1.597 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.931 0.092 -0.994 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.660 1.894 -2.505 1.00 10.00 H new ATOM 752 N LEU A 65 -4.632 1.819 5.778 1.00 10.00 N ATOM 753 CA LEU A 65 -4.477 1.892 7.221 1.00 10.00 C ATOM 754 C LEU A 65 -3.247 1.125 7.683 1.00 10.00 C ATOM 755 O LEU A 65 -2.999 -0.005 7.251 1.00 10.00 O ATOM 756 CB LEU A 65 -5.721 1.348 7.925 1.00 10.00 C ATOM 757 CG LEU A 65 -6.994 2.176 7.742 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.157 1.514 8.456 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.794 3.595 8.255 1.00 10.00 C ATOM 0 H LEU A 65 -4.959 0.916 5.434 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.348 2.942 7.485 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.910 0.338 7.563 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.509 1.270 8.991 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.220 2.228 6.677 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.057 2.113 8.318 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.317 0.518 8.044 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -7.933 1.435 9.520 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.712 4.165 8.115 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.543 3.567 9.315 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -5.983 4.071 7.703 1.00 10.00 H new ATOM 771 N PHE A 66 -2.487 1.755 8.558 1.00 10.00 N ATOM 772 CA PHE A 66 -1.286 1.168 9.115 1.00 10.00 C ATOM 773 C PHE A 66 -1.202 1.533 10.588 1.00 10.00 C ATOM 774 O PHE A 66 -1.028 2.705 10.929 1.00 10.00 O ATOM 775 CB PHE A 66 -0.048 1.672 8.364 1.00 10.00 C ATOM 776 CG PHE A 66 1.241 1.033 8.802 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.630 -0.193 8.291 1.00 10.00 C ATOM 778 CD2 PHE A 66 2.064 1.663 9.722 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.814 -0.780 8.688 1.00 10.00 C ATOM 780 CE2 PHE A 66 3.250 1.079 10.124 1.00 10.00 C ATOM 781 CZ PHE A 66 3.626 -0.144 9.606 1.00 10.00 C ATOM 0 H PHE A 66 -2.687 2.694 8.904 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.323 0.084 9.010 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.186 1.492 7.298 1.00 10.00 H new ATOM 0 HB3 PHE A 66 0.030 2.751 8.498 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.999 -0.696 7.573 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.775 2.621 10.129 1.00 10.00 H new ATOM 0 HE1 PHE A 66 3.106 -1.737 8.281 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.882 1.579 10.843 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.553 -0.602 9.918 1.00 10.00 H new ATOM 791 N GLU A 67 -1.367 0.531 11.449 1.00 10.00 N ATOM 792 CA GLU A 67 -1.317 0.728 12.897 1.00 10.00 C ATOM 793 C GLU A 67 -2.492 1.583 13.370 1.00 10.00 C ATOM 794 O GLU A 67 -2.397 2.285 14.377 1.00 10.00 O ATOM 795 CB GLU A 67 0.010 1.373 13.308 1.00 10.00 C ATOM 796 CG GLU A 67 1.200 0.432 13.223 1.00 10.00 C ATOM 797 CD GLU A 67 1.685 0.000 14.587 1.00 10.00 C ATOM 798 OE1 GLU A 67 1.068 -0.906 15.184 1.00 10.00 O ATOM 799 OE2 GLU A 67 2.672 0.578 15.080 1.00 10.00 O ATOM 0 H GLU A 67 -1.538 -0.434 11.166 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.390 -0.250 13.374 1.00 10.00 H new ATOM 0 HB2 GLU A 67 0.196 2.238 12.671 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.077 1.743 14.330 1.00 10.00 H new ATOM 0 HG2 GLU A 67 0.924 -0.448 12.642 1.00 10.00 H new ATOM 0 HG3 GLU A 67 2.013 0.924 12.689 1.00 10.00 H new ATOM 806 N GLY A 68 -3.599 1.522 12.638 1.00 10.00 N ATOM 807 CA GLY A 68 -4.773 2.293 13.001 1.00 10.00 C ATOM 808 C GLY A 68 -4.842 3.622 12.275 1.00 10.00 C ATOM 809 O GLY A 68 -5.927 4.112 11.960 1.00 10.00 O ATOM 0 H GLY A 68 -3.704 0.952 11.799 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.668 1.713 12.776 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -4.769 2.470 14.077 1.00 10.00 H new ATOM 813 N GLN A 69 -3.683 4.209 12.013 1.00 10.00 N ATOM 814 CA GLN A 69 -3.609 5.487 11.318 1.00 10.00 C ATOM 815 C GLN A 69 -3.671 5.275 9.812 1.00 10.00 C ATOM 816 O GLN A 69 -3.461 4.166 9.327 1.00 10.00 O ATOM 817 CB GLN A 69 -2.318 6.221 11.684 1.00 10.00 C ATOM 818 CG GLN A 69 -2.350 6.858 13.063 1.00 10.00 C ATOM 819 CD GLN A 69 -1.169 7.779 13.303 1.00 10.00 C ATOM 820 OE1 GLN A 69 -0.062 7.529 12.822 1.00 10.00 O ATOM 821 NE2 GLN A 69 -1.395 8.861 14.032 1.00 10.00 N ATOM 0 H GLN A 69 -2.777 3.819 12.272 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.460 6.094 11.627 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.485 5.519 11.636 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -2.126 6.994 10.940 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -3.276 7.422 13.178 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -2.357 6.075 13.822 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -2.325 9.034 14.413 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -0.639 9.522 14.212 1.00 10.00 H new ATOM 830 N ARG A 70 -3.962 6.332 9.073 1.00 10.00 N ATOM 831 CA ARG A 70 -4.037 6.231 7.624 1.00 10.00 C ATOM 832 C ARG A 70 -2.815 6.868 6.979 1.00 10.00 C ATOM 833 O ARG A 70 -2.418 7.978 7.331 1.00 10.00 O ATOM 834 CB ARG A 70 -5.330 6.852 7.085 1.00 10.00 C ATOM 835 CG ARG A 70 -5.604 8.267 7.569 1.00 10.00 C ATOM 836 CD ARG A 70 -6.962 8.758 7.095 1.00 10.00 C ATOM 837 NE ARG A 70 -7.003 8.956 5.644 1.00 10.00 N ATOM 838 CZ ARG A 70 -8.105 8.819 4.901 1.00 10.00 C ATOM 839 NH1 ARG A 70 -9.248 8.427 5.454 1.00 10.00 N ATOM 840 NH2 ARG A 70 -8.065 9.063 3.598 1.00 10.00 N ATOM 0 H ARG A 70 -4.149 7.262 9.447 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.050 5.173 7.363 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.288 6.857 5.996 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.169 6.216 7.369 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.564 8.296 8.658 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.825 8.936 7.204 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.728 8.038 7.384 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -7.202 9.696 7.595 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.137 9.214 5.172 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -9.289 8.228 6.454 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -10.084 8.325 4.879 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.191 9.356 3.161 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -8.908 8.958 3.033 1.00 10.00 H new ATOM 854 N ILE A 71 -2.228 6.143 6.040 1.00 10.00 N ATOM 855 CA ILE A 71 -1.035 6.593 5.332 1.00 10.00 C ATOM 856 C ILE A 71 -1.317 7.834 4.490 1.00 10.00 C ATOM 857 O ILE A 71 -2.234 7.839 3.665 1.00 10.00 O ATOM 858 CB ILE A 71 -0.490 5.474 4.413 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.132 4.228 5.233 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.719 5.959 3.622 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.990 4.450 6.225 1.00 10.00 C ATOM 0 H ILE A 71 -2.563 5.226 5.746 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.290 6.843 6.088 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.274 5.207 3.704 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.018 3.892 5.771 1.00 10.00 H new ATOM 0 HG13 ILE A 71 0.151 3.426 4.552 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.083 5.154 2.984 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.432 6.810 3.004 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.508 6.260 4.311 1.00 10.00 H new ATOM 0 HD11 ILE A 71 1.185 3.524 6.766 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.891 4.756 5.693 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.703 5.229 6.931 1.00 10.00 H new ATOM 873 N ALA A 72 -0.532 8.881 4.699 1.00 10.00 N ATOM 874 CA ALA A 72 -0.693 10.112 3.943 1.00 10.00 C ATOM 875 C ALA A 72 0.119 10.042 2.653 1.00 10.00 C ATOM 876 O ALA A 72 0.884 9.099 2.445 1.00 10.00 O ATOM 877 CB ALA A 72 -0.281 11.317 4.776 1.00 10.00 C ATOM 0 H ALA A 72 0.222 8.902 5.386 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.746 10.228 3.687 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.410 12.226 4.189 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.902 11.371 5.670 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.765 11.218 5.066 1.00 10.00 H new ATOM 883 N ASP A 73 -0.044 11.035 1.795 1.00 10.00 N ATOM 884 CA ASP A 73 0.667 11.068 0.517 1.00 10.00 C ATOM 885 C ASP A 73 2.107 11.534 0.692 1.00 10.00 C ATOM 886 O ASP A 73 2.917 11.444 -0.229 1.00 10.00 O ATOM 887 CB ASP A 73 -0.056 11.986 -0.463 1.00 10.00 C ATOM 888 CG ASP A 73 -1.177 11.283 -1.201 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.642 10.227 -0.718 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.592 11.785 -2.268 1.00 10.00 O ATOM 0 H ASP A 73 -0.661 11.831 1.955 1.00 10.00 H new ATOM 0 HA ASP A 73 0.684 10.053 0.120 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.462 12.841 0.078 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.661 12.377 -1.185 1.00 10.00 H new ATOM 895 N ASN A 74 2.416 12.030 1.878 1.00 10.00 N ATOM 896 CA ASN A 74 3.756 12.516 2.187 1.00 10.00 C ATOM 897 C ASN A 74 4.466 11.555 3.134 1.00 10.00 C ATOM 898 O ASN A 74 5.469 11.904 3.758 1.00 10.00 O ATOM 899 CB ASN A 74 3.677 13.908 2.825 1.00 10.00 C ATOM 900 CG ASN A 74 2.824 13.919 4.079 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.599 13.994 4.007 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.459 13.840 5.236 1.00 10.00 N ATOM 0 H ASN A 74 1.754 12.108 2.650 1.00 10.00 H new ATOM 0 HA ASN A 74 4.324 12.579 1.259 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.682 14.251 3.069 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.266 14.613 2.103 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.931 13.840 6.109 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.477 13.779 5.256 1.00 10.00 H new ATOM 909 N HIS A 75 3.944 10.342 3.226 1.00 10.00 N ATOM 910 CA HIS A 75 4.511 9.332 4.104 1.00 10.00 C ATOM 911 C HIS A 75 5.546 8.486 3.377 1.00 10.00 C ATOM 912 O HIS A 75 5.430 8.232 2.174 1.00 10.00 O ATOM 913 CB HIS A 75 3.405 8.432 4.661 1.00 10.00 C ATOM 914 CG HIS A 75 3.020 8.756 6.069 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.833 9.376 6.361 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.695 8.525 7.220 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.810 9.515 7.676 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.919 9.014 8.240 1.00 10.00 N ATOM 0 H HIS A 75 3.126 10.033 2.701 1.00 10.00 H new ATOM 0 HA HIS A 75 5.007 9.847 4.927 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.524 8.517 4.024 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.735 7.394 4.613 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.659 8.048 7.316 1.00 10.00 H new ATOM 0 HE1 HIS A 75 1.001 9.974 8.226 1.00 10.00 H new ATOM 0 HE2 HIS A 75 3.142 8.999 9.235 1.00 10.00 H new ATOM 926 N THR A 76 6.561 8.069 4.113 1.00 10.00 N ATOM 927 CA THR A 76 7.618 7.235 3.577 1.00 10.00 C ATOM 928 C THR A 76 7.750 5.980 4.438 1.00 10.00 C ATOM 929 O THR A 76 7.517 6.040 5.645 1.00 10.00 O ATOM 930 CB THR A 76 8.966 7.990 3.549 1.00 10.00 C ATOM 931 OG1 THR A 76 8.778 9.362 3.933 1.00 10.00 O ATOM 932 CG2 THR A 76 9.592 7.940 2.163 1.00 10.00 C ATOM 0 H THR A 76 6.674 8.300 5.100 1.00 10.00 H new ATOM 0 HA THR A 76 7.361 6.964 2.553 1.00 10.00 H new ATOM 0 HB THR A 76 9.635 7.500 4.256 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.604 9.411 4.896 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.539 8.479 2.172 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.768 6.902 1.880 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.918 8.403 1.442 1.00 10.00 H new ATOM 940 N PRO A 77 8.123 4.826 3.851 1.00 10.00 N ATOM 941 CA PRO A 77 8.274 3.566 4.604 1.00 10.00 C ATOM 942 C PRO A 77 9.355 3.640 5.685 1.00 10.00 C ATOM 943 O PRO A 77 9.484 2.741 6.517 1.00 10.00 O ATOM 944 CB PRO A 77 8.670 2.543 3.529 1.00 10.00 C ATOM 945 CG PRO A 77 8.267 3.157 2.234 1.00 10.00 C ATOM 946 CD PRO A 77 8.406 4.639 2.417 1.00 10.00 C ATOM 0 HA PRO A 77 7.358 3.315 5.139 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.741 2.342 3.553 1.00 10.00 H new ATOM 0 HB3 PRO A 77 8.164 1.591 3.687 1.00 10.00 H new ATOM 0 HG2 PRO A 77 8.901 2.803 1.421 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.242 2.890 1.978 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.406 4.986 2.155 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.703 5.190 1.792 1.00 10.00 H new ATOM 954 N LYS A 78 10.118 4.723 5.669 1.00 10.00 N ATOM 955 CA LYS A 78 11.186 4.935 6.634 1.00 10.00 C ATOM 956 C LYS A 78 10.612 5.290 8.007 1.00 10.00 C ATOM 957 O LYS A 78 11.152 4.887 9.038 1.00 10.00 O ATOM 958 CB LYS A 78 12.120 6.044 6.127 1.00 10.00 C ATOM 959 CG LYS A 78 13.112 6.565 7.163 1.00 10.00 C ATOM 960 CD LYS A 78 14.077 5.486 7.636 1.00 10.00 C ATOM 961 CE LYS A 78 14.834 4.854 6.478 1.00 10.00 C ATOM 962 NZ LYS A 78 16.093 4.208 6.928 1.00 10.00 N ATOM 0 H LYS A 78 10.015 5.477 4.989 1.00 10.00 H new ATOM 0 HA LYS A 78 11.757 4.013 6.743 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.676 5.668 5.268 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.513 6.878 5.773 1.00 10.00 H new ATOM 0 HG2 LYS A 78 13.678 7.393 6.736 1.00 10.00 H new ATOM 0 HG3 LYS A 78 12.565 6.960 8.019 1.00 10.00 H new ATOM 0 HD2 LYS A 78 14.787 5.918 8.341 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.524 4.715 8.172 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.200 4.114 5.990 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.063 5.617 5.734 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.580 3.789 6.110 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 16.709 4.919 7.371 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 15.873 3.463 7.619 1.00 10.00 H new ATOM 976 N GLU A 79 9.510 6.028 8.018 1.00 10.00 N ATOM 977 CA GLU A 79 8.880 6.431 9.266 1.00 10.00 C ATOM 978 C GLU A 79 7.801 5.433 9.670 1.00 10.00 C ATOM 979 O GLU A 79 7.578 4.441 8.971 1.00 10.00 O ATOM 980 CB GLU A 79 8.294 7.838 9.138 1.00 10.00 C ATOM 981 CG GLU A 79 7.227 7.962 8.065 1.00 10.00 C ATOM 982 CD GLU A 79 7.162 9.352 7.476 1.00 10.00 C ATOM 983 OE1 GLU A 79 6.758 10.290 8.195 1.00 10.00 O ATOM 984 OE2 GLU A 79 7.523 9.516 6.292 1.00 10.00 O ATOM 0 H GLU A 79 9.035 6.359 7.178 1.00 10.00 H new ATOM 0 HA GLU A 79 9.640 6.445 10.047 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.868 8.133 10.097 1.00 10.00 H new ATOM 0 HB3 GLU A 79 9.100 8.539 8.919 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.429 7.243 7.271 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.257 7.704 8.490 1.00 10.00 H new ATOM 991 N LEU A 80 7.159 5.693 10.814 1.00 10.00 N ATOM 992 CA LEU A 80 6.096 4.838 11.359 1.00 10.00 C ATOM 993 C LEU A 80 6.659 3.530 11.914 1.00 10.00 C ATOM 994 O LEU A 80 6.280 3.093 13.002 1.00 10.00 O ATOM 995 CB LEU A 80 5.010 4.553 10.314 1.00 10.00 C ATOM 996 CG LEU A 80 3.879 5.581 10.257 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.040 5.382 9.007 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.005 5.490 11.500 1.00 10.00 C ATOM 0 H LEU A 80 7.363 6.508 11.393 1.00 10.00 H new ATOM 0 HA LEU A 80 5.638 5.387 12.182 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.479 4.497 9.332 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.579 3.573 10.518 1.00 10.00 H new ATOM 0 HG LEU A 80 4.325 6.575 10.222 1.00 10.00 H new ATOM 0 HD11 LEU A 80 2.240 6.122 8.984 1.00 10.00 H new ATOM 0 HD12 LEU A 80 3.669 5.499 8.124 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.608 4.381 9.014 1.00 10.00 H new ATOM 0 HD21 LEU A 80 2.207 6.230 11.439 1.00 10.00 H new ATOM 0 HD22 LEU A 80 2.571 4.493 11.567 1.00 10.00 H new ATOM 0 HD23 LEU A 80 3.611 5.682 12.386 1.00 10.00 H new ATOM 1010 N GLY A 81 7.560 2.913 11.168 1.00 10.00 N ATOM 1011 CA GLY A 81 8.166 1.676 11.604 1.00 10.00 C ATOM 1012 C GLY A 81 7.830 0.516 10.692 1.00 10.00 C ATOM 1013 O GLY A 81 7.585 -0.593 11.159 1.00 10.00 O ATOM 0 H GLY A 81 7.884 3.250 10.262 1.00 10.00 H new ATOM 0 HA2 GLY A 81 9.248 1.800 11.646 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.832 1.448 12.616 1.00 10.00 H new ATOM 1017 N MET A 82 7.819 0.770 9.388 1.00 10.00 N ATOM 1018 CA MET A 82 7.511 -0.269 8.410 1.00 10.00 C ATOM 1019 C MET A 82 8.672 -1.250 8.284 1.00 10.00 C ATOM 1020 O MET A 82 9.837 -0.847 8.266 1.00 10.00 O ATOM 1021 CB MET A 82 7.199 0.350 7.044 1.00 10.00 C ATOM 1022 CG MET A 82 5.787 0.902 6.933 1.00 10.00 C ATOM 1023 SD MET A 82 5.417 1.551 5.291 1.00 10.00 S ATOM 1024 CE MET A 82 3.645 1.777 5.411 1.00 10.00 C ATOM 0 H MET A 82 8.019 1.685 8.983 1.00 10.00 H new ATOM 0 HA MET A 82 6.631 -0.810 8.758 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.910 1.152 6.847 1.00 10.00 H new ATOM 0 HB3 MET A 82 7.347 -0.404 6.271 1.00 10.00 H new ATOM 0 HG2 MET A 82 5.074 0.115 7.177 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.652 1.693 7.670 1.00 10.00 H new ATOM 0 HE1 MET A 82 3.264 2.175 4.470 1.00 10.00 H new ATOM 0 HE2 MET A 82 3.169 0.819 5.619 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.421 2.476 6.217 1.00 10.00 H new ATOM 1034 N GLU A 83 8.352 -2.533 8.213 1.00 10.00 N ATOM 1035 CA GLU A 83 9.364 -3.571 8.093 1.00 10.00 C ATOM 1036 C GLU A 83 8.993 -4.574 7.006 1.00 10.00 C ATOM 1037 O GLU A 83 7.943 -4.461 6.375 1.00 10.00 O ATOM 1038 CB GLU A 83 9.537 -4.289 9.430 1.00 10.00 C ATOM 1039 CG GLU A 83 10.589 -3.657 10.322 1.00 10.00 C ATOM 1040 CD GLU A 83 11.806 -4.541 10.483 1.00 10.00 C ATOM 1041 OE1 GLU A 83 12.402 -4.934 9.457 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.177 -4.846 11.636 1.00 10.00 O ATOM 0 H GLU A 83 7.394 -2.882 8.237 1.00 10.00 H new ATOM 0 HA GLU A 83 10.306 -3.099 7.814 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.582 -4.297 9.956 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.806 -5.329 9.243 1.00 10.00 H new ATOM 0 HG2 GLU A 83 10.891 -2.698 9.901 1.00 10.00 H new ATOM 0 HG3 GLU A 83 10.158 -3.453 11.302 1.00 10.00 H new ATOM 1049 N GLU A 84 9.865 -5.551 6.797 1.00 10.00 N ATOM 1050 CA GLU A 84 9.649 -6.587 5.795 1.00 10.00 C ATOM 1051 C GLU A 84 8.451 -7.459 6.172 1.00 10.00 C ATOM 1052 O GLU A 84 8.281 -7.812 7.343 1.00 10.00 O ATOM 1053 CB GLU A 84 10.915 -7.442 5.666 1.00 10.00 C ATOM 1054 CG GLU A 84 10.789 -8.619 4.710 1.00 10.00 C ATOM 1055 CD GLU A 84 10.627 -8.205 3.263 1.00 10.00 C ATOM 1056 OE1 GLU A 84 9.497 -7.852 2.867 1.00 10.00 O ATOM 1057 OE2 GLU A 84 11.617 -8.275 2.504 1.00 10.00 O ATOM 0 H GLU A 84 10.739 -5.648 7.315 1.00 10.00 H new ATOM 0 HA GLU A 84 9.434 -6.116 4.836 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.735 -6.806 5.332 1.00 10.00 H new ATOM 0 HB3 GLU A 84 11.185 -7.819 6.652 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.674 -9.249 4.803 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.933 -9.226 5.004 1.00 10.00 H new ATOM 1064 N GLU A 85 7.626 -7.790 5.172 1.00 10.00 N ATOM 1065 CA GLU A 85 6.430 -8.615 5.366 1.00 10.00 C ATOM 1066 C GLU A 85 5.474 -7.960 6.362 1.00 10.00 C ATOM 1067 O GLU A 85 4.854 -8.636 7.187 1.00 10.00 O ATOM 1068 CB GLU A 85 6.805 -10.032 5.835 1.00 10.00 C ATOM 1069 CG GLU A 85 7.420 -10.899 4.743 1.00 10.00 C ATOM 1070 CD GLU A 85 6.434 -11.256 3.647 1.00 10.00 C ATOM 1071 OE1 GLU A 85 5.258 -11.536 3.963 1.00 10.00 O ATOM 1072 OE2 GLU A 85 6.835 -11.269 2.463 1.00 10.00 O ATOM 0 H GLU A 85 7.769 -7.493 4.207 1.00 10.00 H new ATOM 0 HA GLU A 85 5.924 -8.698 4.404 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.508 -9.956 6.664 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.912 -10.526 6.218 1.00 10.00 H new ATOM 0 HG2 GLU A 85 8.269 -10.374 4.304 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.807 -11.815 5.189 1.00 10.00 H new ATOM 1079 N ASP A 86 5.352 -6.641 6.276 1.00 10.00 N ATOM 1080 CA ASP A 86 4.479 -5.898 7.176 1.00 10.00 C ATOM 1081 C ASP A 86 3.022 -6.026 6.752 1.00 10.00 C ATOM 1082 O ASP A 86 2.727 -6.404 5.621 1.00 10.00 O ATOM 1083 CB ASP A 86 4.873 -4.424 7.226 1.00 10.00 C ATOM 1084 CG ASP A 86 4.823 -3.864 8.631 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.910 -4.247 9.398 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.702 -3.051 8.982 1.00 10.00 O ATOM 0 H ASP A 86 5.845 -6.065 5.594 1.00 10.00 H new ATOM 0 HA ASP A 86 4.594 -6.327 8.172 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.880 -4.305 6.826 1.00 10.00 H new ATOM 0 HB3 ASP A 86 4.205 -3.850 6.584 1.00 10.00 H new ATOM 1091 N VAL A 87 2.114 -5.694 7.657 1.00 10.00 N ATOM 1092 CA VAL A 87 0.689 -5.795 7.377 1.00 10.00 C ATOM 1093 C VAL A 87 0.052 -4.415 7.235 1.00 10.00 C ATOM 1094 O VAL A 87 0.197 -3.555 8.108 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.041 -6.582 8.484 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.494 -6.833 8.108 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.671 -7.895 8.766 1.00 10.00 C ATOM 0 H VAL A 87 2.338 -5.352 8.592 1.00 10.00 H new ATOM 0 HA VAL A 87 0.587 -6.330 6.433 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.026 -5.978 9.392 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -1.985 -7.390 8.906 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.003 -5.880 7.964 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.536 -7.410 7.184 1.00 10.00 H new ATOM 0 HG21 VAL A 87 0.141 -8.436 9.550 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.692 -8.499 7.859 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.691 -7.693 9.091 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.657 -4.220 6.137 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.331 -2.962 5.862 1.00 10.00 C ATOM 1109 C ILE A 88 -2.758 -3.241 5.382 1.00 10.00 C ATOM 1110 O ILE A 88 -2.992 -4.180 4.622 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.543 -2.125 4.822 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.260 -0.808 4.516 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.311 -2.922 3.546 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.427 0.154 3.693 1.00 10.00 C ATOM 0 H ILE A 88 -0.782 -4.927 5.412 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.377 -2.376 6.780 1.00 10.00 H new ATOM 0 HB ILE A 88 0.428 -1.886 5.255 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.186 -1.023 3.983 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.536 -0.327 5.454 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.244 -2.313 2.832 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.261 -3.821 3.777 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.271 -3.204 3.113 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -0.996 1.066 3.513 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.488 0.398 4.234 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.173 -0.309 2.740 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.712 -2.450 5.849 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.109 -2.646 5.478 1.00 10.00 C ATOM 1128 C GLU A 89 -5.570 -1.604 4.471 1.00 10.00 C ATOM 1129 O GLU A 89 -4.999 -0.517 4.381 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.002 -2.571 6.714 1.00 10.00 C ATOM 1131 CG GLU A 89 -5.741 -3.662 7.734 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.556 -3.468 8.995 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.635 -4.089 9.118 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -6.123 -2.689 9.869 1.00 10.00 O ATOM 0 H GLU A 89 -3.547 -1.668 6.483 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.188 -3.633 5.022 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.862 -1.601 7.192 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.044 -2.624 6.400 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -5.977 -4.632 7.296 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -4.681 -3.676 7.986 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.609 -1.946 3.723 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.173 -1.044 2.737 1.00 10.00 C ATOM 1143 C VAL A 90 -8.701 -1.101 2.794 1.00 10.00 C ATOM 1144 O VAL A 90 -9.300 -2.171 2.693 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.663 -1.363 1.307 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -7.039 -2.777 0.878 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.181 -0.338 0.309 1.00 10.00 C ATOM 0 H VAL A 90 -7.079 -2.849 3.783 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.844 -0.033 2.976 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.575 -1.306 1.325 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.665 -2.963 -0.129 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.598 -3.496 1.568 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -8.124 -2.884 0.887 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.811 -0.581 -0.687 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.271 -0.353 0.305 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.833 0.655 0.593 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.321 0.047 3.008 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.772 0.128 3.089 1.00 10.00 C ATOM 1159 C TYR A 91 -11.279 1.247 2.195 1.00 10.00 C ATOM 1160 O TYR A 91 -10.548 2.188 1.903 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.212 0.368 4.536 1.00 10.00 C ATOM 1162 CG TYR A 91 -10.898 -0.786 5.465 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.765 -1.864 5.580 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -9.734 -0.797 6.224 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.482 -2.920 6.426 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.443 -1.850 7.069 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.320 -2.908 7.168 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.038 -3.959 8.011 1.00 10.00 O ATOM 0 H TYR A 91 -8.842 0.939 3.129 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.196 -0.817 2.750 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.724 1.268 4.911 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.285 0.556 4.554 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.675 -1.878 4.999 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.045 0.032 6.152 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -12.168 -3.750 6.505 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -8.532 -1.844 7.649 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.082 -3.957 8.227 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.523 1.145 1.760 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.103 2.162 0.894 1.00 10.00 C ATOM 1180 C GLN A 92 -13.515 3.388 1.698 1.00 10.00 C ATOM 1181 O GLN A 92 -14.021 3.271 2.816 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.313 1.605 0.140 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.739 2.465 -1.041 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.232 2.408 -1.292 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -16.718 1.551 -2.030 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -16.967 3.328 -0.689 1.00 10.00 N ATOM 0 H GLN A 92 -13.150 0.374 1.989 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.342 2.457 0.171 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -14.079 0.602 -0.217 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.150 1.510 0.831 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.444 3.498 -0.859 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -14.211 2.135 -1.936 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.523 4.020 -0.085 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.977 3.345 -0.828 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.288 4.559 1.123 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.640 5.813 1.769 1.00 10.00 C ATOM 1197 C GLU A 93 -15.143 6.051 1.684 1.00 10.00 C ATOM 1198 O GLU A 93 -15.820 5.511 0.803 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.886 6.976 1.121 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.412 7.033 1.497 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.171 7.689 2.842 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -11.549 7.102 3.879 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.594 8.793 2.874 1.00 10.00 O ATOM 0 H GLU A 93 -12.859 4.666 0.204 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.354 5.752 2.819 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.973 6.895 0.037 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -13.362 7.913 1.410 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -11.007 6.021 1.514 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.867 7.581 0.728 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.650 6.874 2.592 1.00 10.00 N ATOM 1211 CA GLN A 94 -17.072 7.194 2.649 1.00 10.00 C ATOM 1212 C GLN A 94 -17.510 7.978 1.412 1.00 10.00 C ATOM 1213 O GLN A 94 -18.675 7.931 1.009 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.360 8.000 3.918 1.00 10.00 C ATOM 1215 CG GLN A 94 -18.834 8.117 4.260 1.00 10.00 C ATOM 1216 CD GLN A 94 -19.055 8.412 5.729 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -19.066 9.568 6.148 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -19.218 7.370 6.525 1.00 10.00 N ATOM 0 H GLN A 94 -15.090 7.338 3.308 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.639 6.264 2.671 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -16.840 7.535 4.756 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -16.945 9.001 3.801 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -19.283 8.908 3.660 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -19.342 7.189 3.996 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -19.203 6.426 6.139 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -19.359 7.510 7.525 1.00 10.00 H new ATOM 1227 N THR A 95 -16.571 8.685 0.804 1.00 10.00 N ATOM 1228 CA THR A 95 -16.859 9.477 -0.381 1.00 10.00 C ATOM 1229 C THR A 95 -16.940 8.597 -1.625 1.00 10.00 C ATOM 1230 O THR A 95 -17.728 8.856 -2.533 1.00 10.00 O ATOM 1231 CB THR A 95 -15.778 10.549 -0.591 1.00 10.00 C ATOM 1232 OG1 THR A 95 -14.480 9.944 -0.514 1.00 10.00 O ATOM 1233 CG2 THR A 95 -15.898 11.645 0.457 1.00 10.00 C ATOM 0 H THR A 95 -15.600 8.727 1.113 1.00 10.00 H new ATOM 0 HA THR A 95 -17.824 9.959 -0.225 1.00 10.00 H new ATOM 0 HB THR A 95 -15.916 10.996 -1.576 1.00 10.00 H new ATOM 0 HG1 THR A 95 -13.792 10.628 -0.650 1.00 10.00 H new ATOM 0 HG21 THR A 95 -15.124 12.394 0.291 1.00 10.00 H new ATOM 0 HG22 THR A 95 -16.879 12.114 0.382 1.00 10.00 H new ATOM 0 HG23 THR A 95 -15.778 11.213 1.451 1.00 10.00 H new ATOM 1241 N GLY A 96 -16.128 7.550 -1.649 1.00 10.00 N ATOM 1242 CA GLY A 96 -16.106 6.654 -2.788 1.00 10.00 C ATOM 1243 C GLY A 96 -15.089 7.090 -3.820 1.00 10.00 C ATOM 1244 O GLY A 96 -14.888 6.420 -4.834 1.00 10.00 O ATOM 0 H GLY A 96 -15.482 7.304 -0.898 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -15.874 5.643 -2.452 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -17.096 6.619 -3.244 1.00 10.00 H new ATOM 1286 N ARG B 359 -1.859 -14.960 -2.411 1.00 10.00 N ATOM 1287 CA ARG B 359 -0.834 -13.936 -2.339 1.00 10.00 C ATOM 1288 C ARG B 359 -0.289 -13.610 -3.724 1.00 10.00 C ATOM 1289 O ARG B 359 0.070 -14.507 -4.491 1.00 10.00 O ATOM 1290 CB ARG B 359 0.299 -14.372 -1.399 1.00 10.00 C ATOM 1291 CG ARG B 359 0.803 -15.789 -1.645 1.00 10.00 C ATOM 1292 CD ARG B 359 1.469 -16.364 -0.406 1.00 10.00 C ATOM 1293 NE ARG B 359 0.509 -16.604 0.672 1.00 10.00 N ATOM 1294 CZ ARG B 359 0.709 -17.457 1.674 1.00 10.00 C ATOM 1295 NH1 ARG B 359 1.802 -18.208 1.709 1.00 10.00 N ATOM 1296 NH2 ARG B 359 -0.196 -17.561 2.638 1.00 10.00 N ATOM 0 HA ARG B 359 -1.288 -13.031 -1.935 1.00 10.00 H new ATOM 0 HB2 ARG B 359 1.133 -13.678 -1.506 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.049 -14.296 -0.369 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -0.030 -16.427 -1.941 1.00 10.00 H new ATOM 0 HG3 ARG B 359 1.512 -15.786 -2.473 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.967 -17.299 -0.663 1.00 10.00 H new ATOM 0 HD3 ARG B 359 2.241 -15.678 -0.058 1.00 10.00 H new ATOM 0 HE ARG B 359 -0.369 -16.085 0.654 1.00 10.00 H new ATOM 0 HH11 ARG B 359 2.496 -18.134 0.965 1.00 10.00 H new ATOM 0 HH12 ARG B 359 1.949 -18.860 2.480 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -1.040 -16.989 2.609 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -0.048 -18.213 3.408 1.00 10.00 H new ATOM 1310 N ASP B 360 -0.245 -12.321 -4.040 1.00 10.00 N ATOM 1311 CA ASP B 360 0.254 -11.865 -5.329 1.00 10.00 C ATOM 1312 C ASP B 360 1.252 -10.727 -5.151 1.00 10.00 C ATOM 1313 O ASP B 360 0.898 -9.657 -4.656 1.00 10.00 O ATOM 1314 CB ASP B 360 -0.898 -11.403 -6.221 1.00 10.00 C ATOM 1315 CG ASP B 360 -0.433 -11.067 -7.625 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -0.571 -9.902 -8.043 1.00 10.00 O ATOM 1317 OD2 ASP B 360 0.074 -11.973 -8.322 1.00 10.00 O ATOM 0 H ASP B 360 -0.550 -11.572 -3.418 1.00 10.00 H new ATOM 0 HA ASP B 360 0.758 -12.705 -5.807 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -1.656 -12.185 -6.268 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.371 -10.527 -5.777 1.00 10.00 H new ATOM 1322 N PRO B 361 2.517 -10.956 -5.536 1.00 10.00 N ATOM 1323 CA PRO B 361 3.571 -9.946 -5.425 1.00 10.00 C ATOM 1324 C PRO B 361 3.485 -8.881 -6.522 1.00 10.00 C ATOM 1325 O PRO B 361 3.404 -9.200 -7.710 1.00 10.00 O ATOM 1326 CB PRO B 361 4.854 -10.764 -5.568 1.00 10.00 C ATOM 1327 CG PRO B 361 4.470 -11.948 -6.387 1.00 10.00 C ATOM 1328 CD PRO B 361 3.023 -12.231 -6.084 1.00 10.00 C ATOM 0 HA PRO B 361 3.504 -9.388 -4.491 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.638 -10.185 -6.055 1.00 10.00 H new ATOM 0 HB3 PRO B 361 5.239 -11.066 -4.594 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.611 -11.747 -7.449 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.093 -12.808 -6.140 1.00 10.00 H new ATOM 0 HD2 PRO B 361 2.477 -12.525 -6.981 1.00 10.00 H new ATOM 0 HD3 PRO B 361 2.917 -13.044 -5.366 1.00 10.00 H new ATOM 1336 N ILE B 362 3.498 -7.619 -6.118 1.00 10.00 N ATOM 1337 CA ILE B 362 3.425 -6.511 -7.063 1.00 10.00 C ATOM 1338 C ILE B 362 4.726 -5.724 -7.089 1.00 10.00 C ATOM 1339 O ILE B 362 5.222 -5.302 -6.048 1.00 10.00 O ATOM 1340 CB ILE B 362 2.278 -5.532 -6.734 1.00 10.00 C ATOM 1341 CG1 ILE B 362 1.022 -6.290 -6.317 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.984 -4.635 -7.932 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.076 -5.387 -5.804 1.00 10.00 C ATOM 0 H ILE B 362 3.559 -7.335 -5.140 1.00 10.00 H new ATOM 0 HA ILE B 362 3.238 -6.963 -8.037 1.00 10.00 H new ATOM 0 HB ILE B 362 2.593 -4.906 -5.899 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.648 -6.857 -7.169 1.00 10.00 H new ATOM 0 HG13 ILE B 362 1.281 -7.012 -5.543 1.00 10.00 H new ATOM 0 HG21 ILE B 362 1.173 -3.951 -7.684 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.876 -4.063 -8.186 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.692 -5.249 -8.784 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -0.941 -5.989 -5.524 1.00 10.00 H new ATOM 0 HD12 ILE B 362 0.281 -4.838 -4.933 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.362 -4.682 -6.585 1.00 10.00 H new ATOM 1355 N VAL B 363 5.273 -5.543 -8.281 1.00 10.00 N ATOM 1356 CA VAL B 363 6.504 -4.790 -8.458 1.00 10.00 C ATOM 1357 C VAL B 363 6.242 -3.573 -9.338 1.00 10.00 C ATOM 1358 O VAL B 363 5.789 -3.708 -10.477 1.00 10.00 O ATOM 1359 CB VAL B 363 7.611 -5.647 -9.107 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.937 -4.899 -9.122 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.758 -6.980 -8.389 1.00 10.00 C ATOM 0 H VAL B 363 4.879 -5.911 -9.147 1.00 10.00 H new ATOM 0 HA VAL B 363 6.844 -4.480 -7.470 1.00 10.00 H new ATOM 0 HB VAL B 363 7.319 -5.846 -10.138 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.702 -5.523 -9.584 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.828 -3.977 -9.692 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.232 -4.661 -8.100 1.00 10.00 H new ATOM 0 HG21 VAL B 363 8.544 -7.565 -8.866 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.018 -6.804 -7.345 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.817 -7.527 -8.441 1.00 10.00 H new ATOM 1371 N ILE B 364 6.500 -2.390 -8.801 1.00 10.00 N ATOM 1372 CA ILE B 364 6.290 -1.153 -9.543 1.00 10.00 C ATOM 1373 C ILE B 364 7.621 -0.542 -9.957 1.00 10.00 C ATOM 1374 O ILE B 364 8.688 -1.071 -9.635 1.00 10.00 O ATOM 1375 CB ILE B 364 5.493 -0.117 -8.723 1.00 10.00 C ATOM 1376 CG1 ILE B 364 6.142 0.110 -7.352 1.00 10.00 C ATOM 1377 CG2 ILE B 364 4.044 -0.555 -8.574 1.00 10.00 C ATOM 1378 CD1 ILE B 364 6.703 1.506 -7.178 1.00 10.00 C ATOM 0 H ILE B 364 6.855 -2.259 -7.854 1.00 10.00 H new ATOM 0 HA ILE B 364 5.711 -1.412 -10.429 1.00 10.00 H new ATOM 0 HB ILE B 364 5.508 0.831 -9.261 1.00 10.00 H new ATOM 0 HG12 ILE B 364 5.403 -0.077 -6.573 1.00 10.00 H new ATOM 0 HG13 ILE B 364 6.943 -0.616 -7.212 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.497 0.188 -7.993 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.590 -0.651 -9.560 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.005 -1.516 -8.062 1.00 10.00 H new ATOM 0 HD11 ILE B 364 7.147 1.599 -6.187 1.00 10.00 H new ATOM 0 HD12 ILE B 364 7.465 1.689 -7.936 1.00 10.00 H new ATOM 0 HD13 ILE B 364 5.901 2.236 -7.286 1.00 10.00 H new