USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1155 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: C 12 CYS SG : rot 136:sc= -5.16! USER MOD Set 1.2: C 15 CYS SG : rot -129:sc= -0.522 USER MOD Set 1.3: C 26 CYS SG : rot -156:sc= 0.934 USER MOD Set 1.4: C 29 CYS SG : rot -11:sc= 0.341 USER MOD Set 2.1: B 12 CYS SG : rot 132:sc= -5.42! USER MOD Set 2.2: B 15 CYS SG : rot -128:sc= -0.347 USER MOD Set 2.3: B 26 CYS SG : rot -161:sc= 0.0247! USER MOD Set 2.4: B 29 CYS SG : rot -17:sc= 0.244 USER MOD Set 3.1: A 12 CYS SG : rot -142:sc= -6.27! USER MOD Set 3.2: A 15 CYS SG : rot -131:sc= -0.647 USER MOD Set 3.3: A 26 CYS SG : rot -146:sc= 1.61! USER MOD Set 3.4: A 29 CYS SG : rot -6:sc= -1.44 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.397 USER MOD Single : A 14 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.035) USER MOD Single : A 24 THR OG1 : rot 180:sc= -3.23! USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 167:sc= 1.21 (180deg=0.618) USER MOD Single : A 37 THR OG1 : rot 160:sc= -1.22 USER MOD Single : A 39 GLN : amide:sc= -1.71 K(o=-1.7,f=-3.7!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 74:sc= 0.383 USER MOD Single : A 48 GLN : amide:sc= -1.13 K(o=-1.1,f=-5.7!) USER MOD Single : A 49 LYS NZ :NH3+ 143:sc= 1.1 (180deg=0.147) USER MOD Single : A 50 HIS : no HD1:sc= -2.68 K(o=-2.6,f=-6.6!) USER MOD Single : A 52 ASN : amide:sc= -2.33! K(o=-2.3!,f=-0.83) USER MOD Single : A 53 LYS NZ :NH3+ 133:sc= 1.23 (180deg=0.681) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.379 USER MOD Single : B 14 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00933) USER MOD Single : B 24 THR OG1 : rot 180:sc= -2.89! USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 168:sc= 1.19 (180deg=0.544) USER MOD Single : B 37 THR OG1 : rot 160:sc= -0.97 USER MOD Single : B 39 GLN : amide:sc= -1.67 K(o=-1.7,f=-3.5!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 73:sc= 0.345 USER MOD Single : B 48 GLN : amide:sc= -0.86 K(o=-0.86,f=-5.2!) USER MOD Single : B 49 LYS NZ :NH3+ 140:sc= 0.96 (180deg=0.0458) USER MOD Single : B 50 HIS : no HD1:sc= -2.68 K(o=-2.6,f=-6.6!) USER MOD Single : B 52 ASN : amide:sc= -2.51! K(o=-2.5!,f=-0.95) USER MOD Single : B 53 LYS NZ :NH3+ 156:sc= 1.22 (180deg=0.735) USER MOD Single : C 5 THR OG1 : rot 180:sc= -0.205 USER MOD Single : C 14 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00244) USER MOD Single : C 24 THR OG1 : rot 180:sc= -3.1! USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ 165:sc= 1.14 (180deg=0.473) USER MOD Single : C 37 THR OG1 : rot 160:sc= -1.36! USER MOD Single : C 39 GLN : amide:sc= -1.72 K(o=-1.7,f=-3.4) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot 73:sc= 0.357 USER MOD Single : C 48 GLN : amide:sc= -0.976 K(o=-0.98,f=-5.5!) USER MOD Single : C 49 LYS NZ :NH3+ 143:sc= 0.785 (180deg=0.116) USER MOD Single : C 50 HIS : no HD1:sc= -2.7 K(o=-2.6,f=-6.3!) USER MOD Single : C 52 ASN : amide:sc= -2.58! K(o=-2.6!,f=-1.1) USER MOD Single : C 53 LYS NZ :NH3+ 126:sc= 1.17 (180deg=0.617) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.215 -8.807 13.780 1.00 0.00 N ATOM 22 CA VAL A 2 -1.151 -8.103 14.643 1.00 0.00 C ATOM 23 C VAL A 2 -2.269 -7.480 13.809 1.00 0.00 C ATOM 24 O VAL A 2 -3.280 -7.013 14.335 1.00 0.00 O ATOM 25 CB VAL A 2 -0.430 -7.011 15.472 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.075 -5.888 14.577 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.334 -6.468 16.571 1.00 0.00 C ATOM 0 HA VAL A 2 -1.584 -8.825 15.336 1.00 0.00 H new ATOM 0 HB VAL A 2 0.434 -7.474 15.949 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.577 -5.136 15.185 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.777 -6.292 13.847 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.767 -5.431 14.056 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.801 -5.703 17.136 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.228 -6.032 16.125 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.621 -7.279 17.240 1.00 0.00 H new ATOM 37 N ILE A 3 -2.094 -7.500 12.499 1.00 0.00 N ATOM 38 CA ILE A 3 -3.101 -6.966 11.607 1.00 0.00 C ATOM 39 C ILE A 3 -3.734 -8.083 10.787 1.00 0.00 C ATOM 40 O ILE A 3 -3.052 -9.004 10.339 1.00 0.00 O ATOM 41 CB ILE A 3 -2.525 -5.884 10.662 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.657 -5.173 9.916 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.537 -6.493 9.673 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.189 -4.026 9.050 1.00 0.00 C ATOM 0 H ILE A 3 -1.269 -7.878 12.034 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.863 -6.495 12.229 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.990 -5.153 11.268 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.180 -5.898 9.292 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.379 -4.798 10.642 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.147 -5.712 9.021 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.714 -6.955 10.219 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.043 -7.249 9.072 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.046 -3.572 8.553 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.692 -3.281 9.671 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.491 -4.398 8.300 1.00 0.00 H new ATOM 56 N ALA A 4 -5.045 -8.027 10.656 1.00 0.00 N ATOM 57 CA ALA A 4 -5.760 -8.915 9.764 1.00 0.00 C ATOM 58 C ALA A 4 -6.622 -8.098 8.817 1.00 0.00 C ATOM 59 O ALA A 4 -7.129 -7.035 9.179 1.00 0.00 O ATOM 60 CB ALA A 4 -6.605 -9.895 10.558 1.00 0.00 C ATOM 0 H ALA A 4 -5.640 -7.370 11.161 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.043 -9.490 9.178 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.136 -10.556 9.873 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -5.961 -10.488 11.207 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.325 -9.346 11.165 1.00 0.00 H new ATOM 66 N THR A 5 -6.770 -8.602 7.599 1.00 0.00 N ATOM 67 CA THR A 5 -7.474 -7.896 6.537 1.00 0.00 C ATOM 68 C THR A 5 -8.942 -7.664 6.895 1.00 0.00 C ATOM 69 O THR A 5 -9.600 -6.809 6.317 1.00 0.00 O ATOM 70 CB THR A 5 -7.379 -8.689 5.217 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.030 -9.140 5.028 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.795 -7.836 4.025 1.00 0.00 C ATOM 0 H THR A 5 -6.405 -9.513 7.319 1.00 0.00 H new ATOM 0 HA THR A 5 -6.997 -6.924 6.413 1.00 0.00 H new ATOM 0 HB THR A 5 -8.057 -9.540 5.282 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.968 -9.645 4.191 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.716 -8.425 3.111 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.825 -7.505 4.156 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.141 -6.967 3.954 1.00 0.00 H new ATOM 80 N ASP A 6 -9.428 -8.394 7.892 1.00 0.00 N ATOM 81 CA ASP A 6 -10.834 -8.333 8.272 1.00 0.00 C ATOM 82 C ASP A 6 -11.112 -7.140 9.180 1.00 0.00 C ATOM 83 O ASP A 6 -12.260 -6.883 9.539 1.00 0.00 O ATOM 84 CB ASP A 6 -11.253 -9.623 8.985 1.00 0.00 C ATOM 85 CG ASP A 6 -11.187 -10.845 8.089 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.082 -11.403 7.917 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.245 -11.270 7.572 1.00 0.00 O ATOM 0 H ASP A 6 -8.868 -9.036 8.453 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.416 -8.217 7.357 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.609 -9.779 9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.270 -9.510 9.361 1.00 0.00 H new ATOM 92 N ASP A 7 -10.065 -6.409 9.552 1.00 0.00 N ATOM 93 CA ASP A 7 -10.239 -5.214 10.376 1.00 0.00 C ATOM 94 C ASP A 7 -10.124 -3.953 9.530 1.00 0.00 C ATOM 95 O ASP A 7 -10.525 -2.868 9.953 1.00 0.00 O ATOM 96 CB ASP A 7 -9.180 -5.159 11.488 1.00 0.00 C ATOM 97 CG ASP A 7 -9.232 -6.339 12.438 1.00 0.00 C ATOM 98 OD1 ASP A 7 -10.133 -6.379 13.303 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.354 -7.223 12.342 1.00 0.00 O ATOM 0 H ASP A 7 -9.099 -6.618 9.301 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.233 -5.266 10.821 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.190 -5.113 11.033 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.312 -4.239 12.058 1.00 0.00 H new ATOM 104 N LEU A 8 -9.578 -4.092 8.330 1.00 0.00 N ATOM 105 CA LEU A 8 -9.410 -2.948 7.441 1.00 0.00 C ATOM 106 C LEU A 8 -10.276 -3.097 6.205 1.00 0.00 C ATOM 107 O LEU A 8 -10.524 -2.129 5.482 1.00 0.00 O ATOM 108 CB LEU A 8 -7.946 -2.760 7.048 1.00 0.00 C ATOM 109 CG LEU A 8 -7.047 -2.201 8.152 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.728 -3.261 9.195 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.771 -1.632 7.558 1.00 0.00 C ATOM 0 H LEU A 8 -9.245 -4.978 7.950 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.729 -2.058 7.983 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.546 -3.721 6.726 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.899 -2.091 6.189 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.588 -1.397 8.652 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.087 -2.832 9.966 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.654 -3.615 9.648 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.214 -4.096 8.719 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.142 -1.238 8.356 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.234 -2.419 7.028 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.019 -0.830 6.863 1.00 0.00 H new ATOM 123 N GLU A 9 -10.741 -4.312 5.983 1.00 0.00 N ATOM 124 CA GLU A 9 -11.657 -4.601 4.902 1.00 0.00 C ATOM 125 C GLU A 9 -12.729 -5.554 5.394 1.00 0.00 C ATOM 126 O GLU A 9 -12.444 -6.540 6.074 1.00 0.00 O ATOM 127 CB GLU A 9 -10.939 -5.185 3.680 1.00 0.00 C ATOM 128 CG GLU A 9 -10.026 -4.188 2.986 1.00 0.00 C ATOM 129 CD GLU A 9 -9.486 -4.700 1.670 1.00 0.00 C ATOM 130 OE1 GLU A 9 -8.451 -5.391 1.678 1.00 0.00 O ATOM 131 OE2 GLU A 9 -10.085 -4.384 0.614 1.00 0.00 O ATOM 0 H GLU A 9 -10.493 -5.124 6.548 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.114 -3.664 4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.352 -6.049 3.991 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.682 -5.544 2.968 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.574 -3.262 2.812 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.192 -3.947 3.645 1.00 0.00 H new ATOM 138 N VAL A 10 -13.951 -5.253 5.039 1.00 0.00 N ATOM 139 CA VAL A 10 -15.096 -6.002 5.500 1.00 0.00 C ATOM 140 C VAL A 10 -15.902 -6.443 4.294 1.00 0.00 C ATOM 141 O VAL A 10 -15.975 -5.728 3.292 1.00 0.00 O ATOM 142 CB VAL A 10 -15.972 -5.150 6.457 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.406 -3.850 5.795 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.188 -5.931 6.941 1.00 0.00 C ATOM 0 H VAL A 10 -14.183 -4.477 4.419 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.756 -6.874 6.059 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.359 -4.905 7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.018 -3.275 6.490 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.525 -3.269 5.521 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.986 -4.074 4.900 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.780 -5.305 7.609 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.796 -6.225 6.085 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.859 -6.822 7.475 1.00 0.00 H new ATOM 154 N ALA A 11 -16.477 -7.626 4.370 1.00 0.00 N ATOM 155 CA ALA A 11 -17.280 -8.134 3.281 1.00 0.00 C ATOM 156 C ALA A 11 -18.504 -7.250 3.076 1.00 0.00 C ATOM 157 O ALA A 11 -19.222 -6.932 4.023 1.00 0.00 O ATOM 158 CB ALA A 11 -17.683 -9.568 3.584 1.00 0.00 C ATOM 0 H ALA A 11 -16.403 -8.251 5.173 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.701 -8.121 2.357 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.289 -9.956 2.766 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -16.789 -10.181 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.260 -9.596 4.508 1.00 0.00 H new ATOM 164 N CYS A 12 -18.722 -6.861 1.825 1.00 0.00 N ATOM 165 CA CYS A 12 -19.688 -5.835 1.455 1.00 0.00 C ATOM 166 C CYS A 12 -21.115 -6.213 1.879 1.00 0.00 C ATOM 167 O CYS A 12 -21.435 -7.385 2.052 1.00 0.00 O ATOM 168 CB CYS A 12 -19.575 -5.661 -0.068 1.00 0.00 C ATOM 169 SG CYS A 12 -20.511 -4.304 -0.796 1.00 0.00 S ATOM 0 H CYS A 12 -18.224 -7.256 1.027 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.473 -4.899 1.970 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.523 -5.522 -0.318 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -19.896 -6.589 -0.542 1.00 0.00 H new ATOM 0 HG CYS A 12 -20.990 -4.675 -1.946 1.00 0.00 H new ATOM 174 N PRO A 13 -21.979 -5.194 2.069 1.00 0.00 N ATOM 175 CA PRO A 13 -23.391 -5.367 2.440 1.00 0.00 C ATOM 176 C PRO A 13 -24.135 -6.497 1.707 1.00 0.00 C ATOM 177 O PRO A 13 -25.093 -7.045 2.249 1.00 0.00 O ATOM 178 CB PRO A 13 -23.998 -4.031 2.021 1.00 0.00 C ATOM 179 CG PRO A 13 -22.924 -3.030 2.241 1.00 0.00 C ATOM 180 CD PRO A 13 -21.629 -3.758 1.972 1.00 0.00 C ATOM 0 HA PRO A 13 -23.474 -5.638 3.492 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.310 -4.050 0.977 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -24.882 -3.797 2.614 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.040 -2.177 1.572 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -22.952 -2.643 3.260 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.234 -3.512 0.986 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -20.864 -3.487 2.699 1.00 0.00 H new ATOM 188 N LYS A 14 -23.686 -6.865 0.504 1.00 0.00 N ATOM 189 CA LYS A 14 -24.491 -7.736 -0.342 1.00 0.00 C ATOM 190 C LYS A 14 -23.676 -8.568 -1.342 1.00 0.00 C ATOM 191 O LYS A 14 -24.053 -9.686 -1.658 1.00 0.00 O ATOM 192 CB LYS A 14 -25.510 -6.885 -1.104 1.00 0.00 C ATOM 193 CG LYS A 14 -26.403 -7.688 -2.037 1.00 0.00 C ATOM 194 CD LYS A 14 -27.277 -6.778 -2.886 1.00 0.00 C ATOM 195 CE LYS A 14 -28.075 -7.572 -3.899 1.00 0.00 C ATOM 196 NZ LYS A 14 -29.119 -8.392 -3.236 1.00 0.00 N ATOM 0 H LYS A 14 -22.792 -6.580 0.105 1.00 0.00 H new ATOM 0 HA LYS A 14 -24.979 -8.450 0.322 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.135 -6.353 -0.386 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -24.978 -6.131 -1.684 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.787 -8.312 -2.685 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.033 -8.359 -1.453 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.956 -6.218 -2.243 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -26.653 -6.049 -3.402 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.541 -6.892 -4.612 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.406 -8.219 -4.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.704 -8.859 -3.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.667 -9.112 -2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.719 -7.780 -2.647 1.00 0.00 H new ATOM 210 N CYS A 15 -22.579 -8.040 -1.883 1.00 0.00 N ATOM 211 CA CYS A 15 -21.967 -8.691 -3.026 1.00 0.00 C ATOM 212 C CYS A 15 -20.544 -9.195 -2.782 1.00 0.00 C ATOM 213 O CYS A 15 -19.677 -9.084 -3.647 1.00 0.00 O ATOM 214 CB CYS A 15 -21.921 -7.641 -4.101 1.00 0.00 C ATOM 215 SG CYS A 15 -20.670 -6.336 -3.819 1.00 0.00 S ATOM 0 H CYS A 15 -22.113 -7.193 -1.558 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.551 -9.576 -3.278 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.717 -8.124 -5.057 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.903 -7.176 -4.182 1.00 0.00 H new ATOM 0 HG CYS A 15 -21.217 -5.168 -3.983 1.00 0.00 H new ATOM 220 N GLU A 16 -20.333 -9.844 -1.648 1.00 0.00 N ATOM 221 CA GLU A 16 -18.997 -10.309 -1.232 1.00 0.00 C ATOM 222 C GLU A 16 -18.785 -11.707 -1.754 1.00 0.00 C ATOM 223 O GLU A 16 -18.068 -12.514 -1.173 1.00 0.00 O ATOM 224 CB GLU A 16 -18.891 -10.347 0.300 1.00 0.00 C ATOM 225 CG GLU A 16 -20.082 -9.770 1.038 1.00 0.00 C ATOM 226 CD GLU A 16 -21.244 -10.738 1.083 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.048 -10.748 0.131 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.337 -11.525 2.052 1.00 0.00 O ATOM 0 H GLU A 16 -21.074 -10.068 -0.984 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.248 -9.624 -1.629 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.754 -11.382 0.614 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -17.997 -9.801 0.601 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.787 -9.510 2.055 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.398 -8.847 0.552 1.00 0.00 H new ATOM 235 N ARG A 17 -19.427 -11.985 -2.872 1.00 0.00 N ATOM 236 CA ARG A 17 -19.638 -13.336 -3.310 1.00 0.00 C ATOM 237 C ARG A 17 -19.657 -13.336 -4.838 1.00 0.00 C ATOM 238 O ARG A 17 -19.254 -14.300 -5.483 1.00 0.00 O ATOM 239 CB ARG A 17 -20.953 -13.870 -2.725 1.00 0.00 C ATOM 240 CG ARG A 17 -22.171 -13.012 -3.046 1.00 0.00 C ATOM 241 CD ARG A 17 -23.360 -13.370 -2.166 1.00 0.00 C ATOM 242 NE ARG A 17 -23.123 -13.037 -0.760 1.00 0.00 N ATOM 243 CZ ARG A 17 -23.526 -13.784 0.265 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.222 -14.896 0.053 1.00 0.00 N ATOM 245 NH2 ARG A 17 -23.237 -13.408 1.506 1.00 0.00 N ATOM 0 H ARG A 17 -19.813 -11.277 -3.496 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.840 -13.992 -2.963 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -21.123 -14.878 -3.102 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.852 -13.947 -1.642 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.921 -11.960 -2.909 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.442 -13.142 -4.094 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -24.245 -12.841 -2.520 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.569 -14.436 -2.256 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.616 -12.177 -0.553 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.450 -15.181 -0.899 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.528 -15.464 0.843 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.709 -12.551 1.669 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.543 -13.977 2.296 1.00 0.00 H new ATOM 259 N ALA A 18 -20.099 -12.200 -5.397 1.00 0.00 N ATOM 260 CA ALA A 18 -20.342 -12.094 -6.836 1.00 0.00 C ATOM 261 C ALA A 18 -19.552 -10.957 -7.483 1.00 0.00 C ATOM 262 O ALA A 18 -19.054 -11.095 -8.597 1.00 0.00 O ATOM 263 CB ALA A 18 -21.829 -11.911 -7.100 1.00 0.00 C ATOM 0 H ALA A 18 -20.294 -11.347 -4.873 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.997 -13.023 -7.290 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -22.001 -11.833 -8.174 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.377 -12.767 -6.706 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -22.176 -11.001 -6.610 1.00 0.00 H new ATOM 269 N GLY A 19 -19.442 -9.832 -6.784 1.00 0.00 N ATOM 270 CA GLY A 19 -18.718 -8.703 -7.337 1.00 0.00 C ATOM 271 C GLY A 19 -19.625 -7.703 -8.031 1.00 0.00 C ATOM 272 O GLY A 19 -19.158 -6.834 -8.766 1.00 0.00 O ATOM 0 H GLY A 19 -19.836 -9.683 -5.855 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.175 -8.199 -6.538 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.975 -9.067 -8.047 1.00 0.00 H new ATOM 276 N GLU A 20 -20.912 -7.793 -7.741 1.00 0.00 N ATOM 277 CA GLU A 20 -21.913 -6.944 -8.370 1.00 0.00 C ATOM 278 C GLU A 20 -23.140 -6.879 -7.497 1.00 0.00 C ATOM 279 O GLU A 20 -23.297 -7.662 -6.565 1.00 0.00 O ATOM 280 CB GLU A 20 -22.312 -7.454 -9.761 1.00 0.00 C ATOM 281 CG GLU A 20 -22.355 -8.974 -9.871 1.00 0.00 C ATOM 282 CD GLU A 20 -22.618 -9.455 -11.280 1.00 0.00 C ATOM 283 OE1 GLU A 20 -21.652 -9.571 -12.062 1.00 0.00 O ATOM 284 OE2 GLU A 20 -23.790 -9.733 -11.615 1.00 0.00 O ATOM 0 H GLU A 20 -21.293 -8.455 -7.065 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.474 -5.953 -8.489 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -23.293 -7.053 -10.017 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.607 -7.066 -10.496 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.407 -9.385 -9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -23.132 -9.359 -9.210 1.00 0.00 H new ATOM 291 N ILE A 21 -23.999 -5.941 -7.803 1.00 0.00 N ATOM 292 CA ILE A 21 -25.256 -5.801 -7.116 1.00 0.00 C ATOM 293 C ILE A 21 -26.285 -5.423 -8.143 1.00 0.00 C ATOM 294 O ILE A 21 -26.084 -4.464 -8.888 1.00 0.00 O ATOM 295 CB ILE A 21 -25.213 -4.736 -5.995 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.323 -5.210 -4.839 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.616 -4.417 -5.500 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.300 -4.272 -3.644 1.00 0.00 C ATOM 0 H ILE A 21 -23.845 -5.251 -8.538 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.498 -6.745 -6.627 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.784 -3.822 -6.406 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.666 -6.191 -4.510 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.305 -5.336 -5.207 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.562 -3.666 -4.712 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.215 -4.034 -6.326 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.078 -5.323 -5.107 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.648 -4.681 -2.873 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -23.927 -3.296 -3.955 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -25.309 -4.165 -3.246 1.00 0.00 H new ATOM 310 N GLU A 22 -27.366 -6.180 -8.198 1.00 0.00 N ATOM 311 CA GLU A 22 -28.394 -5.948 -9.194 1.00 0.00 C ATOM 312 C GLU A 22 -27.794 -5.944 -10.601 1.00 0.00 C ATOM 313 O GLU A 22 -28.109 -5.087 -11.426 1.00 0.00 O ATOM 314 CB GLU A 22 -29.052 -4.610 -8.894 1.00 0.00 C ATOM 315 CG GLU A 22 -30.401 -4.408 -9.559 1.00 0.00 C ATOM 316 CD GLU A 22 -31.187 -3.271 -8.945 1.00 0.00 C ATOM 317 OE1 GLU A 22 -31.021 -2.115 -9.390 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.975 -3.529 -8.007 1.00 0.00 O ATOM 0 H GLU A 22 -27.554 -6.958 -7.566 1.00 0.00 H new ATOM 0 HA GLU A 22 -29.134 -6.747 -9.154 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -29.175 -4.514 -7.815 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.382 -3.811 -9.211 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -30.253 -4.211 -10.621 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.981 -5.328 -9.484 1.00 0.00 H new ATOM 325 N GLY A 23 -26.893 -6.881 -10.852 1.00 0.00 N ATOM 326 CA GLY A 23 -26.291 -7.002 -12.164 1.00 0.00 C ATOM 327 C GLY A 23 -25.318 -5.888 -12.497 1.00 0.00 C ATOM 328 O GLY A 23 -24.705 -5.903 -13.568 1.00 0.00 O ATOM 0 H GLY A 23 -26.566 -7.563 -10.167 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -25.770 -7.957 -12.228 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -27.080 -7.019 -12.915 1.00 0.00 H new ATOM 332 N THR A 24 -25.162 -4.918 -11.604 1.00 0.00 N ATOM 333 CA THR A 24 -24.332 -3.758 -11.918 1.00 0.00 C ATOM 334 C THR A 24 -23.162 -3.611 -10.929 1.00 0.00 C ATOM 335 O THR A 24 -23.186 -4.202 -9.843 1.00 0.00 O ATOM 336 CB THR A 24 -25.221 -2.496 -11.924 1.00 0.00 C ATOM 337 OG1 THR A 24 -24.694 -1.498 -12.808 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.381 -1.911 -10.529 1.00 0.00 C ATOM 0 H THR A 24 -25.588 -4.908 -10.677 1.00 0.00 H new ATOM 0 HA THR A 24 -23.888 -3.895 -12.904 1.00 0.00 H new ATOM 0 HB THR A 24 -26.204 -2.805 -12.281 1.00 0.00 H new ATOM 0 HG1 THR A 24 -25.276 -0.710 -12.795 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.013 -1.024 -10.577 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.842 -2.651 -9.875 1.00 0.00 H new ATOM 0 HG23 THR A 24 -24.402 -1.638 -10.135 1.00 0.00 H new ATOM 346 N PRO A 25 -22.098 -2.858 -11.309 1.00 0.00 N ATOM 347 CA PRO A 25 -20.972 -2.568 -10.420 1.00 0.00 C ATOM 348 C PRO A 25 -21.428 -1.953 -9.101 1.00 0.00 C ATOM 349 O PRO A 25 -22.287 -1.073 -9.055 1.00 0.00 O ATOM 350 CB PRO A 25 -20.099 -1.584 -11.216 1.00 0.00 C ATOM 351 CG PRO A 25 -20.986 -1.088 -12.305 1.00 0.00 C ATOM 352 CD PRO A 25 -21.890 -2.242 -12.629 1.00 0.00 C ATOM 0 HA PRO A 25 -20.435 -3.475 -10.141 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.749 -0.766 -10.586 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.214 -2.076 -11.619 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -21.558 -0.218 -11.982 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -20.407 -0.784 -13.177 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -22.828 -1.911 -13.076 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -21.429 -2.935 -13.333 1.00 0.00 H new ATOM 360 N CYS A 26 -20.826 -2.435 -8.031 1.00 0.00 N ATOM 361 CA CYS A 26 -21.264 -2.123 -6.683 1.00 0.00 C ATOM 362 C CYS A 26 -20.625 -0.841 -6.138 1.00 0.00 C ATOM 363 O CYS A 26 -19.431 -0.610 -6.342 1.00 0.00 O ATOM 364 CB CYS A 26 -20.939 -3.311 -5.791 1.00 0.00 C ATOM 365 SG CYS A 26 -21.117 -2.992 -4.006 1.00 0.00 S ATOM 0 H CYS A 26 -20.017 -3.055 -8.071 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.338 -1.939 -6.698 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.589 -4.142 -6.065 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.915 -3.628 -5.990 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.224 -3.674 -3.352 1.00 0.00 H new ATOM 370 N PRO A 27 -21.432 -0.021 -5.408 1.00 0.00 N ATOM 371 CA PRO A 27 -21.056 1.284 -4.841 1.00 0.00 C ATOM 372 C PRO A 27 -19.568 1.489 -4.534 1.00 0.00 C ATOM 373 O PRO A 27 -18.972 2.463 -4.979 1.00 0.00 O ATOM 374 CB PRO A 27 -21.849 1.289 -3.537 1.00 0.00 C ATOM 375 CG PRO A 27 -23.105 0.526 -3.823 1.00 0.00 C ATOM 376 CD PRO A 27 -22.853 -0.290 -5.085 1.00 0.00 C ATOM 0 HA PRO A 27 -21.264 2.082 -5.554 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.282 0.822 -2.732 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.073 2.307 -3.219 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.359 -0.125 -2.987 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.945 1.206 -3.965 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.030 -1.352 -4.915 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.512 0.017 -5.897 1.00 0.00 H new ATOM 384 N ALA A 28 -18.970 0.567 -3.790 1.00 0.00 N ATOM 385 CA ALA A 28 -17.635 0.793 -3.245 1.00 0.00 C ATOM 386 C ALA A 28 -16.691 -0.376 -3.522 1.00 0.00 C ATOM 387 O ALA A 28 -15.527 -0.348 -3.140 1.00 0.00 O ATOM 388 CB ALA A 28 -17.731 1.064 -1.749 1.00 0.00 C ATOM 0 H ALA A 28 -19.382 -0.335 -3.551 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.213 1.664 -3.746 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -16.733 1.232 -1.345 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.345 1.948 -1.578 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.184 0.206 -1.252 1.00 0.00 H new ATOM 394 N CYS A 29 -17.194 -1.404 -4.167 1.00 0.00 N ATOM 395 CA CYS A 29 -16.367 -2.552 -4.516 1.00 0.00 C ATOM 396 C CYS A 29 -16.691 -3.026 -5.929 1.00 0.00 C ATOM 397 O CYS A 29 -17.721 -3.650 -6.167 1.00 0.00 O ATOM 398 CB CYS A 29 -16.568 -3.697 -3.520 1.00 0.00 C ATOM 399 SG CYS A 29 -18.292 -4.225 -3.412 1.00 0.00 S ATOM 0 H CYS A 29 -18.168 -1.475 -4.463 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.323 -2.242 -4.474 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.950 -4.544 -3.816 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.226 -3.381 -2.534 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.035 -3.429 -4.122 1.00 0.00 H new ATOM 404 N SER A 30 -15.805 -2.728 -6.868 1.00 0.00 N ATOM 405 CA SER A 30 -16.029 -3.050 -8.268 1.00 0.00 C ATOM 406 C SER A 30 -15.585 -4.481 -8.608 1.00 0.00 C ATOM 407 O SER A 30 -14.733 -4.684 -9.468 1.00 0.00 O ATOM 408 CB SER A 30 -15.285 -2.037 -9.136 1.00 0.00 C ATOM 409 OG SER A 30 -15.612 -0.711 -8.744 1.00 0.00 O ATOM 0 H SER A 30 -14.918 -2.260 -6.683 1.00 0.00 H new ATOM 0 HA SER A 30 -17.099 -2.996 -8.467 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.210 -2.194 -9.048 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.544 -2.187 -10.184 1.00 0.00 H new ATOM 0 HG SER A 30 -15.126 -0.074 -9.308 1.00 0.00 H new ATOM 415 N GLY A 31 -16.162 -5.469 -7.923 1.00 0.00 N ATOM 416 CA GLY A 31 -15.865 -6.855 -8.244 1.00 0.00 C ATOM 417 C GLY A 31 -14.687 -7.356 -7.453 1.00 0.00 C ATOM 418 O GLY A 31 -13.766 -7.964 -7.996 1.00 0.00 O ATOM 0 H GLY A 31 -16.824 -5.335 -7.158 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.737 -7.475 -8.035 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.657 -6.948 -9.310 1.00 0.00 H new ATOM 422 N LYS A 32 -14.736 -7.107 -6.159 1.00 0.00 N ATOM 423 CA LYS A 32 -13.619 -7.364 -5.275 1.00 0.00 C ATOM 424 C LYS A 32 -14.072 -8.310 -4.176 1.00 0.00 C ATOM 425 O LYS A 32 -13.343 -9.209 -3.768 1.00 0.00 O ATOM 426 CB LYS A 32 -13.175 -6.037 -4.668 1.00 0.00 C ATOM 427 CG LYS A 32 -13.173 -4.904 -5.680 1.00 0.00 C ATOM 428 CD LYS A 32 -13.163 -3.546 -5.010 1.00 0.00 C ATOM 429 CE LYS A 32 -11.869 -3.303 -4.273 1.00 0.00 C ATOM 430 NZ LYS A 32 -10.699 -3.458 -5.179 1.00 0.00 N ATOM 0 H LYS A 32 -15.555 -6.719 -5.691 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.790 -7.816 -5.819 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.837 -5.780 -3.841 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.174 -6.149 -4.251 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.300 -4.996 -6.326 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -14.052 -4.987 -6.319 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -13.308 -2.768 -5.760 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -13.998 -3.477 -4.313 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.872 -2.300 -3.847 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.784 -4.002 -3.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.849 -3.077 -4.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.555 -4.466 -5.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.874 -2.940 -6.064 1.00 0.00 H new ATOM 444 N GLY A 33 -15.293 -8.078 -3.688 1.00 0.00 N ATOM 445 CA GLY A 33 -15.859 -8.899 -2.658 1.00 0.00 C ATOM 446 C GLY A 33 -16.000 -8.117 -1.375 1.00 0.00 C ATOM 447 O GLY A 33 -17.029 -8.179 -0.710 1.00 0.00 O ATOM 0 H GLY A 33 -15.898 -7.320 -4.003 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.834 -9.268 -2.974 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.227 -9.771 -2.491 1.00 0.00 H new ATOM 451 N VAL A 34 -15.001 -7.302 -1.064 1.00 0.00 N ATOM 452 CA VAL A 34 -14.993 -6.573 0.199 1.00 0.00 C ATOM 453 C VAL A 34 -14.890 -5.067 -0.008 1.00 0.00 C ATOM 454 O VAL A 34 -14.630 -4.591 -1.118 1.00 0.00 O ATOM 455 CB VAL A 34 -13.814 -7.025 1.097 1.00 0.00 C ATOM 456 CG1 VAL A 34 -13.937 -8.497 1.464 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.480 -6.760 0.412 1.00 0.00 C ATOM 0 H VAL A 34 -14.193 -7.129 -1.662 1.00 0.00 H new ATOM 0 HA VAL A 34 -15.942 -6.800 0.686 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.854 -6.440 2.016 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.096 -8.786 2.094 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -14.869 -8.660 2.005 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -13.934 -9.100 0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.667 -7.085 1.061 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.437 -7.311 -0.527 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.380 -5.693 0.211 1.00 0.00 H new ATOM 467 N ILE A 35 -15.132 -4.336 1.072 1.00 0.00 N ATOM 468 CA ILE A 35 -14.955 -2.891 1.107 1.00 0.00 C ATOM 469 C ILE A 35 -14.134 -2.496 2.336 1.00 0.00 C ATOM 470 O ILE A 35 -13.991 -3.280 3.268 1.00 0.00 O ATOM 471 CB ILE A 35 -16.307 -2.150 1.143 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.196 -2.744 2.231 1.00 0.00 C ATOM 473 CG2 ILE A 35 -16.996 -2.222 -0.212 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.451 -1.947 2.509 1.00 0.00 C ATOM 0 H ILE A 35 -15.459 -4.732 1.954 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.431 -2.603 0.196 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.125 -1.100 1.372 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.478 -3.756 1.942 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.619 -2.825 3.152 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -17.948 -1.693 -0.165 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.361 -1.760 -0.968 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.173 -3.265 -0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.027 -2.437 3.294 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.180 -0.942 2.831 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.052 -1.887 1.602 1.00 0.00 H new ATOM 486 N LEU A 36 -13.613 -1.278 2.334 1.00 0.00 N ATOM 487 CA LEU A 36 -12.671 -0.844 3.368 1.00 0.00 C ATOM 488 C LEU A 36 -13.353 -0.249 4.598 1.00 0.00 C ATOM 489 O LEU A 36 -14.527 0.122 4.570 1.00 0.00 O ATOM 490 CB LEU A 36 -11.701 0.193 2.796 1.00 0.00 C ATOM 491 CG LEU A 36 -10.894 -0.266 1.584 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.629 0.043 0.287 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.526 0.380 1.597 1.00 0.00 C ATOM 0 H LEU A 36 -13.823 -0.570 1.631 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.140 -1.741 3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.268 1.082 2.519 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.007 0.490 3.583 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.770 -1.347 1.641 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.031 -0.295 -0.559 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.589 -0.472 0.281 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.793 1.118 0.209 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.958 0.046 0.729 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.635 1.464 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.998 0.096 2.507 1.00 0.00 H new ATOM 505 N THR A 37 -12.572 -0.160 5.671 1.00 0.00 N ATOM 506 CA THR A 37 -12.974 0.515 6.898 1.00 0.00 C ATOM 507 C THR A 37 -12.220 1.838 6.982 1.00 0.00 C ATOM 508 O THR A 37 -11.371 2.087 6.141 1.00 0.00 O ATOM 509 CB THR A 37 -12.633 -0.336 8.142 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.210 -0.477 8.269 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.257 -1.720 8.051 1.00 0.00 C ATOM 0 H THR A 37 -11.634 -0.559 5.712 1.00 0.00 H new ATOM 0 HA THR A 37 -14.052 0.674 6.878 1.00 0.00 H new ATOM 0 HB THR A 37 -13.038 0.178 9.014 1.00 0.00 H new ATOM 0 HG1 THR A 37 -10.987 -0.724 9.191 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.999 -2.295 8.941 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.341 -1.627 7.981 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.879 -2.232 7.166 1.00 0.00 H new ATOM 519 N ALA A 38 -12.503 2.676 7.973 1.00 0.00 N ATOM 520 CA ALA A 38 -11.812 3.968 8.091 1.00 0.00 C ATOM 521 C ALA A 38 -10.297 3.777 8.164 1.00 0.00 C ATOM 522 O ALA A 38 -9.536 4.491 7.506 1.00 0.00 O ATOM 523 CB ALA A 38 -12.319 4.735 9.298 1.00 0.00 C ATOM 0 H ALA A 38 -13.195 2.494 8.700 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.031 4.552 7.197 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.796 5.689 9.369 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.389 4.915 9.192 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.137 4.153 10.202 1.00 0.00 H new ATOM 529 N GLN A 39 -9.873 2.817 8.977 1.00 0.00 N ATOM 530 CA GLN A 39 -8.475 2.398 9.033 1.00 0.00 C ATOM 531 C GLN A 39 -7.957 2.064 7.626 1.00 0.00 C ATOM 532 O GLN A 39 -6.935 2.593 7.185 1.00 0.00 O ATOM 533 CB GLN A 39 -8.371 1.177 9.956 1.00 0.00 C ATOM 534 CG GLN A 39 -6.955 0.740 10.301 1.00 0.00 C ATOM 535 CD GLN A 39 -6.218 1.735 11.179 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.825 2.497 11.934 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.896 1.714 11.106 1.00 0.00 N ATOM 0 H GLN A 39 -10.485 2.308 9.615 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.860 3.207 9.426 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.901 1.397 10.883 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.887 0.341 9.484 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.993 -0.224 10.809 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.393 0.593 9.379 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.431 1.068 10.468 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.343 2.344 11.688 1.00 0.00 H new ATOM 546 N GLY A 40 -8.686 1.201 6.926 1.00 0.00 N ATOM 547 CA GLY A 40 -8.333 0.837 5.568 1.00 0.00 C ATOM 548 C GLY A 40 -8.422 1.999 4.590 1.00 0.00 C ATOM 549 O GLY A 40 -7.660 2.062 3.631 1.00 0.00 O ATOM 0 H GLY A 40 -9.525 0.743 7.282 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.318 0.440 5.558 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.992 0.037 5.231 1.00 0.00 H new ATOM 553 N TYR A 41 -9.331 2.934 4.843 1.00 0.00 N ATOM 554 CA TYR A 41 -9.516 4.083 3.963 1.00 0.00 C ATOM 555 C TYR A 41 -8.326 5.025 4.034 1.00 0.00 C ATOM 556 O TYR A 41 -7.947 5.629 3.030 1.00 0.00 O ATOM 557 CB TYR A 41 -10.789 4.850 4.351 1.00 0.00 C ATOM 558 CG TYR A 41 -12.043 4.456 3.592 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.373 5.068 2.388 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.908 3.491 4.090 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.525 4.725 1.704 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.061 3.145 3.414 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.365 3.762 2.223 1.00 0.00 C ATOM 564 OH TYR A 41 -15.521 3.420 1.556 1.00 0.00 O ATOM 0 H TYR A 41 -9.953 2.919 5.652 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.608 3.708 2.944 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -10.969 4.706 5.416 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.612 5.915 4.199 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.719 5.824 1.980 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.674 3.002 5.024 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.766 5.208 0.769 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.722 2.393 3.819 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.995 2.725 2.059 1.00 0.00 H new ATOM 574 N THR A 42 -7.715 5.120 5.200 1.00 0.00 N ATOM 575 CA THR A 42 -6.511 5.919 5.356 1.00 0.00 C ATOM 576 C THR A 42 -5.350 5.259 4.618 1.00 0.00 C ATOM 577 O THR A 42 -4.462 5.925 4.077 1.00 0.00 O ATOM 578 CB THR A 42 -6.148 6.057 6.840 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.288 6.510 7.576 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.994 7.029 7.031 1.00 0.00 C ATOM 0 H THR A 42 -8.030 4.656 6.052 1.00 0.00 H new ATOM 0 HA THR A 42 -6.699 6.908 4.939 1.00 0.00 H new ATOM 0 HB THR A 42 -5.838 5.080 7.210 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.931 5.776 7.667 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.757 7.108 8.092 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.120 6.667 6.490 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.277 8.010 6.648 1.00 0.00 H new ATOM 588 N LEU A 43 -5.407 3.939 4.555 1.00 0.00 N ATOM 589 CA LEU A 43 -4.356 3.159 3.932 1.00 0.00 C ATOM 590 C LEU A 43 -4.610 3.019 2.439 1.00 0.00 C ATOM 591 O LEU A 43 -3.714 2.624 1.705 1.00 0.00 O ATOM 592 CB LEU A 43 -4.241 1.765 4.573 1.00 0.00 C ATOM 593 CG LEU A 43 -3.071 1.568 5.561 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.110 2.617 6.658 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.118 0.175 6.163 1.00 0.00 C ATOM 0 H LEU A 43 -6.176 3.384 4.931 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.416 3.688 4.088 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.173 1.550 5.097 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.146 1.027 3.776 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.137 1.682 5.011 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.277 2.459 7.342 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.032 3.610 6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.049 2.536 7.205 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.287 0.051 6.857 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.059 0.040 6.696 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.041 -0.567 5.369 1.00 0.00 H new ATOM 607 N LEU A 44 -5.808 3.362 1.964 1.00 0.00 N ATOM 608 CA LEU A 44 -6.094 3.227 0.544 1.00 0.00 C ATOM 609 C LEU A 44 -5.613 4.463 -0.206 1.00 0.00 C ATOM 610 O LEU A 44 -4.968 4.345 -1.236 1.00 0.00 O ATOM 611 CB LEU A 44 -7.594 2.931 0.280 1.00 0.00 C ATOM 612 CG LEU A 44 -8.552 4.129 0.120 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.431 4.757 -1.264 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.993 3.696 0.336 1.00 0.00 C ATOM 0 H LEU A 44 -6.576 3.726 2.529 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.545 2.365 0.165 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.661 2.327 -0.625 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.962 2.316 1.101 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.271 4.867 0.872 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.120 5.598 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.410 5.108 -1.416 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.676 4.014 -2.023 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.653 4.556 0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.257 2.933 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.104 3.288 1.341 1.00 0.00 H new ATOM 626 N ASP A 45 -5.878 5.647 0.339 1.00 0.00 N ATOM 627 CA ASP A 45 -5.494 6.889 -0.329 1.00 0.00 C ATOM 628 C ASP A 45 -3.991 7.064 -0.278 1.00 0.00 C ATOM 629 O ASP A 45 -3.397 7.708 -1.137 1.00 0.00 O ATOM 630 CB ASP A 45 -6.191 8.092 0.313 1.00 0.00 C ATOM 631 CG ASP A 45 -5.659 9.424 -0.193 1.00 0.00 C ATOM 632 OD1 ASP A 45 -5.868 9.737 -1.385 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.025 10.158 0.603 1.00 0.00 O ATOM 0 H ASP A 45 -6.353 5.774 1.233 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.809 6.830 -1.371 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.261 8.035 0.114 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -6.065 8.044 1.395 1.00 0.00 H new ATOM 638 N PHE A 46 -3.369 6.421 0.693 1.00 0.00 N ATOM 639 CA PHE A 46 -1.925 6.433 0.804 1.00 0.00 C ATOM 640 C PHE A 46 -1.315 5.554 -0.266 1.00 0.00 C ATOM 641 O PHE A 46 -0.349 5.935 -0.926 1.00 0.00 O ATOM 642 CB PHE A 46 -1.547 5.883 2.181 1.00 0.00 C ATOM 643 CG PHE A 46 -0.087 5.954 2.523 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.780 4.945 2.133 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.414 7.018 3.252 1.00 0.00 C ATOM 646 CE1 PHE A 46 2.118 4.999 2.462 1.00 0.00 C ATOM 647 CE2 PHE A 46 1.752 7.078 3.582 1.00 0.00 C ATOM 648 CZ PHE A 46 2.604 6.066 3.187 1.00 0.00 C ATOM 0 H PHE A 46 -3.844 5.883 1.417 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.553 7.450 0.680 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.108 6.430 2.939 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.866 4.842 2.238 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.403 4.107 1.565 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.250 7.810 3.566 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.784 4.207 2.152 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.132 7.915 4.148 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.652 6.110 3.446 1.00 0.00 H new ATOM 658 N ILE A 47 -1.894 4.394 -0.473 1.00 0.00 N ATOM 659 CA ILE A 47 -1.331 3.474 -1.430 1.00 0.00 C ATOM 660 C ILE A 47 -1.710 3.870 -2.855 1.00 0.00 C ATOM 661 O ILE A 47 -0.958 3.632 -3.797 1.00 0.00 O ATOM 662 CB ILE A 47 -1.743 2.023 -1.133 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.261 1.872 -1.230 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.250 1.636 0.252 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.772 0.492 -0.882 1.00 0.00 C ATOM 0 H ILE A 47 -2.738 4.070 -0.001 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.246 3.530 -1.339 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.292 1.358 -1.870 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.730 2.598 -0.566 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.575 2.118 -2.244 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.540 0.608 0.467 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.164 1.722 0.289 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.692 2.300 0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.858 0.472 -0.976 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.335 -0.240 -1.561 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.492 0.248 0.143 1.00 0.00 H new ATOM 677 N GLN A 48 -2.861 4.513 -2.997 1.00 0.00 N ATOM 678 CA GLN A 48 -3.235 5.148 -4.241 1.00 0.00 C ATOM 679 C GLN A 48 -2.181 6.174 -4.615 1.00 0.00 C ATOM 680 O GLN A 48 -1.577 6.103 -5.665 1.00 0.00 O ATOM 681 CB GLN A 48 -4.592 5.841 -4.090 1.00 0.00 C ATOM 682 CG GLN A 48 -5.766 4.881 -3.961 1.00 0.00 C ATOM 683 CD GLN A 48 -6.098 4.171 -5.263 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.241 3.991 -6.124 1.00 0.00 O ATOM 685 NE2 GLN A 48 -7.343 3.750 -5.406 1.00 0.00 N ATOM 0 H GLN A 48 -3.554 4.606 -2.254 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.308 4.392 -5.023 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.564 6.485 -3.211 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.757 6.487 -4.953 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.539 4.138 -3.196 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.643 5.432 -3.620 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.026 3.919 -4.668 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.620 3.256 -6.254 1.00 0.00 H new ATOM 694 N LYS A 49 -1.893 7.043 -3.672 1.00 0.00 N ATOM 695 CA LYS A 49 -1.118 8.251 -3.914 1.00 0.00 C ATOM 696 C LYS A 49 0.389 7.990 -3.984 1.00 0.00 C ATOM 697 O LYS A 49 1.169 8.898 -4.229 1.00 0.00 O ATOM 698 CB LYS A 49 -1.495 9.240 -2.809 1.00 0.00 C ATOM 699 CG LYS A 49 -0.635 10.485 -2.672 1.00 0.00 C ATOM 700 CD LYS A 49 -1.320 11.506 -1.773 1.00 0.00 C ATOM 701 CE LYS A 49 -2.078 10.819 -0.645 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.761 11.776 0.255 1.00 0.00 N ATOM 0 H LYS A 49 -2.191 6.934 -2.703 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.357 8.663 -4.894 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.525 9.557 -2.975 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.475 8.708 -1.858 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.337 10.219 -2.257 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.454 10.920 -3.655 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.576 12.185 -1.355 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.009 12.111 -2.363 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.815 10.139 -1.071 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.383 10.213 -0.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.674 11.379 0.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.167 11.951 1.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.922 12.672 -0.248 1.00 0.00 H new ATOM 716 N HIS A 50 0.837 6.766 -3.759 1.00 0.00 N ATOM 717 CA HIS A 50 2.240 6.505 -4.078 1.00 0.00 C ATOM 718 C HIS A 50 2.440 5.451 -5.169 1.00 0.00 C ATOM 719 O HIS A 50 3.573 5.164 -5.539 1.00 0.00 O ATOM 720 CB HIS A 50 2.998 6.124 -2.803 1.00 0.00 C ATOM 721 CG HIS A 50 2.772 7.101 -1.687 1.00 0.00 C ATOM 722 ND1 HIS A 50 2.132 6.765 -0.520 1.00 0.00 N ATOM 723 CD2 HIS A 50 3.045 8.426 -1.594 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.010 7.834 0.237 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.554 8.857 -0.386 1.00 0.00 N ATOM 0 H HIS A 50 0.300 5.984 -3.384 1.00 0.00 H new ATOM 0 HA HIS A 50 2.646 7.429 -4.489 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.685 5.131 -2.481 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.064 6.067 -3.021 1.00 0.00 H new ATOM 0 HD2 HIS A 50 3.553 9.029 -2.332 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.541 7.866 1.209 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.603 9.812 -0.031 1.00 0.00 H new ATOM 734 N LEU A 51 1.361 4.881 -5.694 1.00 0.00 N ATOM 735 CA LEU A 51 1.478 3.971 -6.841 1.00 0.00 C ATOM 736 C LEU A 51 0.768 4.534 -8.064 1.00 0.00 C ATOM 737 O LEU A 51 1.157 4.272 -9.204 1.00 0.00 O ATOM 738 CB LEU A 51 0.871 2.593 -6.542 1.00 0.00 C ATOM 739 CG LEU A 51 1.676 1.662 -5.621 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.094 1.468 -6.135 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.692 2.185 -4.203 1.00 0.00 C ATOM 0 H LEU A 51 0.410 5.025 -5.356 1.00 0.00 H new ATOM 0 HA LEU A 51 2.545 3.867 -7.036 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.112 2.745 -6.095 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.714 2.079 -7.490 1.00 0.00 H new ATOM 0 HG LEU A 51 1.182 0.691 -5.622 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.637 0.805 -5.462 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.063 1.027 -7.132 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.600 2.433 -6.180 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.268 1.508 -3.572 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.149 3.174 -4.185 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.671 2.250 -3.828 1.00 0.00 H new ATOM 753 N ASN A 52 -0.268 5.312 -7.810 1.00 0.00 N ATOM 754 CA ASN A 52 -1.254 5.655 -8.826 1.00 0.00 C ATOM 755 C ASN A 52 -1.639 7.138 -8.786 1.00 0.00 C ATOM 756 O ASN A 52 -1.970 7.728 -9.815 1.00 0.00 O ATOM 757 CB ASN A 52 -2.479 4.764 -8.609 1.00 0.00 C ATOM 758 CG ASN A 52 -2.516 3.606 -9.590 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.123 3.702 -10.657 1.00 0.00 O ATOM 760 ND2 ASN A 52 -1.852 2.513 -9.247 1.00 0.00 N ATOM 0 H ASN A 52 -0.452 5.725 -6.896 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.826 5.484 -9.814 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.471 4.377 -7.590 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.385 5.360 -8.716 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -1.831 1.711 -9.876 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -1.362 2.473 -8.353 1.00 0.00 H new ATOM 767 N LYS A 53 -1.591 7.725 -7.603 1.00 0.00 N ATOM 768 CA LYS A 53 -1.845 9.146 -7.416 1.00 0.00 C ATOM 769 C LYS A 53 -0.534 9.855 -7.055 1.00 0.00 C ATOM 770 O LYS A 53 -0.444 10.453 -5.964 1.00 0.00 O ATOM 771 CB LYS A 53 -2.889 9.357 -6.301 1.00 0.00 C ATOM 772 CG LYS A 53 -4.264 9.771 -6.808 1.00 0.00 C ATOM 773 CD LYS A 53 -5.190 10.164 -5.658 1.00 0.00 C ATOM 774 CE LYS A 53 -5.708 8.949 -4.903 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.681 9.316 -3.836 1.00 0.00 N ATOM 776 OXT LYS A 53 0.418 9.776 -7.862 1.00 0.00 O ATOM 0 H LYS A 53 -1.374 7.228 -6.739 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.238 9.567 -8.342 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.987 8.434 -5.730 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.522 10.119 -5.614 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.162 10.610 -7.497 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.708 8.949 -7.370 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.655 10.818 -4.969 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.033 10.734 -6.050 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -6.184 8.264 -5.605 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.868 8.416 -4.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.512 8.694 -3.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.232 9.206 -2.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.979 10.304 -3.963 1.00 0.00 H new ATOM 811 N VAL B 2 7.726 4.005 13.812 1.00 0.00 N ATOM 812 CA VAL B 2 7.592 2.828 14.657 1.00 0.00 C ATOM 813 C VAL B 2 7.623 1.560 13.806 1.00 0.00 C ATOM 814 O VAL B 2 7.674 0.444 14.320 1.00 0.00 O ATOM 815 CB VAL B 2 6.285 2.886 15.485 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.063 2.772 14.585 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.268 1.810 16.563 1.00 0.00 C ATOM 0 HA VAL B 2 8.433 2.809 15.350 1.00 0.00 H new ATOM 0 HB VAL B 2 6.249 3.856 15.981 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.159 2.816 15.192 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.060 3.595 13.870 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.094 1.824 14.048 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.338 1.876 17.128 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.341 0.827 16.097 1.00 0.00 H new ATOM 0 HG23 VAL B 2 7.113 1.956 17.236 1.00 0.00 H new ATOM 827 N ILE B 3 7.604 1.741 12.496 1.00 0.00 N ATOM 828 CA ILE B 3 7.639 0.613 11.586 1.00 0.00 C ATOM 829 C ILE B 3 8.914 0.635 10.752 1.00 0.00 C ATOM 830 O ILE B 3 9.358 1.692 10.300 1.00 0.00 O ATOM 831 CB ILE B 3 6.402 0.584 10.653 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.343 -0.742 9.889 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.426 1.757 9.678 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.107 -0.894 9.031 1.00 0.00 C ATOM 0 H ILE B 3 7.565 2.654 12.043 1.00 0.00 H new ATOM 0 HA ILE B 3 7.622 -0.291 12.195 1.00 0.00 H new ATOM 0 HB ILE B 3 5.508 0.674 11.271 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.227 -0.826 9.256 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.383 -1.565 10.603 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.547 1.713 9.035 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.421 2.694 10.235 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.327 1.703 9.066 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.135 -1.857 8.520 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.219 -0.842 9.660 1.00 0.00 H new ATOM 0 HD13 ILE B 3 5.076 -0.093 8.293 1.00 0.00 H new ATOM 846 N ALA B 4 9.522 -0.526 10.603 1.00 0.00 N ATOM 847 CA ALA B 4 10.639 -0.693 9.699 1.00 0.00 C ATOM 848 C ALA B 4 10.343 -1.835 8.740 1.00 0.00 C ATOM 849 O ALA B 4 9.676 -2.807 9.099 1.00 0.00 O ATOM 850 CB ALA B 4 11.920 -0.953 10.476 1.00 0.00 C ATOM 0 H ALA B 4 9.256 -1.374 11.103 1.00 0.00 H new ATOM 0 HA ALA B 4 10.780 0.223 9.125 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.749 -1.076 9.780 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.123 -0.110 11.136 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.807 -1.860 11.070 1.00 0.00 H new ATOM 856 N THR B 5 10.837 -1.697 7.515 1.00 0.00 N ATOM 857 CA THR B 5 10.564 -2.646 6.444 1.00 0.00 C ATOM 858 C THR B 5 11.084 -4.042 6.783 1.00 0.00 C ATOM 859 O THR B 5 10.658 -5.029 6.194 1.00 0.00 O ATOM 860 CB THR B 5 11.207 -2.161 5.128 1.00 0.00 C ATOM 861 OG1 THR B 5 10.940 -0.763 4.952 1.00 0.00 O ATOM 862 CG2 THR B 5 10.668 -2.927 3.929 1.00 0.00 C ATOM 0 H THR B 5 11.439 -0.922 7.237 1.00 0.00 H new ATOM 0 HA THR B 5 9.482 -2.706 6.325 1.00 0.00 H new ATOM 0 HB THR B 5 12.281 -2.337 5.193 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.350 -0.454 4.117 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.143 -2.559 3.019 1.00 0.00 H new ATOM 0 HG22 THR B 5 10.885 -3.989 4.048 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.590 -2.783 3.860 1.00 0.00 H new ATOM 870 N ASP B 6 11.957 -4.119 7.778 1.00 0.00 N ATOM 871 CA ASP B 6 12.610 -5.371 8.142 1.00 0.00 C ATOM 872 C ASP B 6 11.717 -6.226 9.035 1.00 0.00 C ATOM 873 O ASP B 6 12.072 -7.353 9.381 1.00 0.00 O ATOM 874 CB ASP B 6 13.927 -5.092 8.869 1.00 0.00 C ATOM 875 CG ASP B 6 14.949 -4.397 7.996 1.00 0.00 C ATOM 876 OD1 ASP B 6 14.760 -3.202 7.683 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.966 -5.030 7.645 1.00 0.00 O ATOM 0 H ASP B 6 12.232 -3.322 8.353 1.00 0.00 H new ATOM 0 HA ASP B 6 12.806 -5.917 7.219 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.728 -4.476 9.746 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.344 -6.033 9.228 1.00 0.00 H new ATOM 882 N ASP B 7 10.562 -5.694 9.421 1.00 0.00 N ATOM 883 CA ASP B 7 9.620 -6.460 10.232 1.00 0.00 C ATOM 884 C ASP B 7 8.465 -6.968 9.381 1.00 0.00 C ATOM 885 O ASP B 7 7.726 -7.866 9.785 1.00 0.00 O ATOM 886 CB ASP B 7 9.058 -5.600 11.374 1.00 0.00 C ATOM 887 CG ASP B 7 10.120 -5.120 12.342 1.00 0.00 C ATOM 888 OD1 ASP B 7 10.455 -5.859 13.291 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.622 -3.991 12.168 1.00 0.00 O ATOM 0 H ASP B 7 10.257 -4.748 9.190 1.00 0.00 H new ATOM 0 HA ASP B 7 10.162 -7.308 10.651 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.545 -4.736 10.951 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.312 -6.177 11.921 1.00 0.00 H new ATOM 894 N LEU B 8 8.312 -6.402 8.194 1.00 0.00 N ATOM 895 CA LEU B 8 7.234 -6.809 7.302 1.00 0.00 C ATOM 896 C LEU B 8 7.788 -7.468 6.054 1.00 0.00 C ATOM 897 O LEU B 8 7.070 -8.153 5.324 1.00 0.00 O ATOM 898 CB LEU B 8 6.346 -5.623 6.931 1.00 0.00 C ATOM 899 CG LEU B 8 5.422 -5.140 8.048 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.189 -4.354 9.099 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.289 -4.308 7.475 1.00 0.00 C ATOM 0 H LEU B 8 8.914 -5.665 7.827 1.00 0.00 H new ATOM 0 HA LEU B 8 6.621 -7.536 7.834 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.982 -4.794 6.621 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.738 -5.898 6.069 1.00 0.00 H new ATOM 0 HG LEU B 8 4.997 -6.017 8.536 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.503 -4.025 9.879 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.960 -4.988 9.537 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.655 -3.485 8.635 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.640 -3.972 8.283 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.700 -3.442 6.955 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.713 -4.912 6.774 1.00 0.00 H new ATOM 913 N GLU B 9 9.074 -7.268 5.836 1.00 0.00 N ATOM 914 CA GLU B 9 9.783 -7.903 4.748 1.00 0.00 C ATOM 915 C GLU B 9 11.141 -8.368 5.239 1.00 0.00 C ATOM 916 O GLU B 9 11.823 -7.669 5.985 1.00 0.00 O ATOM 917 CB GLU B 9 9.936 -6.968 3.545 1.00 0.00 C ATOM 918 CG GLU B 9 8.620 -6.657 2.849 1.00 0.00 C ATOM 919 CD GLU B 9 8.808 -5.914 1.546 1.00 0.00 C ATOM 920 OE1 GLU B 9 8.934 -4.676 1.579 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.803 -6.569 0.477 1.00 0.00 O ATOM 0 H GLU B 9 9.655 -6.659 6.411 1.00 0.00 H new ATOM 0 HA GLU B 9 9.201 -8.761 4.412 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.393 -6.035 3.875 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.620 -7.421 2.827 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.087 -7.588 2.657 1.00 0.00 H new ATOM 0 HG3 GLU B 9 7.994 -6.062 3.514 1.00 0.00 H new ATOM 928 N VAL B 10 11.514 -9.555 4.828 1.00 0.00 N ATOM 929 CA VAL B 10 12.743 -10.171 5.268 1.00 0.00 C ATOM 930 C VAL B 10 13.521 -10.632 4.052 1.00 0.00 C ATOM 931 O VAL B 10 12.933 -11.030 3.044 1.00 0.00 O ATOM 932 CB VAL B 10 12.454 -11.364 6.216 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.541 -12.384 5.552 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.744 -12.028 6.681 1.00 0.00 C ATOM 0 H VAL B 10 10.973 -10.123 4.177 1.00 0.00 H new ATOM 0 HA VAL B 10 13.333 -9.444 5.826 1.00 0.00 H new ATOM 0 HB VAL B 10 11.943 -10.966 7.093 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.356 -13.209 6.240 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.595 -11.910 5.291 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.017 -12.765 4.649 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.506 -12.860 7.344 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.295 -12.399 5.816 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.355 -11.301 7.216 1.00 0.00 H new ATOM 944 N ALA B 11 14.835 -10.552 4.126 1.00 0.00 N ATOM 945 CA ALA B 11 15.669 -10.979 3.024 1.00 0.00 C ATOM 946 C ALA B 11 15.510 -12.478 2.801 1.00 0.00 C ATOM 947 O ALA B 11 15.570 -13.272 3.737 1.00 0.00 O ATOM 948 CB ALA B 11 17.116 -10.610 3.310 1.00 0.00 C ATOM 0 H ALA B 11 15.345 -10.197 4.935 1.00 0.00 H new ATOM 0 HA ALA B 11 15.361 -10.472 2.110 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.744 -10.932 2.480 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.199 -9.530 3.431 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.443 -11.103 4.225 1.00 0.00 H new ATOM 954 N CYS B 12 15.287 -12.838 1.541 1.00 0.00 N ATOM 955 CA CYS B 12 14.889 -14.183 1.148 1.00 0.00 C ATOM 956 C CYS B 12 15.913 -15.237 1.584 1.00 0.00 C ATOM 957 O CYS B 12 17.082 -14.934 1.797 1.00 0.00 O ATOM 958 CB CYS B 12 14.727 -14.172 -0.381 1.00 0.00 C ATOM 959 SG CYS B 12 13.877 -15.601 -1.096 1.00 0.00 S ATOM 0 H CYS B 12 15.379 -12.195 0.755 1.00 0.00 H new ATOM 0 HA CYS B 12 13.955 -14.454 1.640 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.182 -13.271 -0.663 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.717 -14.100 -0.831 1.00 0.00 H new ATOM 0 HG CYS B 12 12.965 -15.192 -1.927 1.00 0.00 H new ATOM 964 N PRO B 13 15.452 -16.496 1.736 1.00 0.00 N ATOM 965 CA PRO B 13 16.292 -17.647 2.086 1.00 0.00 C ATOM 966 C PRO B 13 17.635 -17.713 1.357 1.00 0.00 C ATOM 967 O PRO B 13 18.584 -18.298 1.874 1.00 0.00 O ATOM 968 CB PRO B 13 15.427 -18.824 1.640 1.00 0.00 C ATOM 969 CG PRO B 13 14.029 -18.385 1.863 1.00 0.00 C ATOM 970 CD PRO B 13 14.029 -16.893 1.628 1.00 0.00 C ATOM 0 HA PRO B 13 16.565 -17.616 3.141 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.601 -19.066 0.592 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.655 -19.721 2.216 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.346 -18.889 1.179 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.700 -18.622 2.875 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.622 -16.646 0.647 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.416 -16.376 2.366 1.00 0.00 H new ATOM 978 N LYS B 14 17.725 -17.126 0.159 1.00 0.00 N ATOM 979 CA LYS B 14 18.895 -17.358 -0.681 1.00 0.00 C ATOM 980 C LYS B 14 19.207 -16.223 -1.671 1.00 0.00 C ATOM 981 O LYS B 14 20.377 -15.973 -1.960 1.00 0.00 O ATOM 982 CB LYS B 14 18.698 -18.668 -1.448 1.00 0.00 C ATOM 983 CG LYS B 14 19.835 -19.009 -2.400 1.00 0.00 C ATOM 984 CD LYS B 14 19.469 -20.200 -3.269 1.00 0.00 C ATOM 985 CE LYS B 14 20.551 -20.513 -4.289 1.00 0.00 C ATOM 986 NZ LYS B 14 21.780 -21.047 -3.648 1.00 0.00 N ATOM 0 H LYS B 14 17.021 -16.504 -0.239 1.00 0.00 H new ATOM 0 HA LYS B 14 19.753 -17.407 -0.010 1.00 0.00 H new ATOM 0 HB2 LYS B 14 18.582 -19.482 -0.732 1.00 0.00 H new ATOM 0 HB3 LYS B 14 17.769 -18.608 -2.015 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.059 -18.148 -3.030 1.00 0.00 H new ATOM 0 HG3 LYS B 14 20.738 -19.231 -1.831 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.303 -21.073 -2.637 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.531 -19.997 -3.786 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.172 -21.239 -5.009 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.796 -19.609 -4.847 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.474 -21.295 -4.381 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 22.185 -20.325 -3.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 21.543 -21.895 -3.095 1.00 0.00 H new ATOM 1000 N CYS B 15 18.194 -15.530 -2.201 1.00 0.00 N ATOM 1001 CA CYS B 15 18.459 -14.634 -3.336 1.00 0.00 C ATOM 1002 C CYS B 15 18.191 -13.156 -3.050 1.00 0.00 C ATOM 1003 O CYS B 15 17.673 -12.432 -3.908 1.00 0.00 O ATOM 1004 CB CYS B 15 17.563 -15.052 -4.483 1.00 0.00 C ATOM 1005 SG CYS B 15 15.797 -14.843 -4.119 1.00 0.00 S ATOM 0 H CYS B 15 17.226 -15.565 -1.883 1.00 0.00 H new ATOM 0 HA CYS B 15 19.521 -14.725 -3.562 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.817 -14.467 -5.367 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.757 -16.097 -4.726 1.00 0.00 H new ATOM 0 HG CYS B 15 15.167 -15.951 -4.375 1.00 0.00 H new ATOM 1010 N GLU B 16 18.666 -12.678 -1.925 1.00 0.00 N ATOM 1011 CA GLU B 16 18.414 -11.313 -1.498 1.00 0.00 C ATOM 1012 C GLU B 16 19.519 -10.433 -2.035 1.00 0.00 C ATOM 1013 O GLU B 16 19.863 -9.404 -1.455 1.00 0.00 O ATOM 1014 CB GLU B 16 18.422 -11.230 0.028 1.00 0.00 C ATOM 1015 CG GLU B 16 18.455 -12.572 0.737 1.00 0.00 C ATOM 1016 CD GLU B 16 19.858 -13.147 0.810 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.326 -13.704 -0.199 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.502 -13.033 1.872 1.00 0.00 O ATOM 0 H GLU B 16 19.238 -13.219 -1.277 1.00 0.00 H new ATOM 0 HA GLU B 16 17.442 -10.989 -1.871 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.288 -10.647 0.342 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.536 -10.685 0.353 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.058 -12.458 1.746 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.803 -13.273 0.215 1.00 0.00 H new ATOM 1025 N ARG B 17 20.069 -10.844 -3.162 1.00 0.00 N ATOM 1026 CA ARG B 17 21.338 -10.344 -3.611 1.00 0.00 C ATOM 1027 C ARG B 17 21.333 -10.354 -5.134 1.00 0.00 C ATOM 1028 O ARG B 17 21.985 -9.535 -5.781 1.00 0.00 O ATOM 1029 CB ARG B 17 22.478 -11.202 -3.049 1.00 0.00 C ATOM 1030 CG ARG B 17 22.370 -12.680 -3.393 1.00 0.00 C ATOM 1031 CD ARG B 17 23.269 -13.517 -2.501 1.00 0.00 C ATOM 1032 NE ARG B 17 22.833 -13.474 -1.107 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.653 -13.407 -0.063 1.00 0.00 C ATOM 1034 NH1 ARG B 17 24.970 -13.418 -0.239 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.151 -13.334 1.164 1.00 0.00 N ATOM 0 H ARG B 17 19.644 -11.532 -3.784 1.00 0.00 H new ATOM 0 HA ARG B 17 21.498 -9.327 -3.254 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.426 -10.820 -3.427 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.500 -11.093 -1.965 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.336 -13.008 -3.282 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.643 -12.834 -4.437 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.270 -14.549 -2.851 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.294 -13.154 -2.574 1.00 0.00 H new ATOM 0 HE ARG B 17 21.830 -13.497 -0.922 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.358 -13.478 -1.180 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.593 -13.366 0.567 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.140 -13.330 1.302 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.776 -13.282 1.968 1.00 0.00 H new ATOM 1049 N ALA B 18 20.565 -11.299 -5.697 1.00 0.00 N ATOM 1050 CA ALA B 18 20.569 -11.511 -7.141 1.00 0.00 C ATOM 1051 C ALA B 18 19.180 -11.386 -7.754 1.00 0.00 C ATOM 1052 O ALA B 18 19.028 -10.873 -8.861 1.00 0.00 O ATOM 1053 CB ALA B 18 21.174 -12.865 -7.481 1.00 0.00 C ATOM 0 H ALA B 18 19.943 -11.918 -5.177 1.00 0.00 H new ATOM 0 HA ALA B 18 21.184 -10.722 -7.574 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.168 -13.005 -8.562 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.200 -12.907 -7.115 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.588 -13.654 -7.010 1.00 0.00 H new ATOM 1059 N GLY B 19 18.166 -11.850 -7.036 1.00 0.00 N ATOM 1060 CA GLY B 19 16.814 -11.787 -7.562 1.00 0.00 C ATOM 1061 C GLY B 19 16.418 -13.055 -8.290 1.00 0.00 C ATOM 1062 O GLY B 19 15.450 -13.072 -9.040 1.00 0.00 O ATOM 0 H GLY B 19 18.252 -12.265 -6.108 1.00 0.00 H new ATOM 0 HA2 GLY B 19 16.117 -11.608 -6.744 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.731 -10.940 -8.242 1.00 0.00 H new ATOM 1066 N GLU B 20 17.144 -14.128 -8.023 1.00 0.00 N ATOM 1067 CA GLU B 20 16.905 -15.412 -8.668 1.00 0.00 C ATOM 1068 C GLU B 20 17.479 -16.513 -7.823 1.00 0.00 C ATOM 1069 O GLU B 20 18.273 -16.267 -6.923 1.00 0.00 O ATOM 1070 CB GLU B 20 17.532 -15.502 -10.060 1.00 0.00 C ATOM 1071 CG GLU B 20 18.807 -14.694 -10.202 1.00 0.00 C ATOM 1072 CD GLU B 20 19.369 -14.744 -11.599 1.00 0.00 C ATOM 1073 OE1 GLU B 20 18.935 -13.936 -12.444 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.250 -15.589 -11.856 1.00 0.00 O ATOM 0 H GLU B 20 17.915 -14.136 -7.355 1.00 0.00 H new ATOM 0 HA GLU B 20 15.825 -15.513 -8.776 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.746 -16.546 -10.287 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.808 -15.157 -10.799 1.00 0.00 H new ATOM 0 HG2 GLU B 20 18.608 -13.657 -9.931 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.552 -15.070 -9.501 1.00 0.00 H new ATOM 1081 N ILE B 21 17.090 -17.717 -8.140 1.00 0.00 N ATOM 1082 CA ILE B 21 17.597 -18.886 -7.475 1.00 0.00 C ATOM 1083 C ILE B 21 17.752 -19.956 -8.513 1.00 0.00 C ATOM 1084 O ILE B 21 16.811 -20.237 -9.249 1.00 0.00 O ATOM 1085 CB ILE B 21 16.684 -19.366 -6.325 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.745 -18.350 -5.180 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.094 -20.758 -5.852 1.00 0.00 C ATOM 1088 CD1 ILE B 21 15.990 -18.743 -3.933 1.00 0.00 C ATOM 0 H ILE B 21 16.408 -17.916 -8.872 1.00 0.00 H new ATOM 0 HA ILE B 21 18.552 -18.646 -7.008 1.00 0.00 H new ATOM 0 HB ILE B 21 15.657 -19.437 -6.682 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.790 -18.185 -4.917 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.353 -17.398 -5.538 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.437 -21.075 -5.042 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.014 -21.462 -6.680 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.124 -20.732 -5.495 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.094 -17.960 -3.182 1.00 0.00 H new ATOM 0 HD12 ILE B 21 14.935 -18.877 -4.173 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.395 -19.676 -3.542 1.00 0.00 H new ATOM 1100 N GLU B 22 18.940 -20.522 -8.590 1.00 0.00 N ATOM 1101 CA GLU B 22 19.233 -21.509 -9.610 1.00 0.00 C ATOM 1102 C GLU B 22 18.924 -20.953 -11.003 1.00 0.00 C ATOM 1103 O GLU B 22 18.324 -21.630 -11.836 1.00 0.00 O ATOM 1104 CB GLU B 22 18.384 -22.738 -9.322 1.00 0.00 C ATOM 1105 CG GLU B 22 18.856 -24.010 -9.998 1.00 0.00 C ATOM 1106 CD GLU B 22 18.236 -25.245 -9.382 1.00 0.00 C ATOM 1107 OE1 GLU B 22 17.091 -25.586 -9.737 1.00 0.00 O ATOM 1108 OE2 GLU B 22 18.890 -25.874 -8.524 1.00 0.00 O ATOM 0 H GLU B 22 19.716 -20.316 -7.961 1.00 0.00 H new ATOM 0 HA GLU B 22 20.291 -21.769 -9.592 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.362 -22.903 -8.245 1.00 0.00 H new ATOM 0 HB3 GLU B 22 17.360 -22.536 -9.635 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.607 -23.970 -11.058 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.942 -24.076 -9.928 1.00 0.00 H new ATOM 1115 N GLY B 23 19.291 -19.699 -11.234 1.00 0.00 N ATOM 1116 CA GLY B 23 19.094 -19.096 -12.538 1.00 0.00 C ATOM 1117 C GLY B 23 17.642 -18.790 -12.863 1.00 0.00 C ATOM 1118 O GLY B 23 17.348 -18.239 -13.927 1.00 0.00 O ATOM 0 H GLY B 23 19.722 -19.088 -10.540 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.670 -18.172 -12.591 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.493 -19.765 -13.300 1.00 0.00 H new ATOM 1122 N THR B 24 16.730 -19.132 -11.962 1.00 0.00 N ATOM 1123 CA THR B 24 15.305 -19.014 -12.264 1.00 0.00 C ATOM 1124 C THR B 24 14.593 -18.081 -11.272 1.00 0.00 C ATOM 1125 O THR B 24 15.107 -17.830 -10.175 1.00 0.00 O ATOM 1126 CB THR B 24 14.663 -20.424 -12.256 1.00 0.00 C ATOM 1127 OG1 THR B 24 13.437 -20.441 -12.996 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.390 -20.909 -10.842 1.00 0.00 C ATOM 0 H THR B 24 16.944 -19.488 -11.030 1.00 0.00 H new ATOM 0 HA THR B 24 15.193 -18.571 -13.254 1.00 0.00 H new ATOM 0 HB THR B 24 15.382 -21.094 -12.729 1.00 0.00 H new ATOM 0 HG1 THR B 24 13.055 -21.343 -12.975 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.940 -21.901 -10.878 1.00 0.00 H new ATOM 0 HG22 THR B 24 15.326 -20.956 -10.286 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.708 -20.219 -10.346 1.00 0.00 H new ATOM 1136 N PRO B 25 13.420 -17.517 -11.658 1.00 0.00 N ATOM 1137 CA PRO B 25 12.600 -16.699 -10.763 1.00 0.00 C ATOM 1138 C PRO B 25 12.277 -17.434 -9.465 1.00 0.00 C ATOM 1139 O PRO B 25 11.879 -18.604 -9.465 1.00 0.00 O ATOM 1140 CB PRO B 25 11.323 -16.413 -11.568 1.00 0.00 C ATOM 1141 CG PRO B 25 11.346 -17.402 -12.681 1.00 0.00 C ATOM 1142 CD PRO B 25 12.802 -17.613 -12.990 1.00 0.00 C ATOM 0 HA PRO B 25 13.115 -15.788 -10.459 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.432 -16.532 -10.952 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.315 -15.391 -11.947 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.866 -18.336 -12.388 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.809 -17.027 -13.552 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.983 -18.583 -13.454 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.187 -16.856 -13.673 1.00 0.00 H new ATOM 1150 N CYS B 26 12.450 -16.722 -8.367 1.00 0.00 N ATOM 1151 CA CYS B 26 12.391 -17.301 -7.037 1.00 0.00 C ATOM 1152 C CYS B 26 10.960 -17.383 -6.495 1.00 0.00 C ATOM 1153 O CYS B 26 10.168 -16.464 -6.690 1.00 0.00 O ATOM 1154 CB CYS B 26 13.270 -16.463 -6.117 1.00 0.00 C ATOM 1155 SG CYS B 26 13.180 -16.908 -4.351 1.00 0.00 S ATOM 0 H CYS B 26 12.637 -15.719 -8.373 1.00 0.00 H new ATOM 0 HA CYS B 26 12.754 -18.328 -7.084 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.305 -16.553 -6.447 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.990 -15.415 -6.227 1.00 0.00 H new ATOM 0 HG CYS B 26 13.620 -15.919 -3.631 1.00 0.00 H new ATOM 1160 N PRO B 27 10.655 -18.492 -5.776 1.00 0.00 N ATOM 1161 CA PRO B 27 9.340 -18.821 -5.200 1.00 0.00 C ATOM 1162 C PRO B 27 8.420 -17.641 -4.866 1.00 0.00 C ATOM 1163 O PRO B 27 7.265 -17.616 -5.281 1.00 0.00 O ATOM 1164 CB PRO B 27 9.750 -19.520 -3.908 1.00 0.00 C ATOM 1165 CG PRO B 27 11.034 -20.222 -4.216 1.00 0.00 C ATOM 1166 CD PRO B 27 11.608 -19.579 -5.468 1.00 0.00 C ATOM 0 HA PRO B 27 8.744 -19.388 -5.915 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.881 -18.801 -3.099 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.985 -20.227 -3.586 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.731 -20.132 -3.383 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.862 -21.287 -4.374 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.612 -19.193 -5.295 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.678 -20.293 -6.288 1.00 0.00 H new ATOM 1174 N ALA B 28 8.931 -16.670 -4.118 1.00 0.00 N ATOM 1175 CA ALA B 28 8.074 -15.627 -3.559 1.00 0.00 C ATOM 1176 C ALA B 28 8.630 -14.228 -3.807 1.00 0.00 C ATOM 1177 O ALA B 28 8.027 -13.230 -3.415 1.00 0.00 O ATOM 1178 CB ALA B 28 7.875 -15.864 -2.070 1.00 0.00 C ATOM 0 H ALA B 28 9.920 -16.581 -3.886 1.00 0.00 H new ATOM 0 HA ALA B 28 7.112 -15.682 -4.068 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.235 -15.083 -1.660 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.406 -16.836 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA B 28 8.841 -15.844 -1.566 1.00 0.00 H new ATOM 1184 N CYS B 29 9.787 -14.151 -4.441 1.00 0.00 N ATOM 1185 CA CYS B 29 10.385 -12.866 -4.755 1.00 0.00 C ATOM 1186 C CYS B 29 10.939 -12.859 -6.170 1.00 0.00 C ATOM 1187 O CYS B 29 12.026 -13.376 -6.425 1.00 0.00 O ATOM 1188 CB CYS B 29 11.485 -12.509 -3.754 1.00 0.00 C ATOM 1189 SG CYS B 29 12.793 -13.752 -3.566 1.00 0.00 S ATOM 0 H CYS B 29 10.329 -14.959 -4.747 1.00 0.00 H new ATOM 0 HA CYS B 29 9.602 -12.111 -4.685 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.942 -11.568 -4.061 1.00 0.00 H new ATOM 0 HB3 CYS B 29 11.026 -12.338 -2.780 1.00 0.00 H new ATOM 0 HG CYS B 29 12.388 -14.886 -4.057 1.00 0.00 H new ATOM 1194 N SER B 30 10.189 -12.268 -7.087 1.00 0.00 N ATOM 1195 CA SER B 30 10.562 -12.251 -8.491 1.00 0.00 C ATOM 1196 C SER B 30 11.576 -11.142 -8.809 1.00 0.00 C ATOM 1197 O SER B 30 11.312 -10.268 -9.633 1.00 0.00 O ATOM 1198 CB SER B 30 9.298 -12.072 -9.328 1.00 0.00 C ATOM 1199 OG SER B 30 8.288 -12.968 -8.898 1.00 0.00 O ATOM 0 H SER B 30 9.312 -11.790 -6.881 1.00 0.00 H new ATOM 0 HA SER B 30 11.047 -13.197 -8.732 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.942 -11.045 -9.244 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.523 -12.246 -10.380 1.00 0.00 H new ATOM 0 HG SER B 30 7.484 -12.840 -9.443 1.00 0.00 H new ATOM 1205 N GLY B 31 12.729 -11.169 -8.140 1.00 0.00 N ATOM 1206 CA GLY B 31 13.785 -10.223 -8.457 1.00 0.00 C ATOM 1207 C GLY B 31 13.651 -8.965 -7.641 1.00 0.00 C ATOM 1208 O GLY B 31 13.732 -7.855 -8.163 1.00 0.00 O ATOM 0 H GLY B 31 12.948 -11.825 -7.390 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.756 -10.681 -8.268 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.750 -9.977 -9.518 1.00 0.00 H new ATOM 1212 N LYS B 32 13.457 -9.148 -6.349 1.00 0.00 N ATOM 1213 CA LYS B 32 13.132 -8.058 -5.451 1.00 0.00 C ATOM 1214 C LYS B 32 14.192 -7.982 -4.361 1.00 0.00 C ATOM 1215 O LYS B 32 14.623 -6.903 -3.965 1.00 0.00 O ATOM 1216 CB LYS B 32 11.767 -8.342 -4.832 1.00 0.00 C ATOM 1217 CG LYS B 32 10.774 -8.888 -5.845 1.00 0.00 C ATOM 1218 CD LYS B 32 9.591 -9.556 -5.175 1.00 0.00 C ATOM 1219 CE LYS B 32 8.736 -8.554 -4.441 1.00 0.00 C ATOM 1220 NZ LYS B 32 8.288 -7.461 -5.349 1.00 0.00 N ATOM 0 H LYS B 32 13.521 -10.058 -5.893 1.00 0.00 H new ATOM 0 HA LYS B 32 13.104 -7.109 -5.987 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.882 -9.058 -4.018 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.371 -7.425 -4.397 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.420 -8.076 -6.480 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.276 -9.605 -6.495 1.00 0.00 H new ATOM 0 HD2 LYS B 32 8.989 -10.070 -5.924 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.947 -10.314 -4.477 1.00 0.00 H new ATOM 0 HE2 LYS B 32 7.867 -9.056 -4.015 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.299 -8.131 -3.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.546 -6.903 -4.881 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 9.095 -6.844 -5.574 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.911 -7.872 -6.227 1.00 0.00 H new ATOM 1234 N GLY B 33 14.602 -9.156 -3.881 1.00 0.00 N ATOM 1235 CA GLY B 33 15.601 -9.239 -2.856 1.00 0.00 C ATOM 1236 C GLY B 33 15.004 -9.769 -1.576 1.00 0.00 C ATOM 1237 O GLY B 33 15.590 -10.618 -0.912 1.00 0.00 O ATOM 0 H GLY B 33 14.246 -10.058 -4.198 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.412 -9.890 -3.183 1.00 0.00 H new ATOM 0 HA3 GLY B 33 16.034 -8.254 -2.681 1.00 0.00 H new ATOM 1241 N VAL B 34 13.793 -9.331 -1.261 1.00 0.00 N ATOM 1242 CA VAL B 34 13.160 -9.713 -0.004 1.00 0.00 C ATOM 1243 C VAL B 34 11.806 -10.381 -0.223 1.00 0.00 C ATOM 1244 O VAL B 34 11.269 -10.390 -1.336 1.00 0.00 O ATOM 1245 CB VAL B 34 12.961 -8.482 0.911 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.295 -7.853 1.284 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.058 -7.453 0.242 1.00 0.00 C ATOM 0 H VAL B 34 13.233 -8.716 -1.851 1.00 0.00 H new ATOM 0 HA VAL B 34 13.831 -10.428 0.473 1.00 0.00 H new ATOM 0 HB VAL B 34 12.479 -8.824 1.827 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.123 -6.990 1.927 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.907 -8.584 1.813 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.812 -7.534 0.379 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.931 -6.596 0.903 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.510 -7.126 -0.694 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.085 -7.900 0.038 1.00 0.00 H new ATOM 1257 N ILE B 35 11.293 -10.965 0.850 1.00 0.00 N ATOM 1258 CA ILE B 35 9.952 -11.535 0.880 1.00 0.00 C ATOM 1259 C ILE B 35 9.204 -11.035 2.117 1.00 0.00 C ATOM 1260 O ILE B 35 9.816 -10.530 3.053 1.00 0.00 O ATOM 1261 CB ILE B 35 9.987 -13.077 0.902 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.943 -13.556 1.992 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.400 -13.626 -0.456 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.895 -15.046 2.249 1.00 0.00 C ATOM 0 H ILE B 35 11.798 -11.058 1.731 1.00 0.00 H new ATOM 0 HA ILE B 35 9.439 -11.216 -0.027 1.00 0.00 H new ATOM 0 HB ILE B 35 8.986 -13.449 1.122 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.960 -13.279 1.715 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.711 -13.031 2.919 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.418 -14.715 -0.418 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.685 -13.301 -1.212 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.393 -13.255 -0.712 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.604 -15.302 3.037 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.889 -15.329 2.559 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.157 -15.581 1.336 1.00 0.00 H new ATOM 1276 N LEU B 36 7.888 -11.192 2.120 1.00 0.00 N ATOM 1277 CA LEU B 36 7.049 -10.612 3.171 1.00 0.00 C ATOM 1278 C LEU B 36 6.884 -11.522 4.386 1.00 0.00 C ATOM 1279 O LEU B 36 7.156 -12.722 4.335 1.00 0.00 O ATOM 1280 CB LEU B 36 5.662 -10.279 2.617 1.00 0.00 C ATOM 1281 CG LEU B 36 5.647 -9.337 1.415 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.739 -10.112 0.108 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.403 -8.477 1.446 1.00 0.00 C ATOM 0 H LEU B 36 7.374 -11.714 1.410 1.00 0.00 H new ATOM 0 HA LEU B 36 7.563 -9.710 3.502 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.169 -11.209 2.335 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.068 -9.833 3.415 1.00 0.00 H new ATOM 0 HG LEU B 36 6.521 -8.689 1.474 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.726 -9.415 -0.730 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.666 -10.685 0.089 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.891 -10.792 0.028 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.401 -7.809 0.585 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.519 -9.114 1.413 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.391 -7.888 2.363 1.00 0.00 H new ATOM 1295 N THR B 37 6.423 -10.913 5.477 1.00 0.00 N ATOM 1296 CA THR B 37 6.043 -11.628 6.690 1.00 0.00 C ATOM 1297 C THR B 37 4.521 -11.635 6.781 1.00 0.00 C ATOM 1298 O THR B 37 3.878 -11.004 5.957 1.00 0.00 O ATOM 1299 CB THR B 37 6.613 -10.940 7.952 1.00 0.00 C ATOM 1300 OG1 THR B 37 5.999 -9.655 8.133 1.00 0.00 O ATOM 1301 CG2 THR B 37 8.119 -10.756 7.849 1.00 0.00 C ATOM 0 H THR B 37 6.302 -9.902 5.543 1.00 0.00 H new ATOM 0 HA THR B 37 6.444 -12.640 6.642 1.00 0.00 H new ATOM 0 HB THR B 37 6.395 -11.583 8.805 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.108 -9.369 9.064 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.489 -10.270 8.752 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.598 -11.729 7.739 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.352 -10.137 6.982 1.00 0.00 H new ATOM 1309 N ALA B 38 3.941 -12.323 7.758 1.00 0.00 N ATOM 1310 CA ALA B 38 2.479 -12.361 7.896 1.00 0.00 C ATOM 1311 C ALA B 38 1.893 -10.952 7.988 1.00 0.00 C ATOM 1312 O ALA B 38 0.898 -10.638 7.329 1.00 0.00 O ATOM 1313 CB ALA B 38 2.086 -13.188 9.107 1.00 0.00 C ATOM 0 H ALA B 38 4.449 -12.859 8.462 1.00 0.00 H new ATOM 0 HA ALA B 38 2.067 -12.832 7.004 1.00 0.00 H new ATOM 0 HB1 ALA B 38 1.000 -13.208 9.197 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.459 -14.205 8.989 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.517 -12.745 10.005 1.00 0.00 H new ATOM 1319 N GLN B 39 2.512 -10.117 8.812 1.00 0.00 N ATOM 1320 CA GLN B 39 2.177 -8.695 8.890 1.00 0.00 C ATOM 1321 C GLN B 39 2.198 -8.059 7.492 1.00 0.00 C ATOM 1322 O GLN B 39 1.225 -7.437 7.063 1.00 0.00 O ATOM 1323 CB GLN B 39 3.189 -8.010 9.817 1.00 0.00 C ATOM 1324 CG GLN B 39 2.862 -6.569 10.188 1.00 0.00 C ATOM 1325 CD GLN B 39 1.644 -6.440 11.084 1.00 0.00 C ATOM 1326 OE1 GLN B 39 1.293 -7.362 11.822 1.00 0.00 O ATOM 1327 NE2 GLN B 39 1.012 -5.278 11.047 1.00 0.00 N ATOM 0 H GLN B 39 3.259 -10.402 9.445 1.00 0.00 H new ATOM 0 HA GLN B 39 1.171 -8.571 9.290 1.00 0.00 H new ATOM 0 HB2 GLN B 39 3.270 -8.594 10.734 1.00 0.00 H new ATOM 0 HB3 GLN B 39 4.168 -8.031 9.338 1.00 0.00 H new ATOM 0 HG2 GLN B 39 3.722 -6.127 10.690 1.00 0.00 H new ATOM 0 HG3 GLN B 39 2.696 -5.995 9.276 1.00 0.00 H new ATOM 0 HE21 GLN B 39 1.336 -4.541 10.421 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.201 -5.119 11.645 1.00 0.00 H new ATOM 1336 N GLY B 40 3.308 -8.241 6.786 1.00 0.00 N ATOM 1337 CA GLY B 40 3.440 -7.734 5.432 1.00 0.00 C ATOM 1338 C GLY B 40 2.469 -8.377 4.453 1.00 0.00 C ATOM 1339 O GLY B 40 2.029 -7.735 3.506 1.00 0.00 O ATOM 0 H GLY B 40 4.129 -8.737 7.133 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.279 -6.656 5.438 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.460 -7.903 5.086 1.00 0.00 H new ATOM 1343 N TYR B 41 2.114 -9.635 4.690 1.00 0.00 N ATOM 1344 CA TYR B 41 1.206 -10.358 3.804 1.00 0.00 C ATOM 1345 C TYR B 41 -0.204 -9.802 3.891 1.00 0.00 C ATOM 1346 O TYR B 41 -0.924 -9.763 2.890 1.00 0.00 O ATOM 1347 CB TYR B 41 1.185 -11.848 4.172 1.00 0.00 C ATOM 1348 CG TYR B 41 2.138 -12.720 3.379 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.749 -13.285 2.170 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.416 -12.996 3.846 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.609 -14.093 1.451 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.279 -13.805 3.135 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.872 -14.350 1.938 1.00 0.00 C ATOM 1354 OH TYR B 41 4.731 -15.161 1.230 1.00 0.00 O ATOM 0 H TYR B 41 2.441 -10.177 5.490 1.00 0.00 H new ATOM 0 HA TYR B 41 1.568 -10.234 2.783 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.422 -11.948 5.231 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.172 -12.226 4.035 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.759 -13.089 1.786 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.741 -12.570 4.783 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.293 -14.521 0.511 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.269 -14.010 3.516 1.00 0.00 H new ATOM 0 HH TYR B 41 5.581 -15.238 1.712 1.00 0.00 H new ATOM 1364 N THR B 42 -0.585 -9.336 5.066 1.00 0.00 N ATOM 1365 CA THR B 42 -1.876 -8.691 5.238 1.00 0.00 C ATOM 1366 C THR B 42 -1.888 -7.349 4.516 1.00 0.00 C ATOM 1367 O THR B 42 -2.910 -6.908 3.980 1.00 0.00 O ATOM 1368 CB THR B 42 -2.163 -8.459 6.727 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.973 -9.677 7.452 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.580 -7.953 6.936 1.00 0.00 C ATOM 0 H THR B 42 -0.021 -9.391 5.914 1.00 0.00 H new ATOM 0 HA THR B 42 -2.643 -9.342 4.819 1.00 0.00 H new ATOM 0 HB THR B 42 -1.471 -7.702 7.095 1.00 0.00 H new ATOM 0 HG1 THR B 42 -1.015 -9.870 7.522 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.757 -7.797 8.000 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.712 -7.011 6.404 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.289 -8.688 6.554 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.719 -6.736 4.457 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.572 -5.427 3.852 1.00 0.00 C ATOM 1380 C LEU B 43 -0.331 -5.555 2.356 1.00 0.00 C ATOM 1381 O LEU B 43 -0.439 -4.571 1.638 1.00 0.00 O ATOM 1382 CB LEU B 43 0.582 -4.639 4.499 1.00 0.00 C ATOM 1383 CG LEU B 43 0.173 -3.541 5.504 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.709 -4.115 6.598 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.407 -2.896 6.109 1.00 0.00 C ATOM 0 H LEU B 43 0.148 -7.129 4.824 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.500 -4.880 4.020 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.236 -5.346 5.010 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.169 -4.177 3.706 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.395 -2.781 4.968 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.985 -3.324 7.295 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.610 -4.539 6.154 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.166 -4.895 7.131 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.104 -2.123 6.816 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.995 -3.652 6.628 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.008 -2.448 5.318 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.031 -6.756 1.865 1.00 0.00 N ATOM 1398 CA LEU B 44 0.218 -6.915 0.440 1.00 0.00 C ATOM 1399 C LEU B 44 -1.099 -7.107 -0.302 1.00 0.00 C ATOM 1400 O LEU B 44 -1.327 -6.477 -1.323 1.00 0.00 O ATOM 1401 CB LEU B 44 1.223 -8.061 0.150 1.00 0.00 C ATOM 1402 CG LEU B 44 0.665 -9.489 -0.025 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.053 -9.681 -1.408 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.763 -10.522 0.172 1.00 0.00 C ATOM 0 H LEU B 44 0.044 -7.610 2.418 1.00 0.00 H new ATOM 0 HA LEU B 44 0.686 -6.002 0.071 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.770 -7.803 -0.757 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.947 -8.083 0.964 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.110 -9.625 0.729 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.331 -10.697 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.763 -8.972 -1.547 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.814 -9.512 -2.169 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.349 -11.522 0.044 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.552 -10.359 -0.563 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.177 -10.426 1.176 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.985 -7.939 0.237 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.254 -8.226 -0.428 1.00 0.00 C ATOM 1418 C ASP B 45 -4.164 -7.017 -0.358 1.00 0.00 C ATOM 1419 O ASP B 45 -5.028 -6.824 -1.209 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.936 -9.441 0.206 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.351 -9.667 -0.307 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.506 -10.081 -1.478 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.314 -9.441 0.457 1.00 0.00 O ATOM 0 H ASP B 45 -1.851 -8.423 1.125 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.051 -8.455 -1.474 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.338 -10.330 0.008 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -3.965 -9.311 1.288 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.915 -6.166 0.619 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.646 -4.922 0.750 1.00 0.00 C ATOM 1430 C PHE B 46 -4.193 -3.939 -0.309 1.00 0.00 C ATOM 1431 O PHE B 46 -5.008 -3.291 -0.962 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.353 -4.339 2.133 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.140 -3.116 2.499 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -4.702 -1.855 2.128 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -6.310 -3.227 3.232 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -5.415 -0.729 2.481 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -7.028 -2.103 3.586 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.580 -0.854 3.208 1.00 0.00 C ATOM 0 H PHE B 46 -3.207 -6.316 1.338 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.713 -5.106 0.627 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.543 -5.109 2.880 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.292 -4.097 2.188 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -3.792 -1.753 1.556 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -6.664 -4.203 3.529 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -5.062 0.249 2.189 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -7.939 -2.201 4.158 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.142 0.027 3.482 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.898 -3.853 -0.515 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.388 -2.888 -1.459 1.00 0.00 C ATOM 1450 C ILE B 47 -2.544 -3.394 -2.891 1.00 0.00 C ATOM 1451 O ILE B 47 -2.714 -2.610 -3.821 1.00 0.00 O ATOM 1452 CB ILE B 47 -0.924 -2.522 -1.161 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.031 -3.757 -1.286 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.829 -1.926 0.235 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.420 -3.513 -0.938 1.00 0.00 C ATOM 0 H ILE B 47 -2.193 -4.427 -0.052 1.00 0.00 H new ATOM 0 HA ILE B 47 -2.980 -1.979 -1.352 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.580 -1.784 -1.886 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.421 -4.541 -0.637 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.089 -4.131 -2.308 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.207 -1.665 0.450 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.447 -1.030 0.291 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.179 -2.655 0.966 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.983 -4.440 -1.053 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.831 -2.754 -1.603 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.494 -3.169 0.094 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.521 -4.707 -3.050 1.00 0.00 N ATOM 1468 CA GLN B 48 -2.885 -5.332 -4.304 1.00 0.00 C ATOM 1469 C GLN B 48 -4.302 -4.930 -4.665 1.00 0.00 C ATOM 1470 O GLN B 48 -4.550 -4.360 -5.709 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.799 -6.856 -4.175 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.378 -7.386 -4.055 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.602 -7.321 -5.361 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -0.883 -6.497 -6.231 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.389 -8.185 -5.502 1.00 0.00 N ATOM 0 H GLN B 48 -2.251 -5.363 -2.317 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.198 -5.005 -5.085 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.368 -7.169 -3.300 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.274 -7.312 -5.044 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -0.846 -6.813 -3.295 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.411 -8.420 -3.710 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.592 -8.853 -4.759 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.950 -8.183 -6.354 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.194 -5.125 -3.718 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.630 -5.058 -3.952 1.00 0.00 C ATOM 1486 C LYS B 49 -7.161 -3.624 -3.999 1.00 0.00 C ATOM 1487 O LYS B 49 -8.339 -3.405 -4.232 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.297 -5.900 -2.861 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.808 -5.771 -2.713 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.355 -6.886 -1.830 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.399 -7.195 -0.688 1.00 0.00 C ATOM 1492 NZ LYS B 49 -8.888 -8.284 0.193 1.00 0.00 N ATOM 0 H LYS B 49 -4.945 -5.337 -2.752 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.868 -5.457 -4.938 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.064 -6.948 -3.052 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -6.840 -5.640 -1.906 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.055 -4.802 -2.280 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.280 -5.812 -3.695 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.325 -6.594 -1.428 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -9.515 -7.783 -2.428 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.428 -7.474 -1.098 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -8.247 -6.294 -0.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.092 -8.897 0.462 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.314 -7.874 1.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.602 -8.846 -0.313 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.327 -2.626 -3.766 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.808 -1.277 -4.065 1.00 0.00 C ATOM 1508 C HIS B 50 -6.005 -0.561 -5.152 1.00 0.00 C ATOM 1509 O HIS B 50 -6.327 0.569 -5.502 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.850 -0.447 -2.781 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.575 -1.149 -1.670 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -6.957 -1.544 -0.511 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -8.854 -1.588 -1.578 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -7.815 -2.200 0.242 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.975 -2.243 -0.378 1.00 0.00 N ATOM 0 H HIS B 50 -5.379 -2.703 -3.398 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.814 -1.385 -4.471 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.832 -0.223 -2.463 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.337 0.507 -2.984 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -9.633 -1.448 -2.313 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -7.602 -2.632 1.209 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -9.822 -2.689 -0.026 1.00 0.00 H new ATOM 1524 N LEU B 51 -4.973 -1.203 -5.692 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.252 -0.630 -6.837 1.00 0.00 C ATOM 1526 C LEU B 51 -4.394 -1.514 -8.071 1.00 0.00 C ATOM 1527 O LEU B 51 -4.373 -1.037 -9.204 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.752 -0.473 -6.548 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.340 0.675 -5.610 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -2.878 2.009 -6.101 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.793 0.409 -4.194 1.00 0.00 C ATOM 0 H LEU B 51 -4.618 -2.103 -5.367 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.696 0.349 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.389 -1.408 -6.120 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.236 -0.336 -7.498 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.251 0.728 -5.616 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.570 2.800 -5.417 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.484 2.216 -7.096 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -3.966 1.969 -6.143 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.488 1.236 -3.553 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -3.879 0.313 -4.171 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.339 -0.515 -3.834 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.548 -2.801 -7.831 1.00 0.00 N ATOM 1544 CA ASN B 52 -4.362 -3.814 -8.862 1.00 0.00 C ATOM 1545 C ASN B 52 -5.462 -4.883 -8.825 1.00 0.00 C ATOM 1546 O ASN B 52 -5.829 -5.448 -9.855 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.979 -4.437 -8.650 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.946 -3.882 -9.615 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -1.705 -4.451 -10.678 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.341 -2.757 -9.262 1.00 0.00 N ATOM 0 H ASN B 52 -4.805 -3.178 -6.919 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.428 -3.352 -9.847 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.653 -4.254 -7.626 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -3.046 -5.518 -8.774 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -0.649 -2.334 -9.881 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -1.567 -2.314 -8.372 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.976 -5.147 -7.638 1.00 0.00 N ATOM 1558 CA LYS B 53 -7.084 -6.070 -7.445 1.00 0.00 C ATOM 1559 C LYS B 53 -8.338 -5.288 -7.041 1.00 0.00 C ATOM 1560 O LYS B 53 -8.925 -5.585 -5.979 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.729 -7.100 -6.357 1.00 0.00 C ATOM 1562 CG LYS B 53 -6.427 -8.489 -6.894 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.295 -9.507 -5.766 1.00 0.00 C ATOM 1564 CE LYS B 53 -4.972 -9.369 -5.034 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.796 -10.413 -3.988 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.712 -4.349 -7.777 1.00 0.00 O ATOM 0 H LYS B 53 -5.636 -4.725 -6.774 1.00 0.00 H new ATOM 0 HA LYS B 53 -7.277 -6.600 -8.378 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.863 -6.741 -5.800 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.557 -7.167 -5.651 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -7.221 -8.798 -7.574 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -5.504 -8.464 -7.473 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.116 -9.377 -5.061 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.382 -10.514 -6.173 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.154 -9.434 -5.751 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -4.915 -8.383 -4.574 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -3.782 -10.551 -3.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -5.270 -10.111 -3.113 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.213 -11.307 -4.317 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.317 4.501 13.889 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.229 4.959 14.741 1.00 0.00 C ATOM 1603 C VAL C 2 -5.149 5.637 13.902 1.00 0.00 C ATOM 1604 O VAL C 2 -4.237 6.275 14.428 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.622 3.786 15.550 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -4.900 2.806 14.636 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.692 4.294 16.646 1.00 0.00 C ATOM 0 HA VAL C 2 -6.635 5.683 15.447 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.444 3.255 16.030 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.484 1.993 15.231 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.604 2.401 13.909 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.095 3.322 14.113 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.282 3.447 17.196 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.878 4.864 16.197 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.250 4.934 17.329 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.272 5.518 12.591 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.313 6.127 11.691 1.00 0.00 C ATOM 1619 C ILE C 3 -4.969 7.241 10.886 1.00 0.00 C ATOM 1620 O ILE C 3 -6.119 7.124 10.461 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.678 5.090 10.731 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.507 5.717 9.969 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.715 4.544 9.756 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.759 4.736 9.094 1.00 0.00 C ATOM 0 H ILE C 3 -6.024 5.007 12.129 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.516 6.545 12.306 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.303 4.259 11.328 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.882 6.531 9.349 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.812 6.156 10.685 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.244 3.818 9.093 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.518 4.060 10.312 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.125 5.363 9.165 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.944 5.250 8.585 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.353 3.934 9.711 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.440 4.315 8.354 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.257 8.341 10.740 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.674 9.404 9.850 1.00 0.00 C ATOM 1638 C ALA C 4 -3.545 9.741 8.893 1.00 0.00 C ATOM 1639 O ALA C 4 -2.368 9.650 9.245 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.092 10.629 10.644 1.00 0.00 C ATOM 0 H ALA C 4 -3.381 8.522 11.230 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.535 9.069 9.272 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.402 11.418 9.959 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.923 10.371 11.301 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.251 10.979 11.243 1.00 0.00 H new ATOM 1646 N THR C 5 -3.921 10.122 7.678 1.00 0.00 N ATOM 1647 CA THR C 5 -2.968 10.386 6.609 1.00 0.00 C ATOM 1648 C THR C 5 -2.016 11.526 6.973 1.00 0.00 C ATOM 1649 O THR C 5 -0.950 11.661 6.385 1.00 0.00 O ATOM 1650 CB THR C 5 -3.715 10.732 5.303 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.804 9.816 5.116 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.788 10.660 4.098 1.00 0.00 C ATOM 0 H THR C 5 -4.895 10.256 7.407 1.00 0.00 H new ATOM 0 HA THR C 5 -2.377 9.482 6.464 1.00 0.00 H new ATOM 0 HB THR C 5 -4.090 11.752 5.388 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.279 10.037 4.288 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.345 10.909 3.195 1.00 0.00 H new ATOM 0 HG22 THR C 5 -1.969 11.368 4.226 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.385 9.651 4.009 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.381 12.304 7.987 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.611 13.483 8.371 1.00 0.00 C ATOM 1662 C ASP C 6 -0.422 13.113 9.248 1.00 0.00 C ATOM 1663 O ASP C 6 0.383 13.974 9.601 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.493 14.478 9.126 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.590 15.066 8.267 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.648 14.417 8.123 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.410 16.189 7.751 1.00 0.00 O ATOM 0 H ASP C 6 -3.209 12.139 8.560 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.242 13.939 7.452 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.940 13.979 9.986 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.871 15.285 9.514 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.307 11.844 9.611 1.00 0.00 N ATOM 1673 CA ASP C 7 0.827 11.397 10.414 1.00 0.00 C ATOM 1674 C ASP C 7 1.847 10.672 9.546 1.00 0.00 C ATOM 1675 O ASP C 7 3.001 10.489 9.941 1.00 0.00 O ATOM 1676 CB ASP C 7 0.364 10.460 11.539 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.562 11.126 12.541 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.086 11.967 13.334 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.769 10.793 12.556 1.00 0.00 O ATOM 0 H ASP C 7 -0.974 11.112 9.367 1.00 0.00 H new ATOM 0 HA ASP C 7 1.290 12.281 10.853 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.146 9.602 11.100 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.239 10.076 12.064 1.00 0.00 H new ATOM 1684 N LEU C 8 1.428 10.268 8.354 1.00 0.00 N ATOM 1685 CA LEU C 8 2.314 9.551 7.444 1.00 0.00 C ATOM 1686 C LEU C 8 2.597 10.377 6.203 1.00 0.00 C ATOM 1687 O LEU C 8 3.543 10.106 5.460 1.00 0.00 O ATOM 1688 CB LEU C 8 1.727 8.194 7.058 1.00 0.00 C ATOM 1689 CG LEU C 8 1.774 7.136 8.160 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.709 7.390 9.217 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.620 5.748 7.568 1.00 0.00 C ATOM 0 H LEU C 8 0.486 10.423 7.995 1.00 0.00 H new ATOM 0 HA LEU C 8 3.255 9.378 7.966 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.690 8.336 6.755 1.00 0.00 H new ATOM 0 HB3 LEU C 8 2.264 7.816 6.188 1.00 0.00 H new ATOM 0 HG LEU C 8 2.747 7.201 8.647 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.769 6.620 9.986 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.871 8.368 9.669 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.277 7.364 8.754 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.656 5.006 8.366 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.664 5.678 7.049 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.430 5.561 6.863 1.00 0.00 H new ATOM 1703 N GLU C 9 1.777 11.391 6.000 1.00 0.00 N ATOM 1704 CA GLU C 9 1.971 12.339 4.924 1.00 0.00 C ATOM 1705 C GLU C 9 1.706 13.738 5.443 1.00 0.00 C ATOM 1706 O GLU C 9 0.770 13.968 6.207 1.00 0.00 O ATOM 1707 CB GLU C 9 1.076 12.031 3.721 1.00 0.00 C ATOM 1708 CG GLU C 9 1.452 10.746 3.003 1.00 0.00 C ATOM 1709 CD GLU C 9 0.708 10.562 1.700 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.435 10.067 1.731 1.00 0.00 O ATOM 1711 OE2 GLU C 9 1.279 10.888 0.633 1.00 0.00 O ATOM 0 H GLU C 9 0.958 11.579 6.578 1.00 0.00 H new ATOM 0 HA GLU C 9 3.002 12.262 4.578 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.041 11.962 4.056 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.129 12.861 3.016 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.524 10.746 2.807 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.247 9.897 3.656 1.00 0.00 H new ATOM 1718 N VAL C 10 2.547 14.657 5.040 1.00 0.00 N ATOM 1719 CA VAL C 10 2.470 16.024 5.495 1.00 0.00 C ATOM 1720 C VAL C 10 2.480 16.943 4.290 1.00 0.00 C ATOM 1721 O VAL C 10 3.123 16.647 3.280 1.00 0.00 O ATOM 1722 CB VAL C 10 3.651 16.360 6.442 1.00 0.00 C ATOM 1723 CG1 VAL C 10 4.987 16.076 5.770 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.587 17.808 6.909 1.00 0.00 C ATOM 0 H VAL C 10 3.308 14.478 4.384 1.00 0.00 H new ATOM 0 HA VAL C 10 1.546 16.164 6.057 1.00 0.00 H new ATOM 0 HB VAL C 10 3.564 15.717 7.318 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.798 16.320 6.456 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.043 15.021 5.503 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.078 16.683 4.870 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.428 18.014 7.571 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.634 18.471 6.045 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.653 17.976 7.445 1.00 0.00 H new ATOM 1734 N ALA C 11 1.753 18.041 4.379 1.00 0.00 N ATOM 1735 CA ALA C 11 1.706 18.993 3.293 1.00 0.00 C ATOM 1736 C ALA C 11 3.082 19.601 3.080 1.00 0.00 C ATOM 1737 O ALA C 11 3.740 20.039 4.027 1.00 0.00 O ATOM 1738 CB ALA C 11 0.669 20.063 3.598 1.00 0.00 C ATOM 0 H ALA C 11 1.189 18.292 5.191 1.00 0.00 H new ATOM 0 HA ALA C 11 1.415 18.488 2.372 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.635 20.780 2.778 1.00 0.00 H new ATOM 0 HB2 ALA C 11 -0.310 19.598 3.715 1.00 0.00 H new ATOM 0 HB3 ALA C 11 0.938 20.578 4.520 1.00 0.00 H new ATOM 1744 N CYS C 12 3.510 19.598 1.823 1.00 0.00 N ATOM 1745 CA CYS C 12 4.871 19.931 1.428 1.00 0.00 C ATOM 1746 C CYS C 12 5.267 21.345 1.862 1.00 0.00 C ATOM 1747 O CYS C 12 4.417 22.207 2.042 1.00 0.00 O ATOM 1748 CB CYS C 12 4.931 19.798 -0.097 1.00 0.00 C ATOM 1749 SG CYS C 12 6.582 19.806 -0.820 1.00 0.00 S ATOM 0 H CYS C 12 2.908 19.359 1.035 1.00 0.00 H new ATOM 0 HA CYS C 12 5.576 19.258 1.916 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.435 18.870 -0.382 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.358 20.614 -0.537 1.00 0.00 H new ATOM 0 HG CYS C 12 6.665 18.875 -1.723 1.00 0.00 H new ATOM 1754 N PRO C 13 6.588 21.575 2.038 1.00 0.00 N ATOM 1755 CA PRO C 13 7.161 22.872 2.422 1.00 0.00 C ATOM 1756 C PRO C 13 6.544 24.089 1.733 1.00 0.00 C ATOM 1757 O PRO C 13 6.575 25.188 2.279 1.00 0.00 O ATOM 1758 CB PRO C 13 8.611 22.732 1.966 1.00 0.00 C ATOM 1759 CG PRO C 13 8.937 21.298 2.161 1.00 0.00 C ATOM 1760 CD PRO C 13 7.648 20.546 1.923 1.00 0.00 C ATOM 0 HA PRO C 13 6.997 23.059 3.483 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.727 23.025 0.922 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.272 23.370 2.552 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.712 20.975 1.466 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.316 21.116 3.167 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.639 20.076 0.940 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.511 19.752 2.657 1.00 0.00 H new ATOM 1768 N LYS C 14 5.993 23.904 0.536 1.00 0.00 N ATOM 1769 CA LYS C 14 5.626 25.048 -0.282 1.00 0.00 C ATOM 1770 C LYS C 14 4.483 24.773 -1.260 1.00 0.00 C ATOM 1771 O LYS C 14 3.685 25.665 -1.544 1.00 0.00 O ATOM 1772 CB LYS C 14 6.855 25.508 -1.065 1.00 0.00 C ATOM 1773 CG LYS C 14 6.601 26.682 -1.989 1.00 0.00 C ATOM 1774 CD LYS C 14 7.816 26.968 -2.855 1.00 0.00 C ATOM 1775 CE LYS C 14 7.522 28.050 -3.875 1.00 0.00 C ATOM 1776 NZ LYS C 14 7.373 29.386 -3.242 1.00 0.00 N ATOM 0 H LYS C 14 5.796 22.993 0.121 1.00 0.00 H new ATOM 0 HA LYS C 14 5.268 25.819 0.400 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.641 25.779 -0.360 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.230 24.671 -1.654 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.740 26.470 -2.623 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.354 27.565 -1.400 1.00 0.00 H new ATOM 0 HD2 LYS C 14 8.650 27.276 -2.225 1.00 0.00 H new ATOM 0 HD3 LYS C 14 8.123 26.056 -3.367 1.00 0.00 H new ATOM 0 HE2 LYS C 14 8.327 28.084 -4.609 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.609 27.801 -4.415 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 7.190 30.099 -3.976 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 6.578 29.366 -2.572 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 8.247 29.629 -2.734 1.00 0.00 H new ATOM 1790 N CYS C 15 4.392 23.563 -1.802 1.00 0.00 N ATOM 1791 CA CYS C 15 3.531 23.372 -2.963 1.00 0.00 C ATOM 1792 C CYS C 15 2.371 22.392 -2.736 1.00 0.00 C ATOM 1793 O CYS C 15 2.015 21.617 -3.630 1.00 0.00 O ATOM 1794 CB CYS C 15 4.414 22.847 -4.085 1.00 0.00 C ATOM 1795 SG CYS C 15 4.946 21.125 -3.864 1.00 0.00 S ATOM 0 H CYS C 15 4.882 22.731 -1.473 1.00 0.00 H new ATOM 0 HA CYS C 15 3.064 24.329 -3.195 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.874 22.931 -5.028 1.00 0.00 H new ATOM 0 HB3 CYS C 15 5.297 23.481 -4.166 1.00 0.00 H new ATOM 0 HG CYS C 15 6.236 21.048 -4.004 1.00 0.00 H new ATOM 1800 N GLU C 16 1.703 22.538 -1.611 1.00 0.00 N ATOM 1801 CA GLU C 16 0.637 21.633 -1.196 1.00 0.00 C ATOM 1802 C GLU C 16 -0.683 22.156 -1.708 1.00 0.00 C ATOM 1803 O GLU C 16 -1.733 21.933 -1.110 1.00 0.00 O ATOM 1804 CB GLU C 16 0.553 21.573 0.334 1.00 0.00 C ATOM 1805 CG GLU C 16 1.705 22.231 1.070 1.00 0.00 C ATOM 1806 CD GLU C 16 1.542 23.736 1.182 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.701 24.430 0.162 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.262 24.233 2.294 1.00 0.00 O ATOM 0 H GLU C 16 1.882 23.293 -0.949 1.00 0.00 H new ATOM 0 HA GLU C 16 0.849 20.641 -1.596 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.377 22.046 0.650 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.498 20.528 0.638 1.00 0.00 H new ATOM 0 HG2 GLU C 16 1.785 21.803 2.069 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.637 22.008 0.552 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.626 22.857 -2.821 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.711 23.702 -3.244 1.00 0.00 C ATOM 1817 C ARG C 17 -1.719 23.724 -4.770 1.00 0.00 C ATOM 1818 O ARG C 17 -2.753 23.906 -5.404 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.533 25.111 -2.663 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.188 25.749 -2.993 1.00 0.00 C ATOM 1821 CD ARG C 17 0.101 26.939 -2.089 1.00 0.00 C ATOM 1822 NE ARG C 17 0.279 26.532 -0.695 1.00 0.00 N ATOM 1823 CZ ARG C 17 -0.169 27.220 0.352 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -0.810 28.371 0.174 1.00 0.00 N ATOM 1825 NH2 ARG C 17 0.027 26.755 1.580 1.00 0.00 N ATOM 0 H ARG C 17 0.174 22.854 -3.453 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.666 23.321 -2.883 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.330 25.752 -3.039 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.646 25.064 -1.580 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.604 25.008 -2.885 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.183 26.072 -4.034 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.999 27.449 -2.436 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -0.718 27.655 -2.157 1.00 0.00 H new ATOM 0 HE ARG C 17 0.780 25.662 -0.514 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -0.960 28.731 -0.769 1.00 0.00 H new ATOM 0 HH12 ARG C 17 -1.151 28.895 0.980 1.00 0.00 H new ATOM 0 HH21 ARG C 17 0.520 25.873 1.719 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -0.315 27.280 2.385 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.526 23.510 -5.344 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.332 23.675 -6.784 1.00 0.00 C ATOM 1841 C ALA C 18 0.285 22.445 -7.445 1.00 0.00 C ATOM 1842 O ALA C 18 -0.028 22.125 -8.591 1.00 0.00 O ATOM 1843 CB ALA C 18 0.532 24.898 -7.055 1.00 0.00 C ATOM 0 H ALA C 18 0.310 23.225 -4.834 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.320 23.810 -7.224 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.672 25.014 -8.130 1.00 0.00 H new ATOM 0 HB2 ALA C 18 0.042 25.786 -6.655 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.502 24.772 -6.575 1.00 0.00 H new ATOM 1849 N GLY C 19 1.179 21.770 -6.734 1.00 0.00 N ATOM 1850 CA GLY C 19 1.803 20.578 -7.282 1.00 0.00 C ATOM 1851 C GLY C 19 3.111 20.878 -7.988 1.00 0.00 C ATOM 1852 O GLY C 19 3.633 20.046 -8.722 1.00 0.00 O ATOM 0 H GLY C 19 1.483 22.023 -5.794 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.983 19.864 -6.478 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.117 20.102 -7.983 1.00 0.00 H new ATOM 1856 N GLU C 20 3.663 22.046 -7.710 1.00 0.00 N ATOM 1857 CA GLU C 20 4.886 22.503 -8.353 1.00 0.00 C ATOM 1858 C GLU C 20 5.562 23.527 -7.485 1.00 0.00 C ATOM 1859 O GLU C 20 4.955 24.088 -6.574 1.00 0.00 O ATOM 1860 CB GLU C 20 4.622 23.127 -9.727 1.00 0.00 C ATOM 1861 CG GLU C 20 3.278 23.827 -9.816 1.00 0.00 C ATOM 1862 CD GLU C 20 2.966 24.325 -11.205 1.00 0.00 C ATOM 1863 OE1 GLU C 20 3.389 25.448 -11.549 1.00 0.00 O ATOM 1864 OE2 GLU C 20 2.273 23.606 -11.951 1.00 0.00 O ATOM 0 H GLU C 20 3.278 22.705 -7.033 1.00 0.00 H new ATOM 0 HA GLU C 20 5.522 21.628 -8.491 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.413 23.842 -9.952 1.00 0.00 H new ATOM 0 HB3 GLU C 20 4.670 22.348 -10.488 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.494 23.140 -9.497 1.00 0.00 H new ATOM 0 HG3 GLU C 20 3.266 24.668 -9.123 1.00 0.00 H new ATOM 1871 N ILE C 21 6.802 23.777 -7.793 1.00 0.00 N ATOM 1872 CA ILE C 21 7.575 24.781 -7.118 1.00 0.00 C ATOM 1873 C ILE C 21 8.425 25.454 -8.155 1.00 0.00 C ATOM 1874 O ILE C 21 9.126 24.782 -8.903 1.00 0.00 O ATOM 1875 CB ILE C 21 8.451 24.203 -5.982 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.549 23.728 -4.841 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.453 25.241 -5.495 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.270 23.235 -3.605 1.00 0.00 C ATOM 0 H ILE C 21 7.311 23.285 -8.527 1.00 0.00 H new ATOM 0 HA ILE C 21 6.901 25.488 -6.634 1.00 0.00 H new ATOM 0 HB ILE C 21 9.019 23.353 -6.360 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.892 24.549 -4.554 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.912 22.926 -5.214 1.00 0.00 H new ATOM 0 HG21 ILE C 21 10.059 24.814 -4.696 1.00 0.00 H new ATOM 0 HG22 ILE C 21 10.099 25.539 -6.321 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.919 26.114 -5.119 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.540 22.922 -2.858 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.905 22.389 -3.868 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.885 24.038 -3.198 1.00 0.00 H new ATOM 1890 N GLU C 22 8.329 26.766 -8.220 1.00 0.00 N ATOM 1891 CA GLU C 22 9.029 27.521 -9.238 1.00 0.00 C ATOM 1892 C GLU C 22 8.692 27.001 -10.638 1.00 0.00 C ATOM 1893 O GLU C 22 9.576 26.808 -11.473 1.00 0.00 O ATOM 1894 CB GLU C 22 10.520 27.401 -8.967 1.00 0.00 C ATOM 1895 CG GLU C 22 11.369 28.466 -9.636 1.00 0.00 C ATOM 1896 CD GLU C 22 12.784 28.495 -9.102 1.00 0.00 C ATOM 1897 OE1 GLU C 22 13.635 27.740 -9.612 1.00 0.00 O ATOM 1898 OE2 GLU C 22 13.055 29.279 -8.169 1.00 0.00 O ATOM 0 H GLU C 22 7.773 27.332 -7.579 1.00 0.00 H new ATOM 0 HA GLU C 22 8.721 28.566 -9.201 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.685 27.446 -7.891 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.859 26.421 -9.301 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.393 28.286 -10.711 1.00 0.00 H new ATOM 0 HG3 GLU C 22 10.907 29.442 -9.487 1.00 0.00 H new ATOM 1905 N GLY C 23 7.413 26.732 -10.875 1.00 0.00 N ATOM 1906 CA GLY C 23 6.975 26.280 -12.184 1.00 0.00 C ATOM 1907 C GLY C 23 7.435 24.876 -12.537 1.00 0.00 C ATOM 1908 O GLY C 23 7.126 24.379 -13.622 1.00 0.00 O ATOM 0 H GLY C 23 6.669 26.819 -10.182 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.886 26.316 -12.224 1.00 0.00 H new ATOM 0 HA3 GLY C 23 7.345 26.973 -12.939 1.00 0.00 H new ATOM 1912 N THR C 24 8.169 24.228 -11.641 1.00 0.00 N ATOM 1913 CA THR C 24 8.764 22.933 -11.967 1.00 0.00 C ATOM 1914 C THR C 24 8.318 21.843 -10.979 1.00 0.00 C ATOM 1915 O THR C 24 7.852 22.155 -9.874 1.00 0.00 O ATOM 1916 CB THR C 24 10.308 23.069 -11.985 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.919 22.018 -12.744 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.886 23.064 -10.579 1.00 0.00 C ATOM 0 H THR C 24 8.366 24.568 -10.699 1.00 0.00 H new ATOM 0 HA THR C 24 8.418 22.627 -12.954 1.00 0.00 H new ATOM 0 HB THR C 24 10.528 24.026 -12.458 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.892 22.133 -12.738 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.970 23.161 -10.631 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.474 23.899 -10.013 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.629 22.128 -10.083 1.00 0.00 H new ATOM 1926 N PRO C 25 8.415 20.548 -11.374 1.00 0.00 N ATOM 1927 CA PRO C 25 8.130 19.418 -10.483 1.00 0.00 C ATOM 1928 C PRO C 25 8.928 19.510 -9.185 1.00 0.00 C ATOM 1929 O PRO C 25 10.122 19.817 -9.181 1.00 0.00 O ATOM 1930 CB PRO C 25 8.539 18.179 -11.297 1.00 0.00 C ATOM 1931 CG PRO C 25 9.373 18.716 -12.410 1.00 0.00 C ATOM 1932 CD PRO C 25 8.800 20.073 -12.712 1.00 0.00 C ATOM 0 HA PRO C 25 7.084 19.392 -10.178 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.101 17.472 -10.687 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.666 17.649 -11.677 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.421 18.787 -12.118 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.329 18.066 -13.284 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.532 20.729 -13.183 1.00 0.00 H new ATOM 0 HD3 PRO C 25 7.945 20.014 -13.386 1.00 0.00 H new ATOM 1940 N CYS C 26 8.246 19.233 -8.091 1.00 0.00 N ATOM 1941 CA CYS C 26 8.777 19.467 -6.761 1.00 0.00 C ATOM 1942 C CYS C 26 9.567 18.264 -6.230 1.00 0.00 C ATOM 1943 O CYS C 26 9.152 17.123 -6.421 1.00 0.00 O ATOM 1944 CB CYS C 26 7.613 19.797 -5.838 1.00 0.00 C ATOM 1945 SG CYS C 26 8.025 19.851 -4.062 1.00 0.00 S ATOM 0 H CYS C 26 7.306 18.838 -8.099 1.00 0.00 H new ATOM 0 HA CYS C 26 9.480 20.299 -6.802 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.201 20.763 -6.129 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.827 19.057 -5.991 1.00 0.00 H new ATOM 0 HG CYS C 26 6.952 19.632 -3.361 1.00 0.00 H new ATOM 1950 N PRO C 27 10.691 18.542 -5.520 1.00 0.00 N ATOM 1951 CA PRO C 27 11.632 17.558 -4.957 1.00 0.00 C ATOM 1952 C PRO C 27 11.068 16.166 -4.650 1.00 0.00 C ATOM 1953 O PRO C 27 11.627 15.159 -5.080 1.00 0.00 O ATOM 1954 CB PRO C 27 12.028 18.243 -3.652 1.00 0.00 C ATOM 1955 CG PRO C 27 12.009 19.710 -3.947 1.00 0.00 C ATOM 1956 CD PRO C 27 11.176 19.902 -5.208 1.00 0.00 C ATOM 0 HA PRO C 27 12.425 17.337 -5.671 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.331 17.995 -2.852 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.017 17.922 -3.325 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.579 20.265 -3.113 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.021 20.087 -4.093 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.350 20.593 -5.040 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.773 20.311 -6.023 1.00 0.00 H new ATOM 1964 N ALA C 28 9.962 16.112 -3.914 1.00 0.00 N ATOM 1965 CA ALA C 28 9.482 14.839 -3.376 1.00 0.00 C ATOM 1966 C ALA C 28 7.991 14.628 -3.618 1.00 0.00 C ATOM 1967 O ALA C 28 7.431 13.606 -3.235 1.00 0.00 O ATOM 1968 CB ALA C 28 9.795 14.751 -1.890 1.00 0.00 C ATOM 0 H ALA C 28 9.387 16.921 -3.678 1.00 0.00 H new ATOM 0 HA ALA C 28 10.005 14.044 -3.907 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.434 13.800 -1.498 1.00 0.00 H new ATOM 0 HB2 ALA C 28 10.872 14.820 -1.740 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.303 15.570 -1.365 1.00 0.00 H new ATOM 1974 N CYS C 29 7.342 15.596 -4.236 1.00 0.00 N ATOM 1975 CA CYS C 29 5.927 15.464 -4.544 1.00 0.00 C ATOM 1976 C CYS C 29 5.638 15.965 -5.953 1.00 0.00 C ATOM 1977 O CYS C 29 5.535 17.173 -6.183 1.00 0.00 O ATOM 1978 CB CYS C 29 5.075 16.230 -3.535 1.00 0.00 C ATOM 1979 SG CYS C 29 5.526 17.973 -3.379 1.00 0.00 S ATOM 0 H CYS C 29 7.765 16.475 -4.533 1.00 0.00 H new ATOM 0 HA CYS C 29 5.669 14.407 -4.484 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.028 16.160 -3.829 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.165 15.752 -2.560 1.00 0.00 H new ATOM 0 HG CYS C 29 6.649 18.188 -3.998 1.00 0.00 H new ATOM 1984 N SER C 30 5.506 15.038 -6.885 1.00 0.00 N ATOM 1985 CA SER C 30 5.295 15.373 -8.284 1.00 0.00 C ATOM 1986 C SER C 30 3.831 15.725 -8.580 1.00 0.00 C ATOM 1987 O SER C 30 3.182 15.078 -9.401 1.00 0.00 O ATOM 1988 CB SER C 30 5.743 14.194 -9.147 1.00 0.00 C ATOM 1989 OG SER C 30 7.036 13.760 -8.761 1.00 0.00 O ATOM 0 H SER C 30 5.542 14.036 -6.696 1.00 0.00 H new ATOM 0 HA SER C 30 5.886 16.258 -8.518 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.033 13.373 -9.049 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.749 14.486 -10.197 1.00 0.00 H new ATOM 0 HG SER C 30 7.308 13.004 -9.322 1.00 0.00 H new ATOM 1995 N GLY C 31 3.303 16.733 -7.887 1.00 0.00 N ATOM 1996 CA GLY C 31 1.960 17.196 -8.182 1.00 0.00 C ATOM 1997 C GLY C 31 0.936 16.431 -7.390 1.00 0.00 C ATOM 1998 O GLY C 31 -0.060 15.950 -7.927 1.00 0.00 O ATOM 0 H GLY C 31 3.777 17.232 -7.134 1.00 0.00 H new ATOM 0 HA2 GLY C 31 1.880 18.259 -7.954 1.00 0.00 H new ATOM 0 HA3 GLY C 31 1.759 17.083 -9.247 1.00 0.00 H new ATOM 2002 N LYS C 32 1.190 16.328 -6.099 1.00 0.00 N ATOM 2003 CA LYS C 32 0.406 15.490 -5.216 1.00 0.00 C ATOM 2004 C LYS C 32 -0.189 16.357 -4.117 1.00 0.00 C ATOM 2005 O LYS C 32 -1.345 16.201 -3.737 1.00 0.00 O ATOM 2006 CB LYS C 32 1.335 14.441 -4.610 1.00 0.00 C ATOM 2007 CG LYS C 32 2.298 13.861 -5.634 1.00 0.00 C ATOM 2008 CD LYS C 32 3.467 13.158 -4.982 1.00 0.00 C ATOM 2009 CE LYS C 32 3.029 11.912 -4.254 1.00 0.00 C ATOM 2010 NZ LYS C 32 2.288 10.992 -5.159 1.00 0.00 N ATOM 0 H LYS C 32 1.949 16.826 -5.633 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.402 14.999 -5.759 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.902 14.889 -3.794 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.739 13.637 -4.179 1.00 0.00 H new ATOM 0 HG2 LYS C 32 1.765 13.159 -6.275 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.668 14.660 -6.276 1.00 0.00 H new ATOM 0 HD2 LYS C 32 4.204 12.897 -5.741 1.00 0.00 H new ATOM 0 HD3 LYS C 32 3.956 13.836 -4.283 1.00 0.00 H new ATOM 0 HE2 LYS C 32 3.901 11.401 -3.846 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.395 12.185 -3.410 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 2.221 10.052 -4.719 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.332 11.365 -5.326 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 2.793 10.915 -6.065 1.00 0.00 H new ATOM 2024 N GLY C 33 0.630 17.284 -3.614 1.00 0.00 N ATOM 2025 CA GLY C 33 0.210 18.176 -2.573 1.00 0.00 C ATOM 2026 C GLY C 33 0.976 17.900 -1.303 1.00 0.00 C ATOM 2027 O GLY C 33 1.436 18.820 -0.631 1.00 0.00 O ATOM 0 H GLY C 33 1.591 17.423 -3.925 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.369 19.209 -2.884 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.859 18.058 -2.394 1.00 0.00 H new ATOM 2031 N VAL C 34 1.195 16.626 -1.011 1.00 0.00 N ATOM 2032 CA VAL C 34 1.848 16.243 0.234 1.00 0.00 C ATOM 2033 C VAL C 34 3.097 15.400 -0.007 1.00 0.00 C ATOM 2034 O VAL C 34 3.359 14.949 -1.127 1.00 0.00 O ATOM 2035 CB VAL C 34 0.884 15.442 1.143 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.324 16.282 1.535 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.437 14.159 0.457 1.00 0.00 C ATOM 0 H VAL C 34 0.933 15.845 -1.613 1.00 0.00 H new ATOM 0 HA VAL C 34 2.139 17.172 0.724 1.00 0.00 H new ATOM 0 HB VAL C 34 1.425 15.179 2.052 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.984 15.695 2.173 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.009 17.168 2.075 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.863 16.585 0.637 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.240 13.612 1.114 1.00 0.00 H new ATOM 0 HG22 VAL C 34 -0.078 14.404 -0.472 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.308 13.541 0.238 1.00 0.00 H new ATOM 2047 N ILE C 35 3.872 15.238 1.057 1.00 0.00 N ATOM 2048 CA ILE C 35 5.034 14.358 1.069 1.00 0.00 C ATOM 2049 C ILE C 35 4.977 13.442 2.292 1.00 0.00 C ATOM 2050 O ILE C 35 4.234 13.703 3.232 1.00 0.00 O ATOM 2051 CB ILE C 35 6.355 15.156 1.098 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.306 16.197 2.214 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.612 15.820 -0.246 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.623 16.896 2.466 1.00 0.00 C ATOM 0 H ILE C 35 3.711 15.717 1.943 1.00 0.00 H new ATOM 0 HA ILE C 35 5.010 13.768 0.153 1.00 0.00 H new ATOM 0 HB ILE C 35 7.177 14.468 1.294 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.552 16.944 1.966 1.00 0.00 H new ATOM 0 HG13 ILE C 35 5.983 15.712 3.135 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.548 16.377 -0.204 1.00 0.00 H new ATOM 0 HG22 ILE C 35 6.679 15.057 -1.022 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.794 16.502 -0.477 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.503 17.619 3.273 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.377 16.161 2.747 1.00 0.00 H new ATOM 0 HD13 ILE C 35 7.940 17.413 1.560 1.00 0.00 H new ATOM 2066 N LEU C 36 5.770 12.381 2.279 1.00 0.00 N ATOM 2067 CA LEU C 36 5.689 11.348 3.312 1.00 0.00 C ATOM 2068 C LEU C 36 6.566 11.637 4.530 1.00 0.00 C ATOM 2069 O LEU C 36 7.475 12.468 4.490 1.00 0.00 O ATOM 2070 CB LEU C 36 6.085 9.987 2.734 1.00 0.00 C ATOM 2071 CG LEU C 36 5.263 9.524 1.534 1.00 0.00 C ATOM 2072 CD1 LEU C 36 5.877 10.006 0.228 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.133 8.016 1.545 1.00 0.00 C ATOM 0 H LEU C 36 6.479 12.209 1.566 1.00 0.00 H new ATOM 0 HA LEU C 36 4.652 11.341 3.647 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.134 10.026 2.441 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.002 9.238 3.522 1.00 0.00 H new ATOM 0 HG LEU C 36 4.267 9.961 1.610 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.270 9.661 -0.609 1.00 0.00 H new ATOM 0 HD12 LEU C 36 5.915 11.095 0.224 1.00 0.00 H new ATOM 0 HD13 LEU C 36 6.887 9.608 0.132 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.545 7.695 0.685 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.124 7.565 1.495 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.636 7.700 2.462 1.00 0.00 H new ATOM 2085 N THR C 37 6.266 10.916 5.607 1.00 0.00 N ATOM 2086 CA THR C 37 7.069 10.924 6.821 1.00 0.00 C ATOM 2087 C THR C 37 7.840 9.611 6.892 1.00 0.00 C ATOM 2088 O THR C 37 7.625 8.754 6.046 1.00 0.00 O ATOM 2089 CB THR C 37 6.180 11.048 8.078 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.342 9.889 8.202 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.300 12.286 8.011 1.00 0.00 C ATOM 0 H THR C 37 5.451 10.305 5.660 1.00 0.00 H new ATOM 0 HA THR C 37 7.744 11.779 6.792 1.00 0.00 H new ATOM 0 HB THR C 37 6.838 11.130 8.943 1.00 0.00 H new ATOM 0 HG1 THR C 37 5.028 9.810 9.127 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.686 12.345 8.910 1.00 0.00 H new ATOM 0 HG22 THR C 37 5.927 13.175 7.941 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.655 12.227 7.134 1.00 0.00 H new ATOM 2099 N ALA C 38 8.713 9.429 7.876 1.00 0.00 N ATOM 2100 CA ALA C 38 9.487 8.185 7.979 1.00 0.00 C ATOM 2101 C ALA C 38 8.564 6.969 8.060 1.00 0.00 C ATOM 2102 O ALA C 38 8.790 5.956 7.390 1.00 0.00 O ATOM 2103 CB ALA C 38 10.419 8.239 9.177 1.00 0.00 C ATOM 0 H ALA C 38 8.905 10.113 8.608 1.00 0.00 H new ATOM 0 HA ALA C 38 10.091 8.083 7.077 1.00 0.00 H new ATOM 0 HB1 ALA C 38 10.985 7.310 9.239 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.107 9.077 9.065 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.834 8.369 10.087 1.00 0.00 H new ATOM 2109 N GLN C 39 7.534 7.078 8.889 1.00 0.00 N ATOM 2110 CA GLN C 39 6.469 6.082 8.958 1.00 0.00 C ATOM 2111 C GLN C 39 5.901 5.804 7.557 1.00 0.00 C ATOM 2112 O GLN C 39 5.843 4.656 7.112 1.00 0.00 O ATOM 2113 CB GLN C 39 5.375 6.610 9.897 1.00 0.00 C ATOM 2114 CG GLN C 39 4.296 5.607 10.275 1.00 0.00 C ATOM 2115 CD GLN C 39 4.810 4.464 11.129 1.00 0.00 C ATOM 2116 OE1 GLN C 39 5.809 4.594 11.842 1.00 0.00 O ATOM 2117 NE2 GLN C 39 4.103 3.347 11.098 1.00 0.00 N ATOM 0 H GLN C 39 7.412 7.859 9.533 1.00 0.00 H new ATOM 0 HA GLN C 39 6.861 5.141 9.344 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.848 6.970 10.811 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.899 7.469 9.425 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.502 6.124 10.813 1.00 0.00 H new ATOM 0 HG3 GLN C 39 3.853 5.201 9.366 1.00 0.00 H new ATOM 0 HE21 GLN C 39 3.283 3.279 10.495 1.00 0.00 H new ATOM 0 HE22 GLN C 39 4.377 2.553 11.677 1.00 0.00 H new ATOM 2126 N GLY C 40 5.508 6.870 6.868 1.00 0.00 N ATOM 2127 CA GLY C 40 4.998 6.752 5.516 1.00 0.00 C ATOM 2128 C GLY C 40 6.034 6.245 4.524 1.00 0.00 C ATOM 2129 O GLY C 40 5.692 5.555 3.567 1.00 0.00 O ATOM 0 H GLY C 40 5.535 7.824 7.228 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.143 6.076 5.515 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.635 7.725 5.186 1.00 0.00 H new ATOM 2133 N TYR C 41 7.303 6.563 4.758 1.00 0.00 N ATOM 2134 CA TYR C 41 8.378 6.152 3.859 1.00 0.00 C ATOM 2135 C TYR C 41 8.601 4.650 3.921 1.00 0.00 C ATOM 2136 O TYR C 41 8.929 4.024 2.912 1.00 0.00 O ATOM 2137 CB TYR C 41 9.682 6.871 4.230 1.00 0.00 C ATOM 2138 CG TYR C 41 9.959 8.147 3.460 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.627 8.116 2.242 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.572 9.384 3.957 1.00 0.00 C ATOM 2141 CE1 TYR C 41 10.897 9.280 1.544 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.840 10.550 3.269 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.500 10.494 2.063 1.00 0.00 C ATOM 2144 OH TYR C 41 10.770 11.659 1.380 1.00 0.00 O ATOM 0 H TYR C 41 7.614 7.105 5.564 1.00 0.00 H new ATOM 0 HA TYR C 41 8.084 6.421 2.845 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.658 7.106 5.294 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.514 6.184 4.074 1.00 0.00 H new ATOM 0 HD1 TYR C 41 10.941 7.167 1.833 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.051 9.435 4.901 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.416 9.238 0.598 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.533 11.502 3.675 1.00 0.00 H new ATOM 0 HH TYR C 41 10.421 12.423 1.885 1.00 0.00 H new ATOM 2154 N THR C 42 8.391 4.068 5.087 1.00 0.00 N ATOM 2155 CA THR C 42 8.479 2.627 5.234 1.00 0.00 C ATOM 2156 C THR C 42 7.315 1.956 4.515 1.00 0.00 C ATOM 2157 O THR C 42 7.441 0.858 3.962 1.00 0.00 O ATOM 2158 CB THR C 42 8.445 2.241 6.719 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.433 2.989 7.431 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.694 0.754 6.902 1.00 0.00 C ATOM 0 H THR C 42 8.159 4.569 5.944 1.00 0.00 H new ATOM 0 HA THR C 42 9.419 2.293 4.796 1.00 0.00 H new ATOM 0 HB THR C 42 7.455 2.471 7.113 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.142 3.921 7.513 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.664 0.508 7.963 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.924 0.189 6.377 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.673 0.496 6.497 1.00 0.00 H new ATOM 2168 N LEU C 43 6.199 2.665 4.474 1.00 0.00 N ATOM 2169 CA LEU C 43 4.988 2.147 3.867 1.00 0.00 C ATOM 2170 C LEU C 43 4.970 2.441 2.375 1.00 0.00 C ATOM 2171 O LEU C 43 4.176 1.859 1.651 1.00 0.00 O ATOM 2172 CB LEU C 43 3.732 2.746 4.529 1.00 0.00 C ATOM 2173 CG LEU C 43 2.988 1.828 5.522 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.930 1.334 6.606 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.813 2.565 6.141 1.00 0.00 C ATOM 0 H LEU C 43 6.109 3.606 4.857 1.00 0.00 H new ATOM 0 HA LEU C 43 4.979 1.068 4.020 1.00 0.00 H new ATOM 0 HB2 LEU C 43 4.021 3.657 5.053 1.00 0.00 H new ATOM 0 HB3 LEU C 43 3.036 3.038 3.743 1.00 0.00 H new ATOM 0 HG LEU C 43 2.612 0.964 4.975 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.385 0.689 7.295 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.746 0.772 6.151 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.336 2.186 7.151 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.297 1.906 6.839 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.175 3.445 6.673 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.123 2.874 5.356 1.00 0.00 H new ATOM 2187 N LEU C 44 5.854 3.316 1.893 1.00 0.00 N ATOM 2188 CA LEU C 44 5.863 3.633 0.473 1.00 0.00 C ATOM 2189 C LEU C 44 6.680 2.595 -0.287 1.00 0.00 C ATOM 2190 O LEU C 44 6.241 2.092 -1.311 1.00 0.00 O ATOM 2191 CB LEU C 44 6.358 5.078 0.203 1.00 0.00 C ATOM 2192 CG LEU C 44 7.875 5.308 0.031 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.346 4.885 -1.355 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.223 6.771 0.242 1.00 0.00 C ATOM 0 H LEU C 44 6.554 3.804 2.452 1.00 0.00 H new ATOM 0 HA LEU C 44 4.837 3.594 0.107 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.862 5.437 -0.699 1.00 0.00 H new ATOM 0 HB3 LEU C 44 6.017 5.706 1.026 1.00 0.00 H new ATOM 0 HG LEU C 44 8.380 4.698 0.780 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.418 5.060 -1.444 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.138 3.825 -1.502 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.820 5.467 -2.112 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.297 6.911 0.116 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.689 7.381 -0.487 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.933 7.072 1.249 1.00 0.00 H new ATOM 2206 N ASP C 45 7.846 2.234 0.241 1.00 0.00 N ATOM 2207 CA ASP C 45 8.726 1.286 -0.442 1.00 0.00 C ATOM 2208 C ASP C 45 8.132 -0.107 -0.390 1.00 0.00 C ATOM 2209 O ASP C 45 8.392 -0.939 -1.252 1.00 0.00 O ATOM 2210 CB ASP C 45 10.123 1.298 0.189 1.00 0.00 C ATOM 2211 CG ASP C 45 11.022 0.182 -0.326 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.435 0.237 -1.504 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.324 -0.751 0.451 1.00 0.00 O ATOM 0 H ASP C 45 8.203 2.579 1.132 1.00 0.00 H new ATOM 0 HA ASP C 45 8.820 1.587 -1.485 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.597 2.259 -0.011 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.027 1.209 1.271 1.00 0.00 H new ATOM 2218 N PHE C 46 7.272 -0.330 0.587 1.00 0.00 N ATOM 2219 CA PHE C 46 6.559 -1.586 0.699 1.00 0.00 C ATOM 2220 C PHE C 46 5.478 -1.668 -0.358 1.00 0.00 C ATOM 2221 O PHE C 46 5.319 -2.688 -1.023 1.00 0.00 O ATOM 2222 CB PHE C 46 5.913 -1.645 2.084 1.00 0.00 C ATOM 2223 CG PHE C 46 5.247 -2.944 2.429 1.00 0.00 C ATOM 2224 CD1 PHE C 46 3.934 -3.186 2.059 1.00 0.00 C ATOM 2225 CD2 PHE C 46 5.928 -3.915 3.143 1.00 0.00 C ATOM 2226 CE1 PHE C 46 3.315 -4.372 2.392 1.00 0.00 C ATOM 2227 CE2 PHE C 46 5.314 -5.105 3.478 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.005 -5.332 3.101 1.00 0.00 C ATOM 0 H PHE C 46 7.051 0.347 1.317 1.00 0.00 H new ATOM 0 HA PHE C 46 7.250 -2.417 0.559 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.678 -1.439 2.832 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.174 -0.847 2.156 1.00 0.00 H new ATOM 0 HD1 PHE C 46 3.389 -2.437 1.503 1.00 0.00 H new ATOM 0 HD2 PHE C 46 6.951 -3.740 3.441 1.00 0.00 H new ATOM 0 HE1 PHE C 46 2.291 -4.549 2.098 1.00 0.00 H new ATOM 0 HE2 PHE C 46 5.856 -5.856 4.033 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.522 -6.262 3.362 1.00 0.00 H new ATOM 2238 N ILE C 47 4.758 -0.585 -0.546 1.00 0.00 N ATOM 2239 CA ILE C 47 3.664 -0.607 -1.487 1.00 0.00 C ATOM 2240 C ILE C 47 4.175 -0.466 -2.918 1.00 0.00 C ATOM 2241 O ILE C 47 3.580 -0.992 -3.855 1.00 0.00 O ATOM 2242 CB ILE C 47 2.618 0.473 -1.167 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.243 1.866 -1.268 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.060 0.233 0.226 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.309 2.995 -0.898 1.00 0.00 C ATOM 0 H ILE C 47 4.906 0.305 -0.070 1.00 0.00 H new ATOM 0 HA ILE C 47 3.171 -1.575 -1.394 1.00 0.00 H new ATOM 0 HB ILE C 47 1.805 0.417 -1.891 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.118 1.907 -0.619 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.595 2.021 -2.288 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.318 0.997 0.457 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.593 -0.751 0.266 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.869 0.281 0.955 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.831 3.947 -0.997 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.445 2.985 -1.562 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.976 2.869 0.132 1.00 0.00 H new ATOM 2257 N GLN C 48 5.303 0.214 -3.070 1.00 0.00 N ATOM 2258 CA GLN C 48 6.025 0.230 -4.324 1.00 0.00 C ATOM 2259 C GLN C 48 6.378 -1.193 -4.711 1.00 0.00 C ATOM 2260 O GLN C 48 6.003 -1.671 -5.762 1.00 0.00 O ATOM 2261 CB GLN C 48 7.307 1.056 -4.185 1.00 0.00 C ATOM 2262 CG GLN C 48 7.065 2.550 -4.038 1.00 0.00 C ATOM 2263 CD GLN C 48 6.602 3.210 -5.325 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.015 2.568 -6.196 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.853 4.501 -5.451 1.00 0.00 N ATOM 0 H GLN C 48 5.737 0.765 -2.330 1.00 0.00 H new ATOM 0 HA GLN C 48 5.399 0.680 -5.094 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.864 0.701 -3.318 1.00 0.00 H new ATOM 0 HB3 GLN C 48 7.935 0.884 -5.059 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.317 2.716 -3.263 1.00 0.00 H new ATOM 0 HG3 GLN C 48 7.984 3.029 -3.702 1.00 0.00 H new ATOM 0 HE21 GLN C 48 7.342 5.000 -4.708 1.00 0.00 H new ATOM 0 HE22 GLN C 48 6.558 4.998 -6.291 1.00 0.00 H new ATOM 2274 N LYS C 49 6.992 -1.887 -3.779 1.00 0.00 N ATOM 2275 CA LYS C 49 7.643 -3.162 -4.038 1.00 0.00 C ATOM 2276 C LYS C 49 6.661 -4.333 -4.111 1.00 0.00 C ATOM 2277 O LYS C 49 7.052 -5.457 -4.384 1.00 0.00 O ATOM 2278 CB LYS C 49 8.700 -3.348 -2.948 1.00 0.00 C ATOM 2279 CG LYS C 49 9.324 -4.728 -2.823 1.00 0.00 C ATOM 2280 CD LYS C 49 10.574 -4.673 -1.957 1.00 0.00 C ATOM 2281 CE LYS C 49 10.415 -3.676 -0.817 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.625 -3.590 0.036 1.00 0.00 N ATOM 0 H LYS C 49 7.057 -1.583 -2.808 1.00 0.00 H new ATOM 0 HA LYS C 49 8.109 -3.150 -5.023 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.500 -2.629 -3.125 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.248 -3.092 -1.990 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.604 -5.421 -2.388 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.577 -5.110 -3.812 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.781 -5.663 -1.551 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.431 -4.394 -2.570 1.00 0.00 H new ATOM 0 HE2 LYS C 49 10.194 -2.691 -1.228 1.00 0.00 H new ATOM 0 HE3 LYS C 49 9.562 -3.964 -0.203 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.767 -2.605 0.338 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.503 -4.195 0.873 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.454 -3.910 -0.504 1.00 0.00 H new ATOM 2296 N HIS C 50 5.382 -4.112 -3.862 1.00 0.00 N ATOM 2297 CA HIS C 50 4.450 -5.196 -4.171 1.00 0.00 C ATOM 2298 C HIS C 50 3.422 -4.838 -5.246 1.00 0.00 C ATOM 2299 O HIS C 50 2.590 -5.670 -5.595 1.00 0.00 O ATOM 2300 CB HIS C 50 3.761 -5.664 -2.889 1.00 0.00 C ATOM 2301 CG HIS C 50 4.739 -5.968 -1.792 1.00 0.00 C ATOM 2302 ND1 HIS C 50 4.783 -5.261 -0.616 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.757 -6.861 -1.725 1.00 0.00 C ATOM 2304 CE1 HIS C 50 5.784 -5.694 0.121 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.393 -6.665 -0.523 1.00 0.00 N ATOM 0 H HIS C 50 4.979 -3.259 -3.475 1.00 0.00 H new ATOM 0 HA HIS C 50 5.040 -6.009 -4.593 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.067 -4.894 -2.551 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.170 -6.555 -3.102 1.00 0.00 H new ATOM 0 HD2 HIS C 50 6.019 -7.591 -2.477 1.00 0.00 H new ATOM 0 HE1 HIS C 50 6.059 -5.314 1.094 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.203 -7.186 -0.186 1.00 0.00 H new ATOM 2314 N LEU C 51 3.467 -3.619 -5.772 1.00 0.00 N ATOM 2315 CA LEU C 51 2.610 -3.260 -6.910 1.00 0.00 C ATOM 2316 C LEU C 51 3.441 -2.912 -8.139 1.00 0.00 C ATOM 2317 O LEU C 51 2.999 -3.076 -9.276 1.00 0.00 O ATOM 2318 CB LEU C 51 1.718 -2.051 -6.592 1.00 0.00 C ATOM 2319 CG LEU C 51 0.525 -2.291 -5.651 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.358 -3.421 -6.155 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.992 -2.571 -4.239 1.00 0.00 C ATOM 0 H LEU C 51 4.075 -2.870 -5.440 1.00 0.00 H new ATOM 0 HA LEU C 51 1.989 -4.134 -7.108 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.344 -1.274 -6.153 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.333 -1.657 -7.533 1.00 0.00 H new ATOM 0 HG LEU C 51 -0.070 -1.378 -5.639 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.192 -3.565 -5.468 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.742 -3.169 -7.144 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.226 -4.340 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.128 -2.737 -3.596 1.00 0.00 H new ATOM 0 HD22 LEU C 51 1.624 -3.459 -4.234 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.562 -1.719 -3.868 1.00 0.00 H new ATOM 2333 N ASN C 52 4.647 -2.436 -7.894 1.00 0.00 N ATOM 2334 CA ASN C 52 5.424 -1.731 -8.906 1.00 0.00 C ATOM 2335 C ASN C 52 6.910 -2.115 -8.875 1.00 0.00 C ATOM 2336 O ASN C 52 7.602 -2.045 -9.891 1.00 0.00 O ATOM 2337 CB ASN C 52 5.242 -0.230 -8.665 1.00 0.00 C ATOM 2338 CG ASN C 52 4.222 0.384 -9.606 1.00 0.00 C ATOM 2339 OD1 ASN C 52 4.569 0.906 -10.665 1.00 0.00 O ATOM 2340 ND2 ASN C 52 2.953 0.317 -9.233 1.00 0.00 N ATOM 0 H ASN C 52 5.118 -2.524 -6.993 1.00 0.00 H new ATOM 0 HA ASN C 52 5.065 -2.011 -9.896 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.928 -0.065 -7.634 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.200 0.275 -8.791 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.224 0.706 -9.831 1.00 0.00 H new ATOM 0 HD22 ASN C 52 2.704 -0.124 -8.347 1.00 0.00 H new ATOM 2347 N LYS C 53 7.393 -2.484 -7.704 1.00 0.00 N ATOM 2348 CA LYS C 53 8.749 -2.985 -7.529 1.00 0.00 C ATOM 2349 C LYS C 53 8.703 -4.471 -7.166 1.00 0.00 C ATOM 2350 O LYS C 53 9.222 -4.852 -6.097 1.00 0.00 O ATOM 2351 CB LYS C 53 9.467 -2.190 -6.427 1.00 0.00 C ATOM 2352 CG LYS C 53 10.517 -1.225 -6.950 1.00 0.00 C ATOM 2353 CD LYS C 53 11.346 -0.638 -5.813 1.00 0.00 C ATOM 2354 CE LYS C 53 10.584 0.429 -5.042 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.418 1.059 -3.980 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.111 -5.249 -7.941 1.00 0.00 O ATOM 0 H LYS C 53 6.854 -2.445 -6.839 1.00 0.00 H new ATOM 0 HA LYS C 53 9.301 -2.862 -8.461 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.727 -1.631 -5.855 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.941 -2.889 -5.738 1.00 0.00 H new ATOM 0 HG2 LYS C 53 11.172 -1.742 -7.651 1.00 0.00 H new ATOM 0 HG3 LYS C 53 10.031 -0.420 -7.502 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.642 -1.435 -5.131 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.262 -0.208 -6.217 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.238 1.197 -5.734 1.00 0.00 H new ATOM 0 HE3 LYS C 53 9.697 -0.015 -4.590 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.414 2.092 -4.102 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 11.029 0.819 -3.046 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.394 0.706 -4.050 1.00 0.00 H new