USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1123 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 130 HIS : no HD1:sc= -0.0959 K(o=-0.097,f=-3.1) USER MOD Set 1.2: A 139 HIS : no HD1:sc=-0.00153 X(o=-0.097,f=-0.16) USER MOD Set 2.1: A 91 THR OG1 : rot 110:sc= 1.21 USER MOD Set 2.2: A 116 THR OG1 : rot 171:sc= 1.06 USER MOD Set 3.1: A 11 LYS NZ :NH3+ 145:sc= 0.478 (180deg=-0.305) USER MOD Set 3.2: A 68 TYR OH : rot 15:sc= 0.646 USER MOD Set 4.1: A 64 THR OG1 : rot 180:sc= 0.886 USER MOD Set 4.2: A 132 SER OG : rot 131:sc= 1.04 USER MOD Set 5.1: A 39 SER OG : rot -33:sc= 0.118 USER MOD Set 5.2: A 62 CYS SG : rot 180:sc= 0.0896 USER MOD Set 6.1: A 35 CYS SG : rot -119:sc= -1.51! USER MOD Set 6.2: A 96 GLN : amide:sc= 1.27 K(o=-0.24,f=-1.3) USER MOD Set 7.1: A 14 GLN : amide:sc= -1.42 K(o=-1.8,f=-3.3!) USER MOD Set 7.2: A 133 TYR OH : rot 120:sc= -0.372 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0.938 (180deg=0.937) USER MOD Single : A 3 HIS : no HD1:sc= -0.185 X(o=-0.18,f=0) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot -117:sc= 0.123 USER MOD Single : A 16 ASN : amide:sc= -0.16 X(o=-0.16,f=0) USER MOD Single : A 17 HIS : no HE2:sc= -0.425 K(o=-0.42,f=-3.2!) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -110:sc= -1.28 (180deg=-8.12!) USER MOD Single : A 23 HIS : no HD1:sc= -0.215 X(o=-0.22,f=-0.66) USER MOD Single : A 24 SER OG : rot 69:sc= 1.22 USER MOD Single : A 25 HIS : no HE2:sc= 1.11 K(o=1.1,f=-5.6!) USER MOD Single : A 36 THR OG1 : rot 106:sc= 1.54 USER MOD Single : A 48 HIS : no HE2:sc= 0.227 K(o=0.23,f=-5.1!) USER MOD Single : A 49 ASN : amide:sc= -0.953 K(o=-0.95,f=-1.5) USER MOD Single : A 55 TYR OH : rot 51:sc= 1.23 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HE2:sc= -0.651 K(o=-0.65,f=-2.6) USER MOD Single : A 73 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 74 MET CE :methyl 164:sc= -0.284 (180deg=-0.802) USER MOD Single : A 84 CYS SG : rot -42:sc= -1.02 USER MOD Single : A 86 SER OG : rot 180:sc= 0.00909 USER MOD Single : A 87 MET CE :methyl -178:sc= -0.186 (180deg=-0.187) USER MOD Single : A 88 TYR OH : rot 1:sc= 1.3 USER MOD Single : A 89 GLN : amide:sc= -0.194 K(o=-0.19,f=-2!) USER MOD Single : A 94 GLN : amide:sc= 0.105 X(o=0.1,f=-0.016) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN :FLIP amide:sc= -0.77 F(o=-1.7!,f=-0.77) USER MOD Single : A 112 CYS SG : rot -170:sc= -2.89! USER MOD Single : A 115 TYR OH : rot 70:sc= 0 USER MOD Single : A 117 THR OG1 : rot -107:sc= 0.226 USER MOD Single : A 119 THR OG1 : rot -53:sc= 0.107 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 130:sc= -0.023 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.602 K(o=0.6,f=0) USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.668 -6.060 6.905 1.00 0.00 N ATOM 2 CA MET A 1 -16.273 -4.724 6.974 1.00 0.00 C ATOM 3 C MET A 1 -15.209 -3.710 7.380 1.00 0.00 C ATOM 4 O MET A 1 -15.257 -3.133 8.470 1.00 0.00 O ATOM 5 CB MET A 1 -17.505 -4.709 7.895 1.00 0.00 C ATOM 6 CG MET A 1 -18.330 -3.438 7.665 1.00 0.00 C ATOM 7 SD MET A 1 -19.831 -3.268 8.666 1.00 0.00 S ATOM 8 CE MET A 1 -19.132 -2.565 10.187 1.00 0.00 C ATOM 0 H1 MET A 1 -16.387 -6.752 6.612 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.891 -6.054 6.214 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.297 -6.322 7.841 1.00 0.00 H new ATOM 0 HA MET A 1 -16.645 -4.441 5.989 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.120 -5.589 7.704 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.189 -4.761 8.937 1.00 0.00 H new ATOM 0 HG2 MET A 1 -17.691 -2.576 7.856 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.613 -3.399 6.613 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.930 -2.399 10.911 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.401 -3.257 10.605 1.00 0.00 H new ATOM 0 HE3 MET A 1 -18.645 -1.617 9.959 1.00 0.00 H new ATOM 18 N ALA A 2 -14.244 -3.477 6.496 1.00 0.00 N ATOM 19 CA ALA A 2 -13.316 -2.365 6.545 1.00 0.00 C ATOM 20 C ALA A 2 -13.004 -1.986 5.098 1.00 0.00 C ATOM 21 O ALA A 2 -13.287 -2.758 4.177 1.00 0.00 O ATOM 22 CB ALA A 2 -12.063 -2.781 7.327 1.00 0.00 C ATOM 0 H ALA A 2 -14.085 -4.087 5.694 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.732 -1.500 7.061 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -11.364 -1.946 7.365 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.345 -3.065 8.341 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.589 -3.628 6.831 1.00 0.00 H new ATOM 28 N HIS A 3 -12.396 -0.821 4.901 1.00 0.00 N ATOM 29 CA HIS A 3 -11.925 -0.352 3.605 1.00 0.00 C ATOM 30 C HIS A 3 -10.472 0.046 3.791 1.00 0.00 C ATOM 31 O HIS A 3 -10.131 0.771 4.741 1.00 0.00 O ATOM 32 CB HIS A 3 -12.773 0.824 3.102 1.00 0.00 C ATOM 33 CG HIS A 3 -14.246 0.521 3.000 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.255 1.170 3.675 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.822 -0.439 2.214 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.416 0.607 3.301 1.00 0.00 C ATOM 37 NE2 HIS A 3 -16.197 -0.414 2.458 1.00 0.00 N ATOM 0 H HIS A 3 -12.213 -0.161 5.657 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.015 -1.132 2.849 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -12.633 1.672 3.772 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.407 1.129 2.122 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -14.307 -1.097 1.529 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.391 0.931 3.633 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -16.897 -1.047 2.071 1.00 0.00 H new ATOM 45 N ILE A 4 -9.601 -0.456 2.927 1.00 0.00 N ATOM 46 CA ILE A 4 -8.180 -0.158 2.967 1.00 0.00 C ATOM 47 C ILE A 4 -7.785 0.373 1.602 1.00 0.00 C ATOM 48 O ILE A 4 -8.401 0.040 0.588 1.00 0.00 O ATOM 49 CB ILE A 4 -7.353 -1.387 3.405 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.423 -2.542 2.384 1.00 0.00 C ATOM 51 CG2 ILE A 4 -7.790 -1.829 4.815 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.443 -3.677 2.698 1.00 0.00 C ATOM 0 H ILE A 4 -9.866 -1.088 2.171 1.00 0.00 H new ATOM 0 HA ILE A 4 -7.967 0.602 3.719 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.303 -1.096 3.442 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.437 -2.940 2.363 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.213 -2.153 1.388 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.205 -2.696 5.122 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.626 -1.013 5.519 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.848 -2.091 4.803 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.539 -4.459 1.945 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.424 -3.290 2.691 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.668 -4.090 3.681 1.00 0.00 H new ATOM 64 N PHE A 5 -6.748 1.196 1.586 1.00 0.00 N ATOM 65 CA PHE A 5 -6.139 1.662 0.362 1.00 0.00 C ATOM 66 C PHE A 5 -4.790 0.969 0.239 1.00 0.00 C ATOM 67 O PHE A 5 -4.043 0.891 1.215 1.00 0.00 O ATOM 68 CB PHE A 5 -6.050 3.182 0.411 1.00 0.00 C ATOM 69 CG PHE A 5 -5.513 3.807 -0.852 1.00 0.00 C ATOM 70 CD1 PHE A 5 -6.353 3.960 -1.968 1.00 0.00 C ATOM 71 CD2 PHE A 5 -4.186 4.265 -0.906 1.00 0.00 C ATOM 72 CE1 PHE A 5 -5.885 4.612 -3.118 1.00 0.00 C ATOM 73 CE2 PHE A 5 -3.711 4.888 -2.070 1.00 0.00 C ATOM 74 CZ PHE A 5 -4.567 5.096 -3.163 1.00 0.00 C ATOM 0 H PHE A 5 -6.306 1.559 2.431 1.00 0.00 H new ATOM 0 HA PHE A 5 -6.721 1.418 -0.527 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -7.042 3.587 0.611 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -5.413 3.471 1.247 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -7.361 3.575 -1.940 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -3.534 4.138 -0.055 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.538 4.742 -3.969 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -2.681 5.209 -2.125 1.00 0.00 H new ATOM 0 HZ PHE A 5 -4.214 5.626 -4.035 1.00 0.00 H new ATOM 84 N VAL A 6 -4.488 0.413 -0.927 1.00 0.00 N ATOM 85 CA VAL A 6 -3.244 -0.317 -1.181 1.00 0.00 C ATOM 86 C VAL A 6 -2.088 0.642 -1.488 1.00 0.00 C ATOM 87 O VAL A 6 -2.312 1.843 -1.685 1.00 0.00 O ATOM 88 CB VAL A 6 -3.478 -1.338 -2.310 1.00 0.00 C ATOM 89 CG1 VAL A 6 -4.186 -2.575 -1.755 1.00 0.00 C ATOM 90 CG2 VAL A 6 -4.312 -0.783 -3.468 1.00 0.00 C ATOM 0 H VAL A 6 -5.106 0.455 -1.737 1.00 0.00 H new ATOM 0 HA VAL A 6 -2.952 -0.862 -0.283 1.00 0.00 H new ATOM 0 HB VAL A 6 -2.492 -1.588 -2.701 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.348 -3.293 -2.559 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -3.569 -3.031 -0.981 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -5.146 -2.284 -1.329 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -4.438 -1.554 -4.228 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -5.290 -0.475 -3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -3.802 0.076 -3.904 1.00 0.00 H new ATOM 100 N TYR A 7 -0.844 0.141 -1.505 1.00 0.00 N ATOM 101 CA TYR A 7 0.341 0.895 -1.939 1.00 0.00 C ATOM 102 C TYR A 7 0.940 0.349 -3.238 1.00 0.00 C ATOM 103 O TYR A 7 1.454 1.132 -4.037 1.00 0.00 O ATOM 104 CB TYR A 7 1.389 1.019 -0.823 1.00 0.00 C ATOM 105 CG TYR A 7 1.828 -0.243 -0.099 1.00 0.00 C ATOM 106 CD1 TYR A 7 1.105 -0.653 1.029 1.00 0.00 C ATOM 107 CD2 TYR A 7 3.021 -0.915 -0.429 1.00 0.00 C ATOM 108 CE1 TYR A 7 1.571 -1.694 1.841 1.00 0.00 C ATOM 109 CE2 TYR A 7 3.512 -1.948 0.394 1.00 0.00 C ATOM 110 CZ TYR A 7 2.783 -2.342 1.537 1.00 0.00 C ATOM 111 OH TYR A 7 3.185 -3.355 2.347 1.00 0.00 O ATOM 0 H TYR A 7 -0.630 -0.813 -1.214 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.002 1.906 -2.161 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.278 1.481 -1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 7 0.999 1.711 -0.077 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.176 -0.160 1.275 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.564 -0.636 -1.320 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.998 -2.001 2.704 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.444 -2.437 0.151 1.00 0.00 H new ATOM 0 HH TYR A 7 4.037 -3.715 2.022 1.00 0.00 H new ATOM 121 N GLY A 8 0.807 -0.955 -3.501 1.00 0.00 N ATOM 122 CA GLY A 8 1.111 -1.548 -4.803 1.00 0.00 C ATOM 123 C GLY A 8 1.629 -2.981 -4.723 1.00 0.00 C ATOM 124 O GLY A 8 1.843 -3.631 -5.750 1.00 0.00 O ATOM 0 H GLY A 8 0.483 -1.632 -2.810 1.00 0.00 H new ATOM 0 HA2 GLY A 8 0.211 -1.531 -5.418 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.854 -0.931 -5.308 1.00 0.00 H new ATOM 128 N THR A 9 1.783 -3.511 -3.509 1.00 0.00 N ATOM 129 CA THR A 9 1.858 -4.939 -3.229 1.00 0.00 C ATOM 130 C THR A 9 0.659 -5.681 -3.817 1.00 0.00 C ATOM 131 O THR A 9 0.817 -6.793 -4.315 1.00 0.00 O ATOM 132 CB THR A 9 1.930 -5.137 -1.706 1.00 0.00 C ATOM 133 OG1 THR A 9 1.097 -4.165 -1.088 1.00 0.00 O ATOM 134 CG2 THR A 9 3.381 -4.961 -1.253 1.00 0.00 C ATOM 0 H THR A 9 1.861 -2.937 -2.669 1.00 0.00 H new ATOM 0 HA THR A 9 2.751 -5.353 -3.697 1.00 0.00 H new ATOM 0 HB THR A 9 1.591 -6.135 -1.427 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.644 -3.568 -0.536 1.00 0.00 H new ATOM 0 HG21 THR A 9 3.445 -5.099 -0.174 1.00 0.00 H new ATOM 0 HG22 THR A 9 4.010 -5.699 -1.751 1.00 0.00 H new ATOM 0 HG23 THR A 9 3.724 -3.959 -1.511 1.00 0.00 H new ATOM 142 N LEU A 10 -0.520 -5.052 -3.786 1.00 0.00 N ATOM 143 CA LEU A 10 -1.816 -5.668 -4.033 1.00 0.00 C ATOM 144 C LEU A 10 -2.609 -4.797 -5.018 1.00 0.00 C ATOM 145 O LEU A 10 -3.738 -4.395 -4.743 1.00 0.00 O ATOM 146 CB LEU A 10 -2.565 -5.805 -2.692 1.00 0.00 C ATOM 147 CG LEU A 10 -1.886 -6.702 -1.638 1.00 0.00 C ATOM 148 CD1 LEU A 10 -2.052 -6.115 -0.232 1.00 0.00 C ATOM 149 CD2 LEU A 10 -2.486 -8.099 -1.707 1.00 0.00 C ATOM 0 H LEU A 10 -0.594 -4.056 -3.578 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.693 -6.659 -4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.696 -4.810 -2.266 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.561 -6.200 -2.892 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.818 -6.755 -1.851 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.565 -6.766 0.494 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.597 -5.125 -0.195 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.113 -6.036 0.006 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.009 -8.737 -0.963 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.556 -8.046 -1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.323 -8.516 -2.701 1.00 0.00 H new ATOM 161 N LYS A 11 -1.998 -4.381 -6.136 1.00 0.00 N ATOM 162 CA LYS A 11 -2.718 -3.578 -7.131 1.00 0.00 C ATOM 163 C LYS A 11 -2.189 -3.817 -8.538 1.00 0.00 C ATOM 164 O LYS A 11 -2.966 -4.203 -9.407 1.00 0.00 O ATOM 165 CB LYS A 11 -2.737 -2.089 -6.726 1.00 0.00 C ATOM 166 CG LYS A 11 -4.034 -1.357 -7.109 1.00 0.00 C ATOM 167 CD LYS A 11 -4.277 -1.227 -8.623 1.00 0.00 C ATOM 168 CE LYS A 11 -5.255 -2.266 -9.198 1.00 0.00 C ATOM 169 NZ LYS A 11 -6.638 -2.092 -8.717 1.00 0.00 N ATOM 0 H LYS A 11 -1.026 -4.583 -6.371 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.757 -3.906 -7.151 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.593 -2.014 -5.648 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -1.893 -1.584 -7.196 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.878 -1.884 -6.664 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.015 -0.359 -6.671 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.661 -0.229 -8.833 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.323 -1.318 -9.142 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.245 -2.201 -10.286 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.909 -3.266 -8.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.304 -2.341 -9.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.801 -2.711 -7.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.786 -1.101 -8.437 1.00 0.00 H new ATOM 183 N ARG A 12 -0.903 -3.566 -8.806 1.00 0.00 N ATOM 184 CA ARG A 12 -0.328 -3.893 -10.113 1.00 0.00 C ATOM 185 C ARG A 12 -0.168 -5.403 -10.212 1.00 0.00 C ATOM 186 O ARG A 12 -1.121 -6.086 -10.581 1.00 0.00 O ATOM 187 CB ARG A 12 0.977 -3.109 -10.304 1.00 0.00 C ATOM 188 CG ARG A 12 0.668 -1.638 -10.614 1.00 0.00 C ATOM 189 CD ARG A 12 0.650 -1.328 -12.109 1.00 0.00 C ATOM 190 NE ARG A 12 0.556 0.121 -12.293 1.00 0.00 N ATOM 191 CZ ARG A 12 0.938 0.868 -13.326 1.00 0.00 C ATOM 192 NH1 ARG A 12 1.432 0.312 -14.429 1.00 0.00 N ATOM 193 NH2 ARG A 12 0.816 2.184 -13.198 1.00 0.00 N ATOM 0 H ARG A 12 -0.250 -3.144 -8.146 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.983 -3.593 -10.931 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.587 -3.179 -9.404 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.557 -3.546 -11.117 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.300 -1.379 -10.184 1.00 0.00 H new ATOM 0 HG3 ARG A 12 1.412 -1.007 -10.128 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.554 -1.710 -12.584 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -0.195 -1.824 -12.586 1.00 0.00 H new ATOM 0 HE ARG A 12 0.137 0.633 -11.517 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.523 -0.702 -14.492 1.00 0.00 H new ATOM 0 HH12 ARG A 12 1.720 0.900 -15.211 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.443 2.580 -12.335 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.095 2.799 -13.962 1.00 0.00 H new ATOM 207 N GLY A 13 0.940 -5.958 -9.730 1.00 0.00 N ATOM 208 CA GLY A 13 1.101 -7.395 -9.709 1.00 0.00 C ATOM 209 C GLY A 13 2.386 -7.772 -9.011 1.00 0.00 C ATOM 210 O GLY A 13 3.182 -8.541 -9.533 1.00 0.00 O ATOM 0 H GLY A 13 1.730 -5.434 -9.353 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.254 -7.854 -9.199 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.107 -7.781 -10.728 1.00 0.00 H new ATOM 214 N GLN A 14 2.604 -7.221 -7.816 1.00 0.00 N ATOM 215 CA GLN A 14 3.682 -7.671 -6.945 1.00 0.00 C ATOM 216 C GLN A 14 3.496 -9.180 -6.674 1.00 0.00 C ATOM 217 O GLN A 14 2.380 -9.698 -6.815 1.00 0.00 O ATOM 218 CB GLN A 14 3.674 -6.807 -5.667 1.00 0.00 C ATOM 219 CG GLN A 14 4.954 -5.987 -5.416 1.00 0.00 C ATOM 220 CD GLN A 14 5.361 -5.118 -6.599 1.00 0.00 C ATOM 221 OE1 GLN A 14 6.456 -5.273 -7.133 1.00 0.00 O ATOM 222 NE2 GLN A 14 4.482 -4.240 -7.063 1.00 0.00 N ATOM 0 H GLN A 14 2.044 -6.460 -7.431 1.00 0.00 H new ATOM 0 HA GLN A 14 4.662 -7.548 -7.405 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.828 -6.122 -5.717 1.00 0.00 H new ATOM 0 HB3 GLN A 14 3.506 -7.458 -4.809 1.00 0.00 H new ATOM 0 HG2 GLN A 14 4.803 -5.351 -4.543 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.771 -6.668 -5.177 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.579 -4.130 -6.602 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.709 -3.675 -7.881 1.00 0.00 H new ATOM 231 N PRO A 15 4.530 -9.888 -6.194 1.00 0.00 N ATOM 232 CA PRO A 15 4.483 -11.328 -5.928 1.00 0.00 C ATOM 233 C PRO A 15 3.493 -11.707 -4.820 1.00 0.00 C ATOM 234 O PRO A 15 3.268 -12.889 -4.544 1.00 0.00 O ATOM 235 CB PRO A 15 5.917 -11.733 -5.567 1.00 0.00 C ATOM 236 CG PRO A 15 6.662 -10.438 -5.284 1.00 0.00 C ATOM 237 CD PRO A 15 5.758 -9.303 -5.704 1.00 0.00 C ATOM 0 HA PRO A 15 4.119 -11.861 -6.806 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.929 -12.388 -4.696 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.385 -12.281 -6.385 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.911 -10.360 -4.226 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.602 -10.406 -5.836 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.558 -8.640 -4.862 1.00 0.00 H new ATOM 0 HD3 PRO A 15 6.232 -8.701 -6.479 1.00 0.00 H new ATOM 245 N ASN A 16 2.875 -10.703 -4.202 1.00 0.00 N ATOM 246 CA ASN A 16 2.106 -10.780 -2.989 1.00 0.00 C ATOM 247 C ASN A 16 0.693 -10.315 -3.286 1.00 0.00 C ATOM 248 O ASN A 16 -0.012 -10.017 -2.338 1.00 0.00 O ATOM 249 CB ASN A 16 2.718 -9.888 -1.886 1.00 0.00 C ATOM 250 CG ASN A 16 4.206 -9.606 -2.059 1.00 0.00 C ATOM 251 OD1 ASN A 16 5.044 -10.501 -2.043 1.00 0.00 O ATOM 252 ND2 ASN A 16 4.548 -8.362 -2.339 1.00 0.00 N ATOM 0 H ASN A 16 2.909 -9.753 -4.572 1.00 0.00 H new ATOM 0 HA ASN A 16 2.107 -11.810 -2.632 1.00 0.00 H new ATOM 0 HB2 ASN A 16 2.181 -8.940 -1.863 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.561 -10.367 -0.919 1.00 0.00 H new ATOM 0 HD21 ASN A 16 5.521 -8.135 -2.546 1.00 0.00 H new ATOM 0 HD22 ASN A 16 3.840 -7.628 -2.349 1.00 0.00 H new ATOM 259 N HIS A 17 0.274 -10.122 -4.546 1.00 0.00 N ATOM 260 CA HIS A 17 -0.981 -9.443 -4.741 1.00 0.00 C ATOM 261 C HIS A 17 -2.088 -10.519 -4.643 1.00 0.00 C ATOM 262 O HIS A 17 -3.156 -10.314 -4.076 1.00 0.00 O ATOM 263 CB HIS A 17 -0.990 -8.768 -6.109 1.00 0.00 C ATOM 264 CG HIS A 17 -1.061 -9.678 -7.285 1.00 0.00 C ATOM 265 ND1 HIS A 17 -0.084 -10.262 -8.053 1.00 0.00 N ATOM 266 CD2 HIS A 17 -2.278 -10.095 -7.720 1.00 0.00 C ATOM 267 CE1 HIS A 17 -0.725 -11.007 -8.973 1.00 0.00 C ATOM 268 NE2 HIS A 17 -2.061 -10.951 -8.802 1.00 0.00 N ATOM 0 H HIS A 17 0.765 -10.414 -5.391 1.00 0.00 H new ATOM 0 HA HIS A 17 -1.142 -8.667 -3.993 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -1.840 -8.086 -6.150 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -0.089 -8.161 -6.198 1.00 0.00 H new ATOM 0 HD1 HIS A 17 0.925 -10.153 -7.948 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -3.236 -9.816 -7.306 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -0.233 -11.576 -9.748 1.00 0.00 H new ATOM 276 N LYS A 18 -1.827 -11.715 -5.193 1.00 0.00 N ATOM 277 CA LYS A 18 -2.828 -12.762 -5.416 1.00 0.00 C ATOM 278 C LYS A 18 -3.485 -13.279 -4.142 1.00 0.00 C ATOM 279 O LYS A 18 -4.561 -13.859 -4.218 1.00 0.00 O ATOM 280 CB LYS A 18 -2.248 -13.896 -6.285 1.00 0.00 C ATOM 281 CG LYS A 18 -1.039 -14.656 -5.721 1.00 0.00 C ATOM 282 CD LYS A 18 -1.392 -15.719 -4.675 1.00 0.00 C ATOM 283 CE LYS A 18 -0.157 -16.546 -4.305 1.00 0.00 C ATOM 284 NZ LYS A 18 0.103 -17.635 -5.271 1.00 0.00 N ATOM 0 H LYS A 18 -0.892 -11.984 -5.501 1.00 0.00 H new ATOM 0 HA LYS A 18 -3.644 -12.294 -5.967 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -3.043 -14.617 -6.476 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -1.963 -13.473 -7.248 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -0.510 -15.136 -6.545 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -0.350 -13.939 -5.274 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.795 -15.239 -3.783 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -2.171 -16.374 -5.064 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.714 -15.892 -4.256 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.292 -16.971 -3.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 0.948 -18.165 -4.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.715 -18.276 -5.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.259 -17.231 -6.216 1.00 0.00 H new ATOM 298 N VAL A 19 -2.890 -13.033 -2.977 1.00 0.00 N ATOM 299 CA VAL A 19 -3.471 -13.414 -1.698 1.00 0.00 C ATOM 300 C VAL A 19 -4.835 -12.748 -1.497 1.00 0.00 C ATOM 301 O VAL A 19 -5.751 -13.391 -0.986 1.00 0.00 O ATOM 302 CB VAL A 19 -2.485 -13.091 -0.562 1.00 0.00 C ATOM 303 CG1 VAL A 19 -1.401 -14.181 -0.506 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.772 -11.765 -0.770 1.00 0.00 C ATOM 0 H VAL A 19 -1.989 -12.562 -2.896 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.648 -14.489 -1.687 1.00 0.00 H new ATOM 0 HB VAL A 19 -3.069 -13.041 0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.700 -13.956 0.298 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -1.867 -15.149 -0.321 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.867 -14.212 -1.455 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -1.088 -11.585 0.060 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.210 -11.797 -1.703 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.506 -10.960 -0.816 1.00 0.00 H new ATOM 314 N MET A 20 -5.033 -11.518 -1.978 1.00 0.00 N ATOM 315 CA MET A 20 -6.325 -10.848 -1.875 1.00 0.00 C ATOM 316 C MET A 20 -7.339 -11.326 -2.929 1.00 0.00 C ATOM 317 O MET A 20 -8.429 -10.764 -3.040 1.00 0.00 O ATOM 318 CB MET A 20 -6.127 -9.343 -1.875 1.00 0.00 C ATOM 319 CG MET A 20 -5.676 -8.808 -3.218 1.00 0.00 C ATOM 320 SD MET A 20 -6.558 -7.362 -3.847 1.00 0.00 S ATOM 321 CE MET A 20 -6.326 -6.285 -2.410 1.00 0.00 C ATOM 0 H MET A 20 -4.311 -10.968 -2.443 1.00 0.00 H new ATOM 0 HA MET A 20 -6.775 -11.127 -0.922 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.062 -8.859 -1.592 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.389 -9.079 -1.118 1.00 0.00 H new ATOM 0 HG2 MET A 20 -4.617 -8.558 -3.148 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.766 -9.609 -3.952 1.00 0.00 H new ATOM 0 HE1 MET A 20 -7.280 -6.148 -1.900 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.611 -6.741 -1.725 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.947 -5.317 -2.738 1.00 0.00 H new ATOM 331 N LEU A 21 -6.974 -12.322 -3.742 1.00 0.00 N ATOM 332 CA LEU A 21 -7.756 -12.844 -4.855 1.00 0.00 C ATOM 333 C LEU A 21 -8.067 -14.336 -4.652 1.00 0.00 C ATOM 334 O LEU A 21 -8.471 -15.001 -5.610 1.00 0.00 O ATOM 335 CB LEU A 21 -6.994 -12.637 -6.181 1.00 0.00 C ATOM 336 CG LEU A 21 -6.415 -11.237 -6.456 1.00 0.00 C ATOM 337 CD1 LEU A 21 -5.656 -11.258 -7.785 1.00 0.00 C ATOM 338 CD2 LEU A 21 -7.487 -10.144 -6.510 1.00 0.00 C ATOM 0 H LEU A 21 -6.083 -12.805 -3.633 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.699 -12.300 -4.897 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.173 -13.353 -6.212 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.668 -12.889 -7.000 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.751 -10.997 -5.626 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.244 -10.269 -7.984 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -4.845 -11.984 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.338 -11.536 -8.589 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.015 -9.181 -6.707 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.197 -10.370 -7.306 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.012 -10.102 -5.556 1.00 0.00 H new ATOM 350 N ASP A 22 -7.837 -14.901 -3.460 1.00 0.00 N ATOM 351 CA ASP A 22 -7.920 -16.348 -3.223 1.00 0.00 C ATOM 352 C ASP A 22 -8.708 -16.755 -1.989 1.00 0.00 C ATOM 353 O ASP A 22 -8.787 -17.948 -1.679 1.00 0.00 O ATOM 354 CB ASP A 22 -6.491 -16.932 -3.184 1.00 0.00 C ATOM 355 CG ASP A 22 -6.082 -17.758 -4.394 1.00 0.00 C ATOM 356 OD1 ASP A 22 -6.930 -18.300 -5.135 1.00 0.00 O ATOM 357 OD2 ASP A 22 -4.852 -17.919 -4.597 1.00 0.00 O ATOM 0 H ASP A 22 -7.587 -14.365 -2.629 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.489 -16.765 -4.054 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -5.785 -16.109 -3.074 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -6.397 -17.554 -2.294 1.00 0.00 H new ATOM 362 N HIS A 23 -9.301 -15.780 -1.307 1.00 0.00 N ATOM 363 CA HIS A 23 -10.161 -15.891 -0.133 1.00 0.00 C ATOM 364 C HIS A 23 -9.648 -16.886 0.914 1.00 0.00 C ATOM 365 O HIS A 23 -10.413 -17.534 1.629 1.00 0.00 O ATOM 366 CB HIS A 23 -11.635 -16.033 -0.517 1.00 0.00 C ATOM 367 CG HIS A 23 -12.545 -15.681 0.633 1.00 0.00 C ATOM 368 ND1 HIS A 23 -13.103 -16.561 1.529 1.00 0.00 N ATOM 369 CD2 HIS A 23 -12.767 -14.417 1.106 1.00 0.00 C ATOM 370 CE1 HIS A 23 -13.623 -15.851 2.539 1.00 0.00 C ATOM 371 NE2 HIS A 23 -13.460 -14.533 2.316 1.00 0.00 N ATOM 0 H HIS A 23 -9.182 -14.806 -1.586 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.104 -14.941 0.398 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.854 -15.386 -1.366 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.831 -17.056 -0.837 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -12.462 -13.496 0.631 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -14.104 -16.275 3.408 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -13.779 -13.769 2.912 1.00 0.00 H new ATOM 379 N SER A 24 -8.336 -17.063 0.976 1.00 0.00 N ATOM 380 CA SER A 24 -7.676 -17.958 1.921 1.00 0.00 C ATOM 381 C SER A 24 -6.746 -17.194 2.864 1.00 0.00 C ATOM 382 O SER A 24 -6.330 -17.723 3.893 1.00 0.00 O ATOM 383 CB SER A 24 -6.992 -19.078 1.166 1.00 0.00 C ATOM 384 OG SER A 24 -7.884 -19.649 0.223 1.00 0.00 O ATOM 0 H SER A 24 -7.685 -16.579 0.358 1.00 0.00 H new ATOM 0 HA SER A 24 -8.422 -18.416 2.571 1.00 0.00 H new ATOM 0 HB2 SER A 24 -6.108 -18.696 0.656 1.00 0.00 H new ATOM 0 HB3 SER A 24 -6.651 -19.842 1.865 1.00 0.00 H new ATOM 0 HG SER A 24 -8.059 -19.004 -0.494 1.00 0.00 H new ATOM 390 N HIS A 25 -6.467 -15.925 2.566 1.00 0.00 N ATOM 391 CA HIS A 25 -5.703 -14.994 3.390 1.00 0.00 C ATOM 392 C HIS A 25 -6.605 -13.883 3.949 1.00 0.00 C ATOM 393 O HIS A 25 -6.135 -13.034 4.700 1.00 0.00 O ATOM 394 CB HIS A 25 -4.545 -14.421 2.565 1.00 0.00 C ATOM 395 CG HIS A 25 -3.459 -15.423 2.244 1.00 0.00 C ATOM 396 ND1 HIS A 25 -2.126 -15.264 2.531 1.00 0.00 N ATOM 397 CD2 HIS A 25 -3.592 -16.621 1.592 1.00 0.00 C ATOM 398 CE1 HIS A 25 -1.470 -16.326 2.031 1.00 0.00 C ATOM 399 NE2 HIS A 25 -2.322 -17.188 1.450 1.00 0.00 N ATOM 0 H HIS A 25 -6.786 -15.498 1.696 1.00 0.00 H new ATOM 0 HA HIS A 25 -5.291 -15.526 4.247 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -4.941 -14.020 1.632 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.104 -13.586 3.109 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -1.708 -14.481 3.033 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -4.520 -17.053 1.247 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -0.401 -16.467 2.089 1.00 0.00 H new ATOM 407 N GLY A 26 -7.898 -13.879 3.613 1.00 0.00 N ATOM 408 CA GLY A 26 -8.842 -12.869 4.052 1.00 0.00 C ATOM 409 C GLY A 26 -9.634 -12.365 2.864 1.00 0.00 C ATOM 410 O GLY A 26 -9.372 -12.731 1.714 1.00 0.00 O ATOM 0 H GLY A 26 -8.317 -14.593 3.018 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.515 -13.287 4.800 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -8.312 -12.043 4.526 1.00 0.00 H new ATOM 414 N LEU A 27 -10.614 -11.520 3.153 1.00 0.00 N ATOM 415 CA LEU A 27 -11.487 -10.949 2.152 1.00 0.00 C ATOM 416 C LEU A 27 -10.823 -9.751 1.491 1.00 0.00 C ATOM 417 O LEU A 27 -10.264 -8.904 2.189 1.00 0.00 O ATOM 418 CB LEU A 27 -12.776 -10.511 2.851 1.00 0.00 C ATOM 419 CG LEU A 27 -13.868 -10.024 1.888 1.00 0.00 C ATOM 420 CD1 LEU A 27 -14.270 -11.162 0.955 1.00 0.00 C ATOM 421 CD2 LEU A 27 -15.097 -9.581 2.678 1.00 0.00 C ATOM 0 H LEU A 27 -10.823 -11.212 4.103 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.702 -11.685 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.164 -11.346 3.433 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -12.543 -9.712 3.555 1.00 0.00 H new ATOM 0 HG LEU A 27 -13.480 -9.185 1.310 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.045 -10.816 0.272 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.401 -11.488 0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -14.651 -11.997 1.543 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.868 -9.237 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.478 -10.421 3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.823 -8.769 3.351 1.00 0.00 H new ATOM 433 N ALA A 28 -10.982 -9.616 0.176 1.00 0.00 N ATOM 434 CA ALA A 28 -10.914 -8.331 -0.495 1.00 0.00 C ATOM 435 C ALA A 28 -11.871 -8.327 -1.686 1.00 0.00 C ATOM 436 O ALA A 28 -12.115 -9.387 -2.266 1.00 0.00 O ATOM 437 CB ALA A 28 -9.490 -8.043 -0.959 1.00 0.00 C ATOM 0 H ALA A 28 -11.162 -10.400 -0.451 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.208 -7.549 0.205 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.459 -7.075 -1.460 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.823 -8.027 -0.097 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.169 -8.821 -1.652 1.00 0.00 H new ATOM 443 N ALA A 29 -12.352 -7.150 -2.085 1.00 0.00 N ATOM 444 CA ALA A 29 -13.103 -6.893 -3.307 1.00 0.00 C ATOM 445 C ALA A 29 -12.830 -5.454 -3.744 1.00 0.00 C ATOM 446 O ALA A 29 -12.753 -4.566 -2.893 1.00 0.00 O ATOM 447 CB ALA A 29 -14.601 -7.073 -3.046 1.00 0.00 C ATOM 0 H ALA A 29 -12.219 -6.304 -1.531 1.00 0.00 H new ATOM 0 HA ALA A 29 -12.797 -7.591 -4.086 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.156 -6.879 -3.964 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -14.793 -8.094 -2.715 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -14.922 -6.374 -2.273 1.00 0.00 H new ATOM 453 N PHE A 30 -12.716 -5.225 -5.054 1.00 0.00 N ATOM 454 CA PHE A 30 -12.538 -3.909 -5.668 1.00 0.00 C ATOM 455 C PHE A 30 -13.737 -3.029 -5.305 1.00 0.00 C ATOM 456 O PHE A 30 -14.872 -3.402 -5.620 1.00 0.00 O ATOM 457 CB PHE A 30 -12.379 -4.116 -7.189 1.00 0.00 C ATOM 458 CG PHE A 30 -12.311 -2.875 -8.058 1.00 0.00 C ATOM 459 CD1 PHE A 30 -11.093 -2.203 -8.236 1.00 0.00 C ATOM 460 CD2 PHE A 30 -13.458 -2.406 -8.719 1.00 0.00 C ATOM 461 CE1 PHE A 30 -11.039 -1.006 -8.978 1.00 0.00 C ATOM 462 CE2 PHE A 30 -13.399 -1.229 -9.485 1.00 0.00 C ATOM 463 CZ PHE A 30 -12.196 -0.521 -9.605 1.00 0.00 C ATOM 0 H PHE A 30 -12.746 -5.979 -5.741 1.00 0.00 H new ATOM 0 HA PHE A 30 -11.647 -3.399 -5.302 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -11.471 -4.695 -7.357 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.214 -4.725 -7.535 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -10.190 -2.606 -7.801 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -14.387 -2.951 -8.639 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -10.109 -0.464 -9.064 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -14.286 -0.868 -9.984 1.00 0.00 H new ATOM 0 HZ PHE A 30 -12.160 0.394 -10.178 1.00 0.00 H new ATOM 473 N ARG A 31 -13.529 -1.907 -4.609 1.00 0.00 N ATOM 474 CA ARG A 31 -14.615 -1.059 -4.106 1.00 0.00 C ATOM 475 C ARG A 31 -14.267 0.418 -4.296 1.00 0.00 C ATOM 476 O ARG A 31 -14.620 1.262 -3.481 1.00 0.00 O ATOM 477 CB ARG A 31 -14.964 -1.449 -2.652 1.00 0.00 C ATOM 478 CG ARG A 31 -16.294 -0.889 -2.115 1.00 0.00 C ATOM 479 CD ARG A 31 -17.534 -1.379 -2.872 1.00 0.00 C ATOM 480 NE ARG A 31 -18.471 -2.045 -1.955 1.00 0.00 N ATOM 481 CZ ARG A 31 -19.748 -1.727 -1.732 1.00 0.00 C ATOM 482 NH1 ARG A 31 -20.389 -0.867 -2.518 1.00 0.00 N ATOM 483 NH2 ARG A 31 -20.361 -2.299 -0.702 1.00 0.00 N ATOM 0 H ARG A 31 -12.598 -1.560 -4.377 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.523 -1.225 -4.686 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.994 -2.536 -2.584 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.158 -1.111 -2.000 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.392 -1.162 -1.064 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.261 0.200 -2.160 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -18.028 -0.536 -3.356 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.236 -2.070 -3.661 1.00 0.00 H new ATOM 0 HE ARG A 31 -18.104 -2.839 -1.431 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.905 -0.438 -3.307 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -21.365 -0.636 -2.332 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.856 -2.959 -0.110 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -21.337 -2.079 -0.503 1.00 0.00 H new ATOM 497 N GLY A 32 -13.656 0.756 -5.422 1.00 0.00 N ATOM 498 CA GLY A 32 -13.515 2.119 -5.878 1.00 0.00 C ATOM 499 C GLY A 32 -12.063 2.469 -6.127 1.00 0.00 C ATOM 500 O GLY A 32 -11.248 2.578 -5.204 1.00 0.00 O ATOM 0 H GLY A 32 -13.238 0.072 -6.053 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -14.087 2.259 -6.795 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -13.933 2.798 -5.135 1.00 0.00 H new ATOM 504 N ARG A 33 -11.709 2.667 -7.401 1.00 0.00 N ATOM 505 CA ARG A 33 -10.361 3.151 -7.707 1.00 0.00 C ATOM 506 C ARG A 33 -10.178 4.518 -7.053 1.00 0.00 C ATOM 507 O ARG A 33 -11.140 5.271 -6.928 1.00 0.00 O ATOM 508 CB ARG A 33 -10.055 3.098 -9.194 1.00 0.00 C ATOM 509 CG ARG A 33 -10.805 4.151 -10.001 1.00 0.00 C ATOM 510 CD ARG A 33 -11.114 3.539 -11.357 1.00 0.00 C ATOM 511 NE ARG A 33 -11.568 4.553 -12.318 1.00 0.00 N ATOM 512 CZ ARG A 33 -12.382 4.361 -13.357 1.00 0.00 C ATOM 513 NH1 ARG A 33 -12.826 3.142 -13.638 1.00 0.00 N ATOM 514 NH2 ARG A 33 -12.732 5.379 -14.129 1.00 0.00 N ATOM 0 H ARG A 33 -12.311 2.507 -8.209 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.610 2.487 -7.279 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -8.983 3.231 -9.342 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -10.309 2.109 -9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.723 4.444 -9.492 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -10.202 5.052 -10.114 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -10.224 3.043 -11.744 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.882 2.774 -11.245 1.00 0.00 H new ATOM 0 HE ARG A 33 -11.225 5.503 -12.176 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -12.545 2.351 -13.059 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -13.448 2.997 -14.433 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -12.379 6.315 -13.930 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -13.355 5.227 -14.922 1.00 0.00 H new ATOM 528 N GLY A 34 -8.954 4.869 -6.660 1.00 0.00 N ATOM 529 CA GLY A 34 -8.748 6.044 -5.825 1.00 0.00 C ATOM 530 C GLY A 34 -7.326 6.563 -5.859 1.00 0.00 C ATOM 531 O GLY A 34 -6.442 5.954 -6.476 1.00 0.00 O ATOM 0 H GLY A 34 -8.103 4.362 -6.904 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.424 6.835 -6.150 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.014 5.801 -4.796 1.00 0.00 H new ATOM 535 N CYS A 35 -7.102 7.690 -5.192 1.00 0.00 N ATOM 536 CA CYS A 35 -5.809 8.350 -5.118 1.00 0.00 C ATOM 537 C CYS A 35 -5.590 8.793 -3.666 1.00 0.00 C ATOM 538 O CYS A 35 -6.562 9.137 -2.989 1.00 0.00 O ATOM 539 CB CYS A 35 -5.795 9.495 -6.156 1.00 0.00 C ATOM 540 SG CYS A 35 -6.498 11.058 -5.578 1.00 0.00 S ATOM 0 H CYS A 35 -7.834 8.179 -4.677 1.00 0.00 H new ATOM 0 HA CYS A 35 -4.973 7.698 -5.372 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.765 9.670 -6.468 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -6.345 9.171 -7.040 1.00 0.00 H new ATOM 0 HG CYS A 35 -7.515 11.378 -6.322 1.00 0.00 H new ATOM 546 N THR A 36 -4.353 8.805 -3.163 1.00 0.00 N ATOM 547 CA THR A 36 -4.055 9.640 -2.009 1.00 0.00 C ATOM 548 C THR A 36 -4.257 11.080 -2.494 1.00 0.00 C ATOM 549 O THR A 36 -3.629 11.501 -3.471 1.00 0.00 O ATOM 550 CB THR A 36 -2.646 9.384 -1.432 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.583 9.774 -2.276 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.415 7.918 -1.078 1.00 0.00 C ATOM 0 H THR A 36 -3.568 8.263 -3.526 1.00 0.00 H new ATOM 0 HA THR A 36 -4.712 9.412 -1.170 1.00 0.00 H new ATOM 0 HB THR A 36 -2.636 10.010 -0.540 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.174 10.595 -1.929 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.409 7.795 -0.677 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.144 7.605 -0.331 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.526 7.306 -1.973 1.00 0.00 H new ATOM 560 N VAL A 37 -5.176 11.799 -1.856 1.00 0.00 N ATOM 561 CA VAL A 37 -5.445 13.195 -2.170 1.00 0.00 C ATOM 562 C VAL A 37 -4.240 14.038 -1.766 1.00 0.00 C ATOM 563 O VAL A 37 -3.891 15.021 -2.420 1.00 0.00 O ATOM 564 CB VAL A 37 -6.703 13.650 -1.408 1.00 0.00 C ATOM 565 CG1 VAL A 37 -7.150 15.021 -1.899 1.00 0.00 C ATOM 566 CG2 VAL A 37 -7.847 12.652 -1.600 1.00 0.00 C ATOM 0 H VAL A 37 -5.756 11.427 -1.104 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.618 13.316 -3.239 1.00 0.00 H new ATOM 0 HB VAL A 37 -6.451 13.704 -0.349 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -8.040 15.331 -1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.352 15.745 -1.733 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.378 14.970 -2.964 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.725 12.995 -1.052 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.088 12.575 -2.660 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.544 11.675 -1.224 1.00 0.00 H new ATOM 576 N GLU A 38 -3.630 13.654 -0.650 1.00 0.00 N ATOM 577 CA GLU A 38 -2.354 14.150 -0.210 1.00 0.00 C ATOM 578 C GLU A 38 -1.284 13.441 -1.023 1.00 0.00 C ATOM 579 O GLU A 38 -1.360 12.229 -1.247 1.00 0.00 O ATOM 580 CB GLU A 38 -2.217 13.843 1.284 1.00 0.00 C ATOM 581 CG GLU A 38 -3.170 14.669 2.154 1.00 0.00 C ATOM 582 CD GLU A 38 -3.051 16.198 2.036 1.00 0.00 C ATOM 583 OE1 GLU A 38 -3.388 16.785 0.977 1.00 0.00 O ATOM 584 OE2 GLU A 38 -2.719 16.832 3.061 1.00 0.00 O ATOM 0 H GLU A 38 -4.033 12.966 -0.014 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.254 15.226 -0.353 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.408 12.783 1.451 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.190 14.035 1.596 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -4.193 14.386 1.905 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.008 14.393 3.196 1.00 0.00 H new ATOM 591 N SER A 39 -0.258 14.185 -1.413 1.00 0.00 N ATOM 592 CA SER A 39 1.007 13.601 -1.806 1.00 0.00 C ATOM 593 C SER A 39 1.563 12.823 -0.608 1.00 0.00 C ATOM 594 O SER A 39 1.327 13.237 0.533 1.00 0.00 O ATOM 595 CB SER A 39 1.959 14.737 -2.189 1.00 0.00 C ATOM 596 OG SER A 39 1.333 15.738 -2.974 1.00 0.00 O ATOM 0 H SER A 39 -0.283 15.203 -1.464 1.00 0.00 H new ATOM 0 HA SER A 39 0.890 12.927 -2.654 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.359 15.190 -1.282 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.805 14.326 -2.740 1.00 0.00 H new ATOM 0 HG SER A 39 0.656 15.326 -3.550 1.00 0.00 H new ATOM 602 N PHE A 40 2.348 11.764 -0.847 1.00 0.00 N ATOM 603 CA PHE A 40 3.148 11.190 0.218 1.00 0.00 C ATOM 604 C PHE A 40 4.574 10.926 -0.307 1.00 0.00 C ATOM 605 O PHE A 40 4.779 10.660 -1.493 1.00 0.00 O ATOM 606 CB PHE A 40 2.507 9.872 0.642 1.00 0.00 C ATOM 607 CG PHE A 40 1.361 10.020 1.624 1.00 0.00 C ATOM 608 CD1 PHE A 40 1.599 10.272 2.984 1.00 0.00 C ATOM 609 CD2 PHE A 40 0.039 9.944 1.147 1.00 0.00 C ATOM 610 CE1 PHE A 40 0.521 10.528 3.854 1.00 0.00 C ATOM 611 CE2 PHE A 40 -1.037 10.175 2.021 1.00 0.00 C ATOM 612 CZ PHE A 40 -0.795 10.523 3.357 1.00 0.00 C ATOM 0 H PHE A 40 2.439 11.302 -1.752 1.00 0.00 H new ATOM 0 HA PHE A 40 3.198 11.871 1.067 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.143 9.356 -0.247 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.272 9.237 1.088 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.610 10.270 3.364 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.148 9.708 0.110 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.704 10.728 4.899 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -2.052 10.084 1.663 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.618 10.787 4.004 1.00 0.00 H new ATOM 622 N PRO A 41 5.584 10.914 0.577 1.00 0.00 N ATOM 623 CA PRO A 41 6.940 10.490 0.264 1.00 0.00 C ATOM 624 C PRO A 41 7.010 8.966 0.188 1.00 0.00 C ATOM 625 O PRO A 41 7.232 8.280 1.189 1.00 0.00 O ATOM 626 CB PRO A 41 7.830 11.037 1.378 1.00 0.00 C ATOM 627 CG PRO A 41 6.863 11.273 2.535 1.00 0.00 C ATOM 628 CD PRO A 41 5.509 11.500 1.896 1.00 0.00 C ATOM 0 HA PRO A 41 7.269 10.867 -0.705 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.612 10.328 1.649 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.326 11.960 1.077 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.840 10.415 3.207 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.166 12.136 3.129 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.718 11.035 2.484 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.279 12.564 1.837 1.00 0.00 H new ATOM 636 N LEU A 42 6.826 8.426 -1.010 1.00 0.00 N ATOM 637 CA LEU A 42 6.987 7.006 -1.252 1.00 0.00 C ATOM 638 C LEU A 42 8.425 6.713 -1.660 1.00 0.00 C ATOM 639 O LEU A 42 8.812 7.078 -2.765 1.00 0.00 O ATOM 640 CB LEU A 42 6.007 6.580 -2.347 1.00 0.00 C ATOM 641 CG LEU A 42 6.124 5.092 -2.719 1.00 0.00 C ATOM 642 CD1 LEU A 42 6.039 4.180 -1.493 1.00 0.00 C ATOM 643 CD2 LEU A 42 5.008 4.706 -3.692 1.00 0.00 C ATOM 0 H LEU A 42 6.562 8.962 -1.837 1.00 0.00 H new ATOM 0 HA LEU A 42 6.773 6.441 -0.345 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.989 6.786 -2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.181 7.185 -3.237 1.00 0.00 H new ATOM 0 HG LEU A 42 7.102 4.957 -3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.127 3.140 -1.807 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.848 4.421 -0.804 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.081 4.329 -0.994 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.099 3.651 -3.950 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.040 4.883 -3.224 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.089 5.309 -4.597 1.00 0.00 H new ATOM 655 N VAL A 43 9.210 6.070 -0.799 1.00 0.00 N ATOM 656 CA VAL A 43 10.649 5.875 -0.979 1.00 0.00 C ATOM 657 C VAL A 43 10.950 4.376 -0.924 1.00 0.00 C ATOM 658 O VAL A 43 10.408 3.656 -0.086 1.00 0.00 O ATOM 659 CB VAL A 43 11.411 6.724 0.063 1.00 0.00 C ATOM 660 CG1 VAL A 43 11.265 8.207 -0.338 1.00 0.00 C ATOM 661 CG2 VAL A 43 10.867 6.573 1.487 1.00 0.00 C ATOM 0 H VAL A 43 8.856 5.659 0.065 1.00 0.00 H new ATOM 0 HA VAL A 43 10.992 6.222 -1.954 1.00 0.00 H new ATOM 0 HB VAL A 43 12.446 6.381 0.068 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.794 8.832 0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.688 8.359 -1.331 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.210 8.479 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 43 11.448 7.196 2.167 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.823 6.884 1.512 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.942 5.531 1.797 1.00 0.00 H new ATOM 671 N ILE A 44 11.784 3.878 -1.836 1.00 0.00 N ATOM 672 CA ILE A 44 12.042 2.455 -2.017 1.00 0.00 C ATOM 673 C ILE A 44 13.464 2.202 -1.538 1.00 0.00 C ATOM 674 O ILE A 44 14.398 2.009 -2.322 1.00 0.00 O ATOM 675 CB ILE A 44 11.736 1.995 -3.463 1.00 0.00 C ATOM 676 CG1 ILE A 44 10.341 2.488 -3.923 1.00 0.00 C ATOM 677 CG2 ILE A 44 11.857 0.459 -3.502 1.00 0.00 C ATOM 678 CD1 ILE A 44 9.826 1.918 -5.253 1.00 0.00 C ATOM 0 H ILE A 44 12.309 4.467 -2.482 1.00 0.00 H new ATOM 0 HA ILE A 44 11.369 1.838 -1.422 1.00 0.00 H new ATOM 0 HB ILE A 44 12.449 2.431 -4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.618 2.247 -3.144 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.371 3.575 -4.004 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.647 0.103 -4.510 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.868 0.166 -3.217 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.142 0.020 -2.806 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.843 2.334 -5.471 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.517 2.181 -6.054 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.752 0.833 -5.180 1.00 0.00 H new ATOM 690 N ALA A 45 13.624 2.247 -0.219 1.00 0.00 N ATOM 691 CA ALA A 45 14.862 1.894 0.436 1.00 0.00 C ATOM 692 C ALA A 45 14.930 0.390 0.688 1.00 0.00 C ATOM 693 O ALA A 45 13.993 -0.372 0.427 1.00 0.00 O ATOM 694 CB ALA A 45 14.989 2.656 1.753 1.00 0.00 C ATOM 0 H ALA A 45 12.886 2.533 0.424 1.00 0.00 H new ATOM 0 HA ALA A 45 15.691 2.169 -0.216 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.925 2.385 2.241 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.980 3.728 1.555 1.00 0.00 H new ATOM 0 HB3 ALA A 45 14.153 2.400 2.404 1.00 0.00 H new ATOM 700 N GLY A 46 16.056 0.013 1.276 1.00 0.00 N ATOM 701 CA GLY A 46 16.322 -1.306 1.820 1.00 0.00 C ATOM 702 C GLY A 46 16.800 -2.250 0.721 1.00 0.00 C ATOM 703 O GLY A 46 16.453 -2.099 -0.452 1.00 0.00 O ATOM 0 H GLY A 46 16.844 0.650 1.391 1.00 0.00 H new ATOM 0 HA2 GLY A 46 17.077 -1.238 2.603 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.419 -1.704 2.282 1.00 0.00 H new ATOM 707 N GLU A 47 17.568 -3.271 1.098 1.00 0.00 N ATOM 708 CA GLU A 47 18.330 -4.079 0.145 1.00 0.00 C ATOM 709 C GLU A 47 17.452 -4.943 -0.759 1.00 0.00 C ATOM 710 O GLU A 47 17.929 -5.490 -1.756 1.00 0.00 O ATOM 711 CB GLU A 47 19.334 -4.957 0.906 1.00 0.00 C ATOM 712 CG GLU A 47 20.567 -5.215 0.032 1.00 0.00 C ATOM 713 CD GLU A 47 21.517 -6.279 0.569 1.00 0.00 C ATOM 714 OE1 GLU A 47 21.083 -7.187 1.310 1.00 0.00 O ATOM 715 OE2 GLU A 47 22.673 -6.301 0.093 1.00 0.00 O ATOM 0 H GLU A 47 17.680 -3.561 2.069 1.00 0.00 H new ATOM 0 HA GLU A 47 18.853 -3.385 -0.513 1.00 0.00 H new ATOM 0 HB2 GLU A 47 19.631 -4.466 1.833 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.868 -5.903 1.181 1.00 0.00 H new ATOM 0 HG2 GLU A 47 20.235 -5.513 -0.963 1.00 0.00 H new ATOM 0 HG3 GLU A 47 21.117 -4.281 -0.082 1.00 0.00 H new ATOM 722 N HIS A 48 16.170 -5.046 -0.429 1.00 0.00 N ATOM 723 CA HIS A 48 15.193 -5.820 -1.166 1.00 0.00 C ATOM 724 C HIS A 48 14.128 -4.937 -1.806 1.00 0.00 C ATOM 725 O HIS A 48 13.089 -5.451 -2.228 1.00 0.00 O ATOM 726 CB HIS A 48 14.652 -6.903 -0.231 1.00 0.00 C ATOM 727 CG HIS A 48 15.572 -8.080 -0.232 1.00 0.00 C ATOM 728 ND1 HIS A 48 15.531 -9.163 -1.073 1.00 0.00 N ATOM 729 CD2 HIS A 48 16.725 -8.145 0.471 1.00 0.00 C ATOM 730 CE1 HIS A 48 16.653 -9.869 -0.887 1.00 0.00 C ATOM 731 NE2 HIS A 48 17.418 -9.282 0.049 1.00 0.00 N ATOM 0 H HIS A 48 15.775 -4.576 0.386 1.00 0.00 H new ATOM 0 HA HIS A 48 15.654 -6.315 -2.021 1.00 0.00 H new ATOM 0 HB2 HIS A 48 14.554 -6.507 0.780 1.00 0.00 H new ATOM 0 HB3 HIS A 48 13.656 -7.208 -0.552 1.00 0.00 H new ATOM 0 HD1 HIS A 48 14.779 -9.390 -1.724 1.00 0.00 H new ATOM 0 HD2 HIS A 48 17.052 -7.443 1.224 1.00 0.00 H new ATOM 0 HE1 HIS A 48 16.906 -10.778 -1.413 1.00 0.00 H new ATOM 739 N ASN A 49 14.408 -3.630 -1.911 1.00 0.00 N ATOM 740 CA ASN A 49 13.567 -2.603 -2.513 1.00 0.00 C ATOM 741 C ASN A 49 12.166 -2.696 -1.934 1.00 0.00 C ATOM 742 O ASN A 49 11.218 -3.166 -2.574 1.00 0.00 O ATOM 743 CB ASN A 49 13.618 -2.696 -4.043 1.00 0.00 C ATOM 744 CG ASN A 49 14.980 -2.307 -4.589 1.00 0.00 C ATOM 745 OD1 ASN A 49 15.535 -1.272 -4.227 1.00 0.00 O ATOM 746 ND2 ASN A 49 15.525 -3.108 -5.487 1.00 0.00 N ATOM 0 H ASN A 49 15.283 -3.245 -1.554 1.00 0.00 H new ATOM 0 HA ASN A 49 13.942 -1.609 -2.269 1.00 0.00 H new ATOM 0 HB2 ASN A 49 13.380 -3.714 -4.353 1.00 0.00 H new ATOM 0 HB3 ASN A 49 12.856 -2.045 -4.472 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.429 -2.873 -5.898 1.00 0.00 H new ATOM 0 HD22 ASN A 49 15.042 -3.961 -5.769 1.00 0.00 H new ATOM 753 N ILE A 50 12.060 -2.245 -0.693 1.00 0.00 N ATOM 754 CA ILE A 50 10.941 -2.371 0.222 1.00 0.00 C ATOM 755 C ILE A 50 10.283 -0.986 0.237 1.00 0.00 C ATOM 756 O ILE A 50 10.793 -0.105 0.914 1.00 0.00 O ATOM 757 CB ILE A 50 11.404 -2.906 1.604 1.00 0.00 C ATOM 758 CG1 ILE A 50 11.943 -4.348 1.480 1.00 0.00 C ATOM 759 CG2 ILE A 50 10.245 -2.882 2.617 1.00 0.00 C ATOM 760 CD1 ILE A 50 12.733 -4.822 2.708 1.00 0.00 C ATOM 0 H ILE A 50 12.830 -1.733 -0.263 1.00 0.00 H new ATOM 0 HA ILE A 50 10.205 -3.113 -0.088 1.00 0.00 H new ATOM 0 HB ILE A 50 12.202 -2.254 1.959 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.106 -5.026 1.314 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.584 -4.412 0.601 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.593 -3.261 3.578 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.889 -1.859 2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.431 -3.509 2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.079 -5.843 2.546 1.00 0.00 H new ATOM 0 HD12 ILE A 50 13.591 -4.168 2.863 1.00 0.00 H new ATOM 0 HD13 ILE A 50 12.090 -4.792 3.588 1.00 0.00 H new ATOM 772 N PRO A 51 9.327 -0.678 -0.664 1.00 0.00 N ATOM 773 CA PRO A 51 8.681 0.630 -0.721 1.00 0.00 C ATOM 774 C PRO A 51 8.070 1.005 0.635 1.00 0.00 C ATOM 775 O PRO A 51 7.056 0.438 1.057 1.00 0.00 O ATOM 776 CB PRO A 51 7.634 0.528 -1.830 1.00 0.00 C ATOM 777 CG PRO A 51 7.315 -0.957 -1.871 1.00 0.00 C ATOM 778 CD PRO A 51 8.677 -1.580 -1.602 1.00 0.00 C ATOM 0 HA PRO A 51 9.392 1.427 -0.940 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.749 1.124 -1.605 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.023 0.883 -2.785 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.581 -1.238 -1.115 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.911 -1.261 -2.836 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.577 -2.581 -1.182 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.255 -1.677 -2.521 1.00 0.00 H new ATOM 786 N TRP A 52 8.684 1.953 1.330 1.00 0.00 N ATOM 787 CA TRP A 52 8.227 2.477 2.596 1.00 0.00 C ATOM 788 C TRP A 52 7.353 3.682 2.305 1.00 0.00 C ATOM 789 O TRP A 52 7.816 4.687 1.757 1.00 0.00 O ATOM 790 CB TRP A 52 9.420 2.869 3.462 1.00 0.00 C ATOM 791 CG TRP A 52 10.291 1.728 3.863 1.00 0.00 C ATOM 792 CD1 TRP A 52 11.444 1.363 3.264 1.00 0.00 C ATOM 793 CD2 TRP A 52 10.038 0.723 4.881 1.00 0.00 C ATOM 794 NE1 TRP A 52 11.943 0.226 3.870 1.00 0.00 N ATOM 795 CE2 TRP A 52 11.116 -0.208 4.882 1.00 0.00 C ATOM 796 CE3 TRP A 52 8.975 0.483 5.773 1.00 0.00 C ATOM 797 CZ2 TRP A 52 11.164 -1.292 5.769 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.007 -0.607 6.656 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.111 -1.475 6.676 1.00 0.00 C ATOM 0 H TRP A 52 9.547 2.391 1.009 1.00 0.00 H new ATOM 0 HA TRP A 52 7.657 1.725 3.142 1.00 0.00 H new ATOM 0 HB2 TRP A 52 10.023 3.598 2.920 1.00 0.00 H new ATOM 0 HB3 TRP A 52 9.054 3.364 4.361 1.00 0.00 H new ATOM 0 HD1 TRP A 52 11.906 1.881 2.437 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.813 -0.233 3.602 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.123 1.147 5.777 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.000 -1.976 5.754 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.177 -0.780 7.325 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.149 -2.284 7.391 1.00 0.00 H new ATOM 810 N LEU A 53 6.077 3.594 2.673 1.00 0.00 N ATOM 811 CA LEU A 53 5.193 4.741 2.598 1.00 0.00 C ATOM 812 C LEU A 53 5.336 5.544 3.887 1.00 0.00 C ATOM 813 O LEU A 53 4.709 5.242 4.904 1.00 0.00 O ATOM 814 CB LEU A 53 3.750 4.307 2.343 1.00 0.00 C ATOM 815 CG LEU A 53 2.988 5.338 1.508 1.00 0.00 C ATOM 816 CD1 LEU A 53 1.491 5.059 1.647 1.00 0.00 C ATOM 817 CD2 LEU A 53 3.202 6.799 1.851 1.00 0.00 C ATOM 0 H LEU A 53 5.639 2.742 3.024 1.00 0.00 H new ATOM 0 HA LEU A 53 5.471 5.374 1.755 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.745 3.346 1.828 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.240 4.161 3.295 1.00 0.00 H new ATOM 0 HG LEU A 53 3.385 5.213 0.501 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.929 5.784 1.058 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.273 4.053 1.287 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.202 5.140 2.695 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.604 7.421 1.184 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.900 6.979 2.883 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.256 7.050 1.733 1.00 0.00 H new ATOM 829 N LEU A 54 6.229 6.522 3.881 1.00 0.00 N ATOM 830 CA LEU A 54 6.454 7.433 4.981 1.00 0.00 C ATOM 831 C LEU A 54 5.206 8.283 5.176 1.00 0.00 C ATOM 832 O LEU A 54 4.740 8.927 4.234 1.00 0.00 O ATOM 833 CB LEU A 54 7.691 8.278 4.658 1.00 0.00 C ATOM 834 CG LEU A 54 8.988 7.599 5.051 1.00 0.00 C ATOM 835 CD1 LEU A 54 9.199 6.289 4.345 1.00 0.00 C ATOM 836 CD2 LEU A 54 10.181 8.541 4.847 1.00 0.00 C ATOM 0 H LEU A 54 6.835 6.705 3.081 1.00 0.00 H new ATOM 0 HA LEU A 54 6.640 6.902 5.915 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.709 8.493 3.590 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.616 9.235 5.175 1.00 0.00 H new ATOM 0 HG LEU A 54 8.911 7.364 6.113 1.00 0.00 H new ATOM 0 HD11 LEU A 54 10.143 5.850 4.667 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.382 5.609 4.587 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.225 6.456 3.268 1.00 0.00 H new ATOM 0 HD21 LEU A 54 11.100 8.032 5.136 1.00 0.00 H new ATOM 0 HD22 LEU A 54 10.241 8.831 3.798 1.00 0.00 H new ATOM 0 HD23 LEU A 54 10.051 9.431 5.462 1.00 0.00 H new ATOM 848 N TYR A 55 4.649 8.269 6.387 1.00 0.00 N ATOM 849 CA TYR A 55 3.418 8.978 6.703 1.00 0.00 C ATOM 850 C TYR A 55 3.682 10.484 6.796 1.00 0.00 C ATOM 851 O TYR A 55 3.912 11.023 7.883 1.00 0.00 O ATOM 852 CB TYR A 55 2.791 8.413 7.990 1.00 0.00 C ATOM 853 CG TYR A 55 1.377 8.909 8.242 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.382 8.745 7.256 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.051 9.539 9.456 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.929 9.203 7.485 1.00 0.00 C ATOM 857 CE2 TYR A 55 -0.245 10.039 9.672 1.00 0.00 C ATOM 858 CZ TYR A 55 -1.249 9.855 8.696 1.00 0.00 C ATOM 859 OH TYR A 55 -2.517 10.277 8.955 1.00 0.00 O ATOM 0 H TYR A 55 5.045 7.761 7.178 1.00 0.00 H new ATOM 0 HA TYR A 55 2.697 8.826 5.900 1.00 0.00 H new ATOM 0 HB2 TYR A 55 2.781 7.325 7.933 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.419 8.682 8.839 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.627 8.265 6.320 1.00 0.00 H new ATOM 0 HD2 TYR A 55 1.801 9.639 10.227 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.691 9.056 6.734 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -0.474 10.565 10.587 1.00 0.00 H new ATOM 0 HH TYR A 55 -3.145 9.542 8.795 1.00 0.00 H new ATOM 869 N LEU A 56 3.653 11.165 5.651 1.00 0.00 N ATOM 870 CA LEU A 56 3.876 12.603 5.524 1.00 0.00 C ATOM 871 C LEU A 56 2.853 13.167 4.513 1.00 0.00 C ATOM 872 O LEU A 56 3.158 13.225 3.321 1.00 0.00 O ATOM 873 CB LEU A 56 5.349 12.878 5.119 1.00 0.00 C ATOM 874 CG LEU A 56 6.149 13.956 5.879 1.00 0.00 C ATOM 875 CD1 LEU A 56 5.278 15.084 6.443 1.00 0.00 C ATOM 876 CD2 LEU A 56 7.053 13.341 6.960 1.00 0.00 C ATOM 0 H LEU A 56 3.467 10.714 4.755 1.00 0.00 H new ATOM 0 HA LEU A 56 3.722 13.111 6.476 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.895 11.939 5.210 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.354 13.149 4.063 1.00 0.00 H new ATOM 0 HG LEU A 56 6.792 14.424 5.133 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.908 15.805 6.964 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.755 15.583 5.627 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.550 14.668 7.140 1.00 0.00 H new ATOM 0 HD21 LEU A 56 7.599 14.134 7.472 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.441 12.798 7.680 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.761 12.655 6.495 1.00 0.00 H new ATOM 888 N PRO A 57 1.624 13.512 4.935 1.00 0.00 N ATOM 889 CA PRO A 57 0.602 14.057 4.041 1.00 0.00 C ATOM 890 C PRO A 57 1.077 15.405 3.494 1.00 0.00 C ATOM 891 O PRO A 57 1.451 16.290 4.267 1.00 0.00 O ATOM 892 CB PRO A 57 -0.668 14.174 4.890 1.00 0.00 C ATOM 893 CG PRO A 57 -0.169 14.245 6.330 1.00 0.00 C ATOM 894 CD PRO A 57 1.138 13.461 6.306 1.00 0.00 C ATOM 0 HA PRO A 57 0.408 13.428 3.172 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -1.240 15.063 4.625 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.324 13.317 4.741 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -0.010 15.276 6.647 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.886 13.805 7.023 1.00 0.00 H new ATOM 0 HD2 PRO A 57 1.865 13.897 6.992 1.00 0.00 H new ATOM 0 HD3 PRO A 57 0.978 12.430 6.623 1.00 0.00 H new ATOM 902 N GLY A 58 1.073 15.560 2.171 1.00 0.00 N ATOM 903 CA GLY A 58 1.411 16.810 1.503 1.00 0.00 C ATOM 904 C GLY A 58 2.901 16.940 1.186 1.00 0.00 C ATOM 905 O GLY A 58 3.367 18.048 0.925 1.00 0.00 O ATOM 0 H GLY A 58 0.831 14.808 1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.841 16.885 0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.106 17.645 2.133 1.00 0.00 H new ATOM 909 N LYS A 59 3.666 15.844 1.200 1.00 0.00 N ATOM 910 CA LYS A 59 5.068 15.786 0.774 1.00 0.00 C ATOM 911 C LYS A 59 5.162 14.730 -0.330 1.00 0.00 C ATOM 912 O LYS A 59 4.344 13.822 -0.333 1.00 0.00 O ATOM 913 CB LYS A 59 5.872 15.443 2.043 1.00 0.00 C ATOM 914 CG LYS A 59 7.285 14.879 1.849 1.00 0.00 C ATOM 915 CD LYS A 59 8.276 15.931 1.359 1.00 0.00 C ATOM 916 CE LYS A 59 8.961 16.627 2.537 1.00 0.00 C ATOM 917 NZ LYS A 59 10.075 17.470 2.074 1.00 0.00 N ATOM 0 H LYS A 59 3.314 14.941 1.519 1.00 0.00 H new ATOM 0 HA LYS A 59 5.464 16.712 0.357 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.949 16.347 2.648 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.297 14.720 2.622 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.639 14.464 2.793 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.249 14.058 1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.026 15.461 0.723 1.00 0.00 H new ATOM 0 HD3 LYS A 59 7.756 16.669 0.748 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.236 17.238 3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.332 15.881 3.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 10.524 17.932 2.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.776 16.880 1.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.714 18.195 1.422 1.00 0.00 H new ATOM 931 N GLY A 60 6.159 14.746 -1.217 1.00 0.00 N ATOM 932 CA GLY A 60 6.306 13.691 -2.213 1.00 0.00 C ATOM 933 C GLY A 60 5.214 13.763 -3.271 1.00 0.00 C ATOM 934 O GLY A 60 4.913 14.859 -3.744 1.00 0.00 O ATOM 0 H GLY A 60 6.871 15.475 -1.264 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.282 13.774 -2.691 1.00 0.00 H new ATOM 0 HA3 GLY A 60 6.274 12.719 -1.721 1.00 0.00 H new ATOM 938 N HIS A 61 4.677 12.617 -3.709 1.00 0.00 N ATOM 939 CA HIS A 61 3.776 12.516 -4.859 1.00 0.00 C ATOM 940 C HIS A 61 2.528 11.696 -4.514 1.00 0.00 C ATOM 941 O HIS A 61 2.519 10.959 -3.533 1.00 0.00 O ATOM 942 CB HIS A 61 4.539 11.903 -6.037 1.00 0.00 C ATOM 943 CG HIS A 61 5.792 12.650 -6.419 1.00 0.00 C ATOM 944 ND1 HIS A 61 6.041 13.991 -6.236 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.930 12.089 -6.923 1.00 0.00 C ATOM 946 CE1 HIS A 61 7.304 14.232 -6.608 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.887 13.105 -7.050 1.00 0.00 N ATOM 0 H HIS A 61 4.862 11.718 -3.264 1.00 0.00 H new ATOM 0 HA HIS A 61 3.432 13.512 -5.136 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.804 10.875 -5.788 1.00 0.00 H new ATOM 0 HB3 HIS A 61 3.877 11.861 -6.902 1.00 0.00 H new ATOM 0 HD1 HIS A 61 5.379 14.680 -5.879 1.00 0.00 H new ATOM 0 HD2 HIS A 61 7.068 11.049 -7.178 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.787 15.197 -6.560 1.00 0.00 H new ATOM 955 N CYS A 62 1.453 11.844 -5.289 1.00 0.00 N ATOM 956 CA CYS A 62 0.148 11.273 -4.956 1.00 0.00 C ATOM 957 C CYS A 62 0.062 9.810 -5.399 1.00 0.00 C ATOM 958 O CYS A 62 -0.077 9.551 -6.591 1.00 0.00 O ATOM 959 CB CYS A 62 -0.961 12.112 -5.597 1.00 0.00 C ATOM 960 SG CYS A 62 -0.992 13.795 -4.935 1.00 0.00 S ATOM 0 H CYS A 62 1.463 12.364 -6.166 1.00 0.00 H new ATOM 0 HA CYS A 62 0.019 11.293 -3.874 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -0.813 12.148 -6.676 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -1.925 11.635 -5.423 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.945 14.469 -5.508 1.00 0.00 H new ATOM 966 N VAL A 63 0.112 8.874 -4.458 1.00 0.00 N ATOM 967 CA VAL A 63 0.330 7.449 -4.659 1.00 0.00 C ATOM 968 C VAL A 63 -0.952 6.729 -5.145 1.00 0.00 C ATOM 969 O VAL A 63 -1.727 6.203 -4.336 1.00 0.00 O ATOM 970 CB VAL A 63 0.896 6.872 -3.342 1.00 0.00 C ATOM 971 CG1 VAL A 63 1.369 5.424 -3.490 1.00 0.00 C ATOM 972 CG2 VAL A 63 2.086 7.678 -2.784 1.00 0.00 C ATOM 0 H VAL A 63 -0.006 9.107 -3.472 1.00 0.00 H new ATOM 0 HA VAL A 63 1.052 7.283 -5.458 1.00 0.00 H new ATOM 0 HB VAL A 63 0.055 6.931 -2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.757 5.069 -2.535 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.532 4.797 -3.797 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.156 5.373 -4.243 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.435 7.219 -1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.896 7.684 -3.514 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.770 8.702 -2.584 1.00 0.00 H new ATOM 982 N THR A 64 -1.185 6.663 -6.462 1.00 0.00 N ATOM 983 CA THR A 64 -2.450 6.140 -7.016 1.00 0.00 C ATOM 984 C THR A 64 -2.688 4.686 -6.580 1.00 0.00 C ATOM 985 O THR A 64 -1.724 3.917 -6.502 1.00 0.00 O ATOM 986 CB THR A 64 -2.531 6.239 -8.554 1.00 0.00 C ATOM 987 OG1 THR A 64 -1.744 5.266 -9.217 1.00 0.00 O ATOM 988 CG2 THR A 64 -2.126 7.582 -9.134 1.00 0.00 C ATOM 0 H THR A 64 -0.515 6.965 -7.169 1.00 0.00 H new ATOM 0 HA THR A 64 -3.234 6.778 -6.608 1.00 0.00 H new ATOM 0 HB THR A 64 -3.594 6.077 -8.732 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.836 5.376 -10.186 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.217 7.552 -10.220 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.777 8.361 -8.737 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.093 7.799 -8.862 1.00 0.00 H new ATOM 996 N GLY A 65 -3.941 4.275 -6.350 1.00 0.00 N ATOM 997 CA GLY A 65 -4.240 2.952 -5.820 1.00 0.00 C ATOM 998 C GLY A 65 -5.701 2.565 -6.003 1.00 0.00 C ATOM 999 O GLY A 65 -6.358 2.940 -6.983 1.00 0.00 O ATOM 0 H GLY A 65 -4.765 4.849 -6.526 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.608 2.215 -6.315 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.991 2.925 -4.759 1.00 0.00 H new ATOM 1003 N GLU A 66 -6.210 1.751 -5.088 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.577 1.247 -5.108 1.00 0.00 C ATOM 1005 C GLU A 66 -8.086 1.126 -3.670 1.00 0.00 C ATOM 1006 O GLU A 66 -7.261 1.030 -2.754 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.537 -0.111 -5.814 1.00 0.00 C ATOM 1008 CG GLU A 66 -8.815 -0.461 -6.565 1.00 0.00 C ATOM 1009 CD GLU A 66 -9.971 -0.937 -5.685 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -9.820 -1.981 -5.047 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -11.040 -0.293 -5.734 1.00 0.00 O ATOM 0 H GLU A 66 -5.670 1.414 -4.291 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.257 1.914 -5.638 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.703 -0.119 -6.515 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.339 -0.887 -5.074 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.141 0.415 -7.125 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.589 -1.239 -7.294 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.405 1.137 -3.482 1.00 0.00 N ATOM 1019 CA ILE A 67 -10.068 1.046 -2.188 1.00 0.00 C ATOM 1020 C ILE A 67 -10.681 -0.349 -2.132 1.00 0.00 C ATOM 1021 O ILE A 67 -11.809 -0.569 -2.564 1.00 0.00 O ATOM 1022 CB ILE A 67 -11.117 2.170 -2.000 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -10.490 3.573 -2.171 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -11.770 2.061 -0.605 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -11.543 4.655 -2.419 1.00 0.00 C ATOM 0 H ILE A 67 -10.063 1.212 -4.258 1.00 0.00 H new ATOM 0 HA ILE A 67 -9.366 1.189 -1.367 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.876 2.042 -2.772 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -9.918 3.824 -1.278 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.788 3.555 -3.004 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.506 2.856 -0.484 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.263 1.093 -0.508 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -11.003 2.156 0.164 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -11.052 5.621 -2.532 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -12.098 4.421 -3.328 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -12.230 4.694 -1.574 1.00 0.00 H new ATOM 1037 N TYR A 68 -9.934 -1.305 -1.594 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.449 -2.657 -1.441 1.00 0.00 C ATOM 1039 C TYR A 68 -11.325 -2.701 -0.187 1.00 0.00 C ATOM 1040 O TYR A 68 -10.898 -2.301 0.905 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.320 -3.694 -1.412 1.00 0.00 C ATOM 1042 CG TYR A 68 -8.617 -3.856 -2.752 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -9.131 -4.725 -3.739 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -7.465 -3.100 -3.030 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -8.512 -4.813 -5.006 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -6.822 -3.225 -4.273 1.00 0.00 C ATOM 1047 CZ TYR A 68 -7.355 -4.050 -5.280 1.00 0.00 C ATOM 1048 OH TYR A 68 -6.761 -4.054 -6.512 1.00 0.00 O ATOM 0 H TYR A 68 -8.980 -1.170 -1.260 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.059 -2.921 -2.305 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.588 -3.403 -0.658 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.728 -4.657 -1.105 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.002 -5.326 -3.524 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -7.073 -2.422 -2.287 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -8.923 -5.463 -5.764 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -5.907 -2.681 -4.458 1.00 0.00 H new ATOM 0 HH TYR A 68 -7.375 -4.441 -7.170 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.556 -3.186 -0.338 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.403 -3.620 0.765 1.00 0.00 C ATOM 1060 C GLU A 69 -12.852 -4.952 1.256 1.00 0.00 C ATOM 1061 O GLU A 69 -12.586 -5.827 0.437 1.00 0.00 O ATOM 1062 CB GLU A 69 -14.853 -3.755 0.279 1.00 0.00 C ATOM 1063 CG GLU A 69 -15.811 -4.159 1.409 1.00 0.00 C ATOM 1064 CD GLU A 69 -17.255 -4.389 0.952 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -17.636 -4.089 -0.207 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -18.031 -4.937 1.769 1.00 0.00 O ATOM 0 H GLU A 69 -12.999 -3.289 -1.251 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.402 -2.898 1.581 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.180 -2.808 -0.150 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -14.899 -4.498 -0.517 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.440 -5.071 1.877 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -15.802 -3.382 2.173 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.646 -5.096 2.563 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.896 -6.183 3.185 1.00 0.00 C ATOM 1075 C VAL A 70 -12.540 -6.562 4.524 1.00 0.00 C ATOM 1076 O VAL A 70 -13.510 -5.928 4.970 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.416 -5.759 3.336 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.681 -5.586 2.001 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -10.265 -4.459 4.131 1.00 0.00 C ATOM 0 H VAL A 70 -13.012 -4.431 3.245 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.923 -7.073 2.557 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.959 -6.588 3.877 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.650 -5.288 2.189 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.692 -6.529 1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.178 -4.818 1.409 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -9.209 -4.202 4.211 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.796 -3.656 3.620 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.682 -4.592 5.129 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.012 -7.597 5.183 1.00 0.00 N ATOM 1090 CA ASP A 71 -12.471 -8.059 6.488 1.00 0.00 C ATOM 1091 C ASP A 71 -11.373 -8.051 7.551 1.00 0.00 C ATOM 1092 O ASP A 71 -10.253 -7.560 7.352 1.00 0.00 O ATOM 1093 CB ASP A 71 -13.129 -9.437 6.380 1.00 0.00 C ATOM 1094 CG ASP A 71 -12.104 -10.568 6.489 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -11.081 -10.530 5.766 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -12.296 -11.404 7.395 1.00 0.00 O ATOM 0 H ASP A 71 -11.237 -8.147 4.813 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.220 -7.341 6.823 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.875 -9.546 7.167 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.656 -9.514 5.429 1.00 0.00 H new ATOM 1101 N GLU A 72 -11.747 -8.549 8.729 1.00 0.00 N ATOM 1102 CA GLU A 72 -10.879 -8.810 9.859 1.00 0.00 C ATOM 1103 C GLU A 72 -9.696 -9.673 9.445 1.00 0.00 C ATOM 1104 O GLU A 72 -8.561 -9.304 9.731 1.00 0.00 O ATOM 1105 CB GLU A 72 -11.683 -9.525 10.964 1.00 0.00 C ATOM 1106 CG GLU A 72 -11.732 -8.710 12.256 1.00 0.00 C ATOM 1107 CD GLU A 72 -12.543 -9.382 13.382 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -12.747 -10.622 13.359 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -12.879 -8.684 14.363 1.00 0.00 O ATOM 0 H GLU A 72 -12.718 -8.792 8.923 1.00 0.00 H new ATOM 0 HA GLU A 72 -10.496 -7.861 10.234 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.698 -9.708 10.612 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.235 -10.498 11.166 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -10.714 -8.539 12.606 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.164 -7.732 12.042 1.00 0.00 H new ATOM 1116 N GLN A 73 -9.948 -10.809 8.793 1.00 0.00 N ATOM 1117 CA GLN A 73 -8.926 -11.775 8.454 1.00 0.00 C ATOM 1118 C GLN A 73 -7.907 -11.155 7.500 1.00 0.00 C ATOM 1119 O GLN A 73 -6.714 -11.379 7.705 1.00 0.00 O ATOM 1120 CB GLN A 73 -9.565 -13.056 7.900 1.00 0.00 C ATOM 1121 CG GLN A 73 -8.645 -14.283 8.011 1.00 0.00 C ATOM 1122 CD GLN A 73 -8.518 -14.761 9.460 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -9.437 -15.357 10.018 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -7.421 -14.490 10.141 1.00 0.00 N ATOM 0 H GLN A 73 -10.883 -11.079 8.486 1.00 0.00 H new ATOM 0 HA GLN A 73 -8.381 -12.061 9.353 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.492 -13.254 8.437 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.829 -12.901 6.854 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.038 -15.091 7.394 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.658 -14.035 7.621 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.650 -13.996 9.691 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.344 -14.774 11.117 1.00 0.00 H new ATOM 1133 N MET A 74 -8.329 -10.336 6.526 1.00 0.00 N ATOM 1134 CA MET A 74 -7.385 -9.648 5.653 1.00 0.00 C ATOM 1135 C MET A 74 -6.540 -8.664 6.458 1.00 0.00 C ATOM 1136 O MET A 74 -5.333 -8.571 6.252 1.00 0.00 O ATOM 1137 CB MET A 74 -8.156 -8.945 4.532 1.00 0.00 C ATOM 1138 CG MET A 74 -7.277 -8.122 3.582 1.00 0.00 C ATOM 1139 SD MET A 74 -5.909 -9.007 2.796 1.00 0.00 S ATOM 1140 CE MET A 74 -6.870 -10.282 1.959 1.00 0.00 C ATOM 0 H MET A 74 -9.310 -10.139 6.329 1.00 0.00 H new ATOM 0 HA MET A 74 -6.703 -10.370 5.203 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.695 -9.694 3.952 1.00 0.00 H new ATOM 0 HB3 MET A 74 -8.903 -8.288 4.977 1.00 0.00 H new ATOM 0 HG2 MET A 74 -7.912 -7.708 2.799 1.00 0.00 H new ATOM 0 HG3 MET A 74 -6.866 -7.279 4.138 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.255 -10.759 1.196 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.193 -11.029 2.684 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.744 -9.830 1.490 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.157 -7.899 7.367 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.380 -6.934 8.159 1.00 0.00 C ATOM 1152 C LEU A 75 -5.375 -7.629 9.078 1.00 0.00 C ATOM 1153 O LEU A 75 -4.229 -7.200 9.170 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.291 -6.001 8.968 1.00 0.00 C ATOM 1155 CG LEU A 75 -6.574 -4.689 9.374 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -5.992 -3.853 8.222 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -7.562 -3.784 10.115 1.00 0.00 C ATOM 0 H LEU A 75 -8.156 -7.924 7.569 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.819 -6.327 7.448 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.177 -5.762 8.380 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -7.633 -6.518 9.864 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.733 -5.021 9.982 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.515 -2.960 8.625 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.254 -4.445 7.680 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -6.793 -3.561 7.543 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.062 -2.859 10.403 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -8.404 -3.554 9.462 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.924 -4.294 11.008 1.00 0.00 H new ATOM 1169 N ARG A 76 -5.804 -8.711 9.727 1.00 0.00 N ATOM 1170 CA ARG A 76 -4.960 -9.570 10.551 1.00 0.00 C ATOM 1171 C ARG A 76 -3.805 -10.122 9.723 1.00 0.00 C ATOM 1172 O ARG A 76 -2.689 -10.187 10.222 1.00 0.00 O ATOM 1173 CB ARG A 76 -5.786 -10.735 11.112 1.00 0.00 C ATOM 1174 CG ARG A 76 -6.774 -10.349 12.222 1.00 0.00 C ATOM 1175 CD ARG A 76 -7.599 -11.599 12.541 1.00 0.00 C ATOM 1176 NE ARG A 76 -8.635 -11.350 13.553 1.00 0.00 N ATOM 1177 CZ ARG A 76 -9.072 -12.225 14.468 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -8.447 -13.376 14.696 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -10.177 -11.936 15.144 1.00 0.00 N ATOM 0 H ARG A 76 -6.775 -9.021 9.692 1.00 0.00 H new ATOM 0 HA ARG A 76 -4.561 -8.979 11.375 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.341 -11.195 10.295 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.104 -11.492 11.499 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.242 -10.001 13.108 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.420 -9.533 11.897 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.069 -11.962 11.627 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.935 -12.388 12.893 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.061 -10.423 13.559 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.608 -13.615 14.167 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.806 -14.021 15.400 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.673 -11.064 14.961 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.530 -12.586 15.846 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.077 -10.532 8.483 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.078 -11.133 7.624 1.00 0.00 C ATOM 1195 C PHE A 77 -1.992 -10.108 7.342 1.00 0.00 C ATOM 1196 O PHE A 77 -0.825 -10.379 7.586 1.00 0.00 O ATOM 1197 CB PHE A 77 -3.709 -11.665 6.333 1.00 0.00 C ATOM 1198 CG PHE A 77 -2.677 -12.068 5.307 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -1.774 -13.111 5.580 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -2.548 -11.321 4.127 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -0.731 -13.393 4.682 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -1.507 -11.608 3.232 1.00 0.00 C ATOM 1203 CZ PHE A 77 -0.596 -12.642 3.501 1.00 0.00 C ATOM 0 H PHE A 77 -4.999 -10.453 8.054 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.631 -11.991 8.127 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.338 -12.524 6.567 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.359 -10.900 5.908 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.882 -13.696 6.481 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.248 -10.528 3.908 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.032 -14.187 4.899 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.405 -11.028 2.327 1.00 0.00 H new ATOM 0 HZ PHE A 77 0.202 -12.859 2.806 1.00 0.00 H new ATOM 1213 N LEU A 78 -2.369 -8.918 6.872 1.00 0.00 N ATOM 1214 CA LEU A 78 -1.439 -7.815 6.650 1.00 0.00 C ATOM 1215 C LEU A 78 -0.632 -7.504 7.915 1.00 0.00 C ATOM 1216 O LEU A 78 0.553 -7.205 7.804 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.217 -6.569 6.190 1.00 0.00 C ATOM 1218 CG LEU A 78 -2.418 -6.414 4.672 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -2.772 -7.699 3.929 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -3.544 -5.407 4.407 1.00 0.00 C ATOM 0 H LEU A 78 -3.335 -8.693 6.634 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.734 -8.109 5.873 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.198 -6.583 6.666 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.697 -5.685 6.558 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.451 -6.083 4.294 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.893 -7.484 2.867 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.973 -8.429 4.063 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.703 -8.104 4.325 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.687 -5.296 3.332 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -4.468 -5.766 4.861 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -3.278 -4.442 4.839 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.248 -7.553 9.102 1.00 0.00 N ATOM 1233 CA ASP A 79 -0.570 -7.297 10.380 1.00 0.00 C ATOM 1234 C ASP A 79 0.617 -8.245 10.564 1.00 0.00 C ATOM 1235 O ASP A 79 1.712 -7.842 10.952 1.00 0.00 O ATOM 1236 CB ASP A 79 -1.560 -7.406 11.557 1.00 0.00 C ATOM 1237 CG ASP A 79 -1.200 -6.485 12.726 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -1.625 -5.303 12.675 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -0.586 -6.931 13.719 1.00 0.00 O ATOM 0 H ASP A 79 -2.239 -7.773 9.204 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.184 -6.278 10.364 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.563 -7.163 11.205 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.586 -8.437 11.909 1.00 0.00 H new ATOM 1244 N ASP A 80 0.401 -9.515 10.237 1.00 0.00 N ATOM 1245 CA ASP A 80 1.353 -10.605 10.416 1.00 0.00 C ATOM 1246 C ASP A 80 2.324 -10.753 9.239 1.00 0.00 C ATOM 1247 O ASP A 80 3.439 -11.251 9.400 1.00 0.00 O ATOM 1248 CB ASP A 80 0.505 -11.876 10.574 1.00 0.00 C ATOM 1249 CG ASP A 80 1.302 -13.130 10.893 1.00 0.00 C ATOM 1250 OD1 ASP A 80 1.580 -13.351 12.095 1.00 0.00 O ATOM 1251 OD2 ASP A 80 1.497 -13.980 9.999 1.00 0.00 O ATOM 0 H ASP A 80 -0.478 -9.825 9.823 1.00 0.00 H new ATOM 0 HA ASP A 80 1.983 -10.410 11.284 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.226 -11.714 11.366 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -0.055 -12.041 9.653 1.00 0.00 H new ATOM 1256 N PHE A 81 1.913 -10.337 8.042 1.00 0.00 N ATOM 1257 CA PHE A 81 2.625 -10.577 6.795 1.00 0.00 C ATOM 1258 C PHE A 81 3.557 -9.421 6.456 1.00 0.00 C ATOM 1259 O PHE A 81 4.669 -9.663 5.982 1.00 0.00 O ATOM 1260 CB PHE A 81 1.608 -10.778 5.669 1.00 0.00 C ATOM 1261 CG PHE A 81 2.228 -11.090 4.320 1.00 0.00 C ATOM 1262 CD1 PHE A 81 2.687 -12.386 4.020 1.00 0.00 C ATOM 1263 CD2 PHE A 81 2.338 -10.075 3.355 1.00 0.00 C ATOM 1264 CE1 PHE A 81 3.216 -12.666 2.746 1.00 0.00 C ATOM 1265 CE2 PHE A 81 2.874 -10.349 2.086 1.00 0.00 C ATOM 1266 CZ PHE A 81 3.312 -11.649 1.779 1.00 0.00 C ATOM 0 H PHE A 81 1.050 -9.809 7.913 1.00 0.00 H new ATOM 0 HA PHE A 81 3.237 -11.472 6.910 1.00 0.00 H new ATOM 0 HB2 PHE A 81 0.935 -11.590 5.943 1.00 0.00 H new ATOM 0 HB3 PHE A 81 1.001 -9.877 5.578 1.00 0.00 H new ATOM 0 HD1 PHE A 81 2.633 -13.165 4.766 1.00 0.00 H new ATOM 0 HD2 PHE A 81 2.007 -9.074 3.591 1.00 0.00 H new ATOM 0 HE1 PHE A 81 3.550 -13.666 2.510 1.00 0.00 H new ATOM 0 HE2 PHE A 81 2.949 -9.564 1.349 1.00 0.00 H new ATOM 0 HZ PHE A 81 3.721 -11.866 0.803 1.00 0.00 H new ATOM 1276 N GLU A 82 3.129 -8.174 6.679 1.00 0.00 N ATOM 1277 CA GLU A 82 3.968 -6.998 6.442 1.00 0.00 C ATOM 1278 C GLU A 82 4.897 -6.748 7.645 1.00 0.00 C ATOM 1279 O GLU A 82 5.577 -5.726 7.685 1.00 0.00 O ATOM 1280 CB GLU A 82 3.125 -5.745 6.131 1.00 0.00 C ATOM 1281 CG GLU A 82 2.004 -5.889 5.086 1.00 0.00 C ATOM 1282 CD GLU A 82 2.388 -6.404 3.693 1.00 0.00 C ATOM 1283 OE1 GLU A 82 3.570 -6.360 3.281 1.00 0.00 O ATOM 1284 OE2 GLU A 82 1.438 -6.770 2.953 1.00 0.00 O ATOM 0 H GLU A 82 2.196 -7.954 7.027 1.00 0.00 H new ATOM 0 HA GLU A 82 4.580 -7.201 5.564 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.675 -5.401 7.063 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.801 -4.959 5.794 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.249 -6.560 5.495 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.532 -4.914 4.964 1.00 0.00 H new ATOM 1291 N ASP A 83 4.935 -7.662 8.625 1.00 0.00 N ATOM 1292 CA ASP A 83 5.832 -7.634 9.785 1.00 0.00 C ATOM 1293 C ASP A 83 5.638 -6.364 10.632 1.00 0.00 C ATOM 1294 O ASP A 83 6.572 -5.862 11.260 1.00 0.00 O ATOM 1295 CB ASP A 83 7.297 -7.872 9.347 1.00 0.00 C ATOM 1296 CG ASP A 83 7.912 -9.082 10.039 1.00 0.00 C ATOM 1297 OD1 ASP A 83 8.309 -8.975 11.220 1.00 0.00 O ATOM 1298 OD2 ASP A 83 7.978 -10.164 9.402 1.00 0.00 O ATOM 0 H ASP A 83 4.316 -8.473 8.630 1.00 0.00 H new ATOM 0 HA ASP A 83 5.568 -8.459 10.447 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.333 -8.015 8.267 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.891 -6.986 9.571 1.00 0.00 H new ATOM 1303 N CYS A 84 4.428 -5.794 10.654 1.00 0.00 N ATOM 1304 CA CYS A 84 4.145 -4.671 11.544 1.00 0.00 C ATOM 1305 C CYS A 84 4.044 -5.211 12.984 1.00 0.00 C ATOM 1306 O CYS A 84 4.018 -6.430 13.187 1.00 0.00 O ATOM 1307 CB CYS A 84 2.922 -3.878 11.046 1.00 0.00 C ATOM 1308 SG CYS A 84 1.363 -4.571 11.620 1.00 0.00 S ATOM 0 H CYS A 84 3.642 -6.089 10.074 1.00 0.00 H new ATOM 0 HA CYS A 84 4.952 -3.938 11.542 1.00 0.00 H new ATOM 0 HB2 CYS A 84 3.002 -2.845 11.384 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.926 -3.858 9.956 1.00 0.00 H new ATOM 0 HG CYS A 84 1.407 -5.868 11.536 1.00 0.00 H new ATOM 1314 N PRO A 85 4.025 -4.363 14.023 1.00 0.00 N ATOM 1315 CA PRO A 85 4.355 -2.938 14.019 1.00 0.00 C ATOM 1316 C PRO A 85 5.855 -2.653 13.791 1.00 0.00 C ATOM 1317 O PRO A 85 6.269 -1.491 13.750 1.00 0.00 O ATOM 1318 CB PRO A 85 3.892 -2.437 15.381 1.00 0.00 C ATOM 1319 CG PRO A 85 4.025 -3.655 16.294 1.00 0.00 C ATOM 1320 CD PRO A 85 3.749 -4.830 15.372 1.00 0.00 C ATOM 0 HA PRO A 85 3.865 -2.428 13.189 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.508 -1.608 15.731 1.00 0.00 H new ATOM 0 HB3 PRO A 85 2.864 -2.077 15.344 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.020 -3.718 16.735 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.313 -3.617 17.118 1.00 0.00 H new ATOM 0 HD2 PRO A 85 4.381 -5.681 15.626 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.715 -5.163 15.465 1.00 0.00 H new ATOM 1328 N SER A 86 6.681 -3.697 13.717 1.00 0.00 N ATOM 1329 CA SER A 86 8.126 -3.637 13.567 1.00 0.00 C ATOM 1330 C SER A 86 8.519 -2.938 12.275 1.00 0.00 C ATOM 1331 O SER A 86 9.201 -1.912 12.309 1.00 0.00 O ATOM 1332 CB SER A 86 8.684 -5.058 13.633 1.00 0.00 C ATOM 1333 OG SER A 86 8.080 -5.705 14.746 1.00 0.00 O ATOM 0 H SER A 86 6.337 -4.656 13.763 1.00 0.00 H new ATOM 0 HA SER A 86 8.553 -3.047 14.378 1.00 0.00 H new ATOM 0 HB2 SER A 86 8.466 -5.598 12.712 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.768 -5.039 13.743 1.00 0.00 H new ATOM 0 HG SER A 86 8.418 -6.622 14.814 1.00 0.00 H new ATOM 1339 N MET A 87 8.119 -3.497 11.135 1.00 0.00 N ATOM 1340 CA MET A 87 8.423 -2.916 9.849 1.00 0.00 C ATOM 1341 C MET A 87 7.506 -1.711 9.636 1.00 0.00 C ATOM 1342 O MET A 87 7.904 -0.574 9.904 1.00 0.00 O ATOM 1343 CB MET A 87 8.303 -3.984 8.753 1.00 0.00 C ATOM 1344 CG MET A 87 9.571 -4.813 8.546 1.00 0.00 C ATOM 1345 SD MET A 87 10.024 -5.116 6.815 1.00 0.00 S ATOM 1346 CE MET A 87 8.511 -5.865 6.162 1.00 0.00 C ATOM 0 H MET A 87 7.578 -4.361 11.087 1.00 0.00 H new ATOM 0 HA MET A 87 9.451 -2.557 9.806 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.481 -4.654 9.003 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.043 -3.497 7.813 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.401 -4.307 9.038 1.00 0.00 H new ATOM 0 HG3 MET A 87 9.443 -5.774 9.045 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.660 -6.135 5.116 1.00 0.00 H new ATOM 0 HE2 MET A 87 8.271 -6.760 6.737 1.00 0.00 H new ATOM 0 HE3 MET A 87 7.690 -5.153 6.239 1.00 0.00 H new ATOM 1356 N TYR A 88 6.296 -1.953 9.133 1.00 0.00 N ATOM 1357 CA TYR A 88 5.293 -0.929 8.865 1.00 0.00 C ATOM 1358 C TYR A 88 4.524 -0.629 10.160 1.00 0.00 C ATOM 1359 O TYR A 88 4.741 -1.283 11.179 1.00 0.00 O ATOM 1360 CB TYR A 88 4.373 -1.423 7.730 1.00 0.00 C ATOM 1361 CG TYR A 88 5.066 -1.512 6.376 1.00 0.00 C ATOM 1362 CD1 TYR A 88 5.069 -0.404 5.507 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.727 -2.693 5.986 1.00 0.00 C ATOM 1364 CE1 TYR A 88 5.741 -0.469 4.273 1.00 0.00 C ATOM 1365 CE2 TYR A 88 6.432 -2.754 4.770 1.00 0.00 C ATOM 1366 CZ TYR A 88 6.433 -1.643 3.897 1.00 0.00 C ATOM 1367 OH TYR A 88 7.076 -1.704 2.695 1.00 0.00 O ATOM 0 H TYR A 88 5.980 -2.893 8.895 1.00 0.00 H new ATOM 0 HA TYR A 88 5.754 0.003 8.537 1.00 0.00 H new ATOM 0 HB2 TYR A 88 3.981 -2.406 7.993 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.519 -0.751 7.648 1.00 0.00 H new ATOM 0 HD1 TYR A 88 4.552 0.501 5.790 1.00 0.00 H new ATOM 0 HD2 TYR A 88 5.692 -3.561 6.627 1.00 0.00 H new ATOM 0 HE1 TYR A 88 5.728 0.383 3.609 1.00 0.00 H new ATOM 0 HE2 TYR A 88 6.973 -3.650 4.504 1.00 0.00 H new ATOM 0 HH TYR A 88 6.973 -0.850 2.225 1.00 0.00 H new ATOM 1377 N GLN A 89 3.603 0.334 10.129 1.00 0.00 N ATOM 1378 CA GLN A 89 2.533 0.525 11.100 1.00 0.00 C ATOM 1379 C GLN A 89 1.267 0.850 10.306 1.00 0.00 C ATOM 1380 O GLN A 89 1.314 1.637 9.354 1.00 0.00 O ATOM 1381 CB GLN A 89 2.828 1.672 12.085 1.00 0.00 C ATOM 1382 CG GLN A 89 4.027 1.447 13.023 1.00 0.00 C ATOM 1383 CD GLN A 89 5.305 2.122 12.519 1.00 0.00 C ATOM 1384 OE1 GLN A 89 5.407 3.351 12.469 1.00 0.00 O ATOM 1385 NE2 GLN A 89 6.313 1.354 12.145 1.00 0.00 N ATOM 0 H GLN A 89 3.585 1.035 9.388 1.00 0.00 H new ATOM 0 HA GLN A 89 2.426 -0.380 11.698 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.002 2.583 11.513 1.00 0.00 H new ATOM 0 HB3 GLN A 89 1.940 1.843 12.693 1.00 0.00 H new ATOM 0 HG2 GLN A 89 3.785 1.831 14.014 1.00 0.00 H new ATOM 0 HG3 GLN A 89 4.204 0.377 13.130 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.224 0.339 12.188 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.180 1.776 11.813 1.00 0.00 H new ATOM 1394 N ARG A 90 0.134 0.258 10.680 1.00 0.00 N ATOM 1395 CA ARG A 90 -1.164 0.620 10.122 1.00 0.00 C ATOM 1396 C ARG A 90 -1.543 2.005 10.635 1.00 0.00 C ATOM 1397 O ARG A 90 -1.490 2.237 11.842 1.00 0.00 O ATOM 1398 CB ARG A 90 -2.192 -0.457 10.502 1.00 0.00 C ATOM 1399 CG ARG A 90 -3.590 -0.227 9.895 1.00 0.00 C ATOM 1400 CD ARG A 90 -4.532 0.669 10.716 1.00 0.00 C ATOM 1401 NE ARG A 90 -4.708 0.153 12.079 1.00 0.00 N ATOM 1402 CZ ARG A 90 -5.687 0.413 12.945 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -6.693 1.216 12.625 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -5.653 -0.162 14.134 1.00 0.00 N ATOM 0 H ARG A 90 0.092 -0.485 11.378 1.00 0.00 H new ATOM 0 HA ARG A 90 -1.133 0.666 9.033 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.821 -1.430 10.178 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.280 -0.495 11.588 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.469 0.214 8.906 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.070 -1.196 9.755 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.130 1.681 10.758 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.501 0.731 10.221 1.00 0.00 H new ATOM 0 HE ARG A 90 -3.986 -0.489 12.406 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.727 1.647 11.701 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.432 1.402 13.303 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.887 -0.791 14.374 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.393 0.024 14.812 1.00 0.00 H new ATOM 1418 N THR A 91 -2.003 2.874 9.741 1.00 0.00 N ATOM 1419 CA THR A 91 -2.425 4.249 9.995 1.00 0.00 C ATOM 1420 C THR A 91 -3.726 4.510 9.224 1.00 0.00 C ATOM 1421 O THR A 91 -4.185 3.656 8.462 1.00 0.00 O ATOM 1422 CB THR A 91 -1.294 5.197 9.549 1.00 0.00 C ATOM 1423 OG1 THR A 91 -0.062 4.721 10.045 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.409 6.634 10.060 1.00 0.00 C ATOM 0 H THR A 91 -2.097 2.622 8.757 1.00 0.00 H new ATOM 0 HA THR A 91 -2.617 4.421 11.054 1.00 0.00 H new ATOM 0 HB THR A 91 -1.366 5.211 8.461 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.481 4.384 9.302 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.567 7.220 9.691 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.340 7.074 9.703 1.00 0.00 H new ATOM 0 HG23 THR A 91 -1.402 6.634 11.150 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.320 5.689 9.405 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.497 6.214 8.722 1.00 0.00 C ATOM 1434 C ALA A 92 -5.126 7.489 7.957 1.00 0.00 C ATOM 1435 O ALA A 92 -4.377 8.326 8.459 1.00 0.00 O ATOM 1436 CB ALA A 92 -6.566 6.434 9.793 1.00 0.00 C ATOM 0 H ALA A 92 -3.959 6.354 10.089 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.888 5.525 7.973 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.470 6.828 9.329 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.792 5.486 10.281 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.199 7.145 10.533 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.629 7.618 6.726 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.398 8.748 5.810 1.00 0.00 C ATOM 1444 C LEU A 93 -6.677 9.072 5.021 1.00 0.00 C ATOM 1445 O LEU A 93 -7.691 8.405 5.235 1.00 0.00 O ATOM 1446 CB LEU A 93 -4.156 8.464 4.930 1.00 0.00 C ATOM 1447 CG LEU A 93 -4.254 7.534 3.694 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -5.249 6.368 3.828 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -4.558 8.280 2.410 1.00 0.00 C ATOM 0 H LEU A 93 -6.237 6.907 6.319 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.170 9.653 6.372 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.787 9.427 4.577 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.389 8.048 5.583 1.00 0.00 H new ATOM 0 HG LEU A 93 -3.252 7.107 3.646 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -5.243 5.778 2.912 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.959 5.737 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -6.251 6.762 3.999 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.614 7.573 1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.511 8.799 2.508 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -3.768 9.005 2.215 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.645 10.066 4.128 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.769 10.498 3.289 1.00 0.00 C ATOM 1463 C GLN A 94 -7.482 10.201 1.807 1.00 0.00 C ATOM 1464 O GLN A 94 -6.473 10.654 1.257 1.00 0.00 O ATOM 1465 CB GLN A 94 -8.023 11.996 3.509 1.00 0.00 C ATOM 1466 CG GLN A 94 -9.279 12.512 2.783 1.00 0.00 C ATOM 1467 CD GLN A 94 -10.496 12.668 3.691 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -10.482 13.413 4.668 1.00 0.00 O ATOM 1469 NE2 GLN A 94 -11.572 11.964 3.398 1.00 0.00 N ATOM 0 H GLN A 94 -5.801 10.615 3.963 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.664 9.943 3.571 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -8.124 12.188 4.577 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -7.155 12.559 3.165 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -9.053 13.475 2.326 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -9.527 11.825 1.974 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.573 11.349 2.585 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.403 12.035 3.985 1.00 0.00 H new ATOM 1478 N VAL A 95 -8.371 9.451 1.157 1.00 0.00 N ATOM 1479 CA VAL A 95 -8.262 9.007 -0.232 1.00 0.00 C ATOM 1480 C VAL A 95 -9.451 9.597 -0.994 1.00 0.00 C ATOM 1481 O VAL A 95 -10.539 9.743 -0.431 1.00 0.00 O ATOM 1482 CB VAL A 95 -8.233 7.462 -0.255 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -8.357 6.796 -1.630 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -6.938 6.930 0.387 1.00 0.00 C ATOM 0 H VAL A 95 -9.226 9.121 1.605 1.00 0.00 H new ATOM 0 HA VAL A 95 -7.346 9.349 -0.713 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.128 7.196 0.307 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.323 5.713 -1.514 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.303 7.083 -2.089 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.533 7.118 -2.266 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.939 5.840 0.360 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.077 7.306 -0.166 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.880 7.267 1.422 1.00 0.00 H new ATOM 1494 N GLN A 96 -9.251 9.943 -2.267 1.00 0.00 N ATOM 1495 CA GLN A 96 -10.325 10.346 -3.160 1.00 0.00 C ATOM 1496 C GLN A 96 -10.852 9.086 -3.840 1.00 0.00 C ATOM 1497 O GLN A 96 -10.079 8.247 -4.306 1.00 0.00 O ATOM 1498 CB GLN A 96 -9.818 11.384 -4.173 1.00 0.00 C ATOM 1499 CG GLN A 96 -10.760 11.578 -5.352 1.00 0.00 C ATOM 1500 CD GLN A 96 -10.319 12.661 -6.321 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -9.297 12.604 -6.997 1.00 0.00 O ATOM 1502 NE2 GLN A 96 -11.165 13.650 -6.505 1.00 0.00 N ATOM 0 H GLN A 96 -8.330 9.950 -2.705 1.00 0.00 H new ATOM 0 HA GLN A 96 -11.135 10.825 -2.610 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -9.678 12.339 -3.666 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.841 11.074 -4.544 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.849 10.635 -5.892 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -11.753 11.824 -4.975 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -12.017 13.703 -5.946 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -10.970 14.364 -7.207 1.00 0.00 H new ATOM 1511 N VAL A 97 -12.170 8.996 -3.929 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.942 8.046 -4.701 1.00 0.00 C ATOM 1513 C VAL A 97 -12.888 8.532 -6.151 1.00 0.00 C ATOM 1514 O VAL A 97 -13.627 9.435 -6.545 1.00 0.00 O ATOM 1515 CB VAL A 97 -14.366 8.037 -4.097 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -15.349 7.140 -4.840 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -14.331 7.573 -2.632 1.00 0.00 C ATOM 0 H VAL A 97 -12.773 9.641 -3.419 1.00 0.00 H new ATOM 0 HA VAL A 97 -12.570 7.022 -4.676 1.00 0.00 H new ATOM 0 HB VAL A 97 -14.713 9.066 -4.184 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -16.324 7.189 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -15.440 7.477 -5.873 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -14.987 6.112 -4.824 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -15.342 7.574 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -13.920 6.565 -2.579 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.706 8.251 -2.051 1.00 0.00 H new ATOM 1527 N LEU A 98 -11.962 7.991 -6.944 1.00 0.00 N ATOM 1528 CA LEU A 98 -11.910 8.244 -8.382 1.00 0.00 C ATOM 1529 C LEU A 98 -13.060 7.499 -9.075 1.00 0.00 C ATOM 1530 O LEU A 98 -13.552 7.955 -10.104 1.00 0.00 O ATOM 1531 CB LEU A 98 -10.557 7.795 -8.973 1.00 0.00 C ATOM 1532 CG LEU A 98 -9.586 8.950 -9.284 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -8.854 9.418 -8.030 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -8.527 8.479 -10.286 1.00 0.00 C ATOM 0 H LEU A 98 -11.229 7.367 -6.607 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.014 9.316 -8.551 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.077 7.111 -8.273 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.742 7.235 -9.890 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.178 9.771 -9.689 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -8.178 10.233 -8.286 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.579 9.766 -7.294 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.282 8.590 -7.612 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.842 9.298 -10.504 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.970 7.644 -9.861 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.014 8.159 -11.207 1.00 0.00 H new ATOM 1546 N GLU A 99 -13.483 6.350 -8.552 1.00 0.00 N ATOM 1547 CA GLU A 99 -14.707 5.645 -8.922 1.00 0.00 C ATOM 1548 C GLU A 99 -15.190 4.924 -7.653 1.00 0.00 C ATOM 1549 O GLU A 99 -14.401 4.756 -6.722 1.00 0.00 O ATOM 1550 CB GLU A 99 -14.402 4.679 -10.078 1.00 0.00 C ATOM 1551 CG GLU A 99 -15.641 4.152 -10.819 1.00 0.00 C ATOM 1552 CD GLU A 99 -15.304 3.038 -11.818 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -14.358 2.247 -11.578 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -15.973 2.920 -12.871 1.00 0.00 O ATOM 0 H GLU A 99 -12.957 5.864 -7.826 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.492 6.313 -9.277 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.755 5.185 -10.795 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.842 3.830 -9.686 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -16.362 3.777 -10.092 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -16.121 4.976 -11.348 1.00 0.00 H new ATOM 1561 N TRP A 100 -16.442 4.466 -7.614 1.00 0.00 N ATOM 1562 CA TRP A 100 -17.030 3.688 -6.527 1.00 0.00 C ATOM 1563 C TRP A 100 -17.903 2.604 -7.143 1.00 0.00 C ATOM 1564 O TRP A 100 -18.811 2.927 -7.918 1.00 0.00 O ATOM 1565 CB TRP A 100 -17.883 4.581 -5.613 1.00 0.00 C ATOM 1566 CG TRP A 100 -18.454 3.879 -4.417 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -19.732 3.452 -4.282 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -17.770 3.489 -3.185 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -19.867 2.785 -3.084 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -18.694 2.780 -2.366 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -16.462 3.643 -2.678 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -18.341 2.246 -1.118 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -16.091 3.105 -1.430 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -17.027 2.402 -0.648 1.00 0.00 C ATOM 0 H TRP A 100 -17.101 4.636 -8.373 1.00 0.00 H new ATOM 0 HA TRP A 100 -16.237 3.249 -5.922 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -17.273 5.417 -5.271 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.702 5.001 -6.197 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -20.522 3.610 -5.001 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -20.733 2.348 -2.768 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -15.730 4.185 -3.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -19.073 1.720 -0.524 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -15.081 3.233 -1.070 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -16.737 1.986 0.306 1.00 0.00 H new ATOM 1585 N GLU A 101 -17.662 1.337 -6.807 1.00 0.00 N ATOM 1586 CA GLU A 101 -18.547 0.257 -7.205 1.00 0.00 C ATOM 1587 C GLU A 101 -19.767 0.226 -6.289 1.00 0.00 C ATOM 1588 O GLU A 101 -19.667 -0.149 -5.120 1.00 0.00 O ATOM 1589 CB GLU A 101 -17.846 -1.109 -7.153 1.00 0.00 C ATOM 1590 CG GLU A 101 -16.649 -1.242 -8.092 1.00 0.00 C ATOM 1591 CD GLU A 101 -16.983 -0.961 -9.557 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -16.876 0.207 -9.999 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -17.326 -1.916 -10.290 1.00 0.00 O ATOM 0 H GLU A 101 -16.856 1.039 -6.258 1.00 0.00 H new ATOM 0 HA GLU A 101 -18.849 0.445 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -17.513 -1.294 -6.132 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -18.571 -1.885 -7.397 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -15.867 -0.555 -7.769 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -16.243 -2.250 -8.008 1.00 0.00 H new ATOM 1600 N GLY A 102 -20.933 0.524 -6.850 1.00 0.00 N ATOM 1601 CA GLY A 102 -22.184 0.011 -6.311 1.00 0.00 C ATOM 1602 C GLY A 102 -22.744 0.898 -5.217 1.00 0.00 C ATOM 1603 O GLY A 102 -22.673 2.129 -5.280 1.00 0.00 O ATOM 0 H GLY A 102 -21.037 1.116 -7.674 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.915 -0.077 -7.115 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -22.023 -0.992 -5.916 1.00 0.00 H new ATOM 1607 N ASP A 103 -23.426 0.248 -4.286 1.00 0.00 N ATOM 1608 CA ASP A 103 -24.224 0.843 -3.228 1.00 0.00 C ATOM 1609 C ASP A 103 -23.358 1.597 -2.224 1.00 0.00 C ATOM 1610 O ASP A 103 -22.169 1.296 -2.076 1.00 0.00 O ATOM 1611 CB ASP A 103 -24.967 -0.290 -2.522 1.00 0.00 C ATOM 1612 CG ASP A 103 -26.269 0.143 -1.845 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -26.489 1.352 -1.605 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -27.095 -0.767 -1.603 1.00 0.00 O ATOM 0 H ASP A 103 -23.437 -0.771 -4.248 1.00 0.00 H new ATOM 0 HA ASP A 103 -24.917 1.565 -3.659 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -25.190 -1.072 -3.248 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -24.309 -0.730 -1.772 1.00 0.00 H new ATOM 1619 N GLY A 104 -23.969 2.504 -1.466 1.00 0.00 N ATOM 1620 CA GLY A 104 -23.362 3.164 -0.327 1.00 0.00 C ATOM 1621 C GLY A 104 -22.137 3.962 -0.728 1.00 0.00 C ATOM 1622 O GLY A 104 -21.035 3.568 -0.379 1.00 0.00 O ATOM 0 H GLY A 104 -24.928 2.805 -1.637 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -24.091 3.826 0.141 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -23.083 2.420 0.419 1.00 0.00 H new ATOM 1626 N ASP A 105 -22.366 5.125 -1.344 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.418 5.991 -2.049 1.00 0.00 C ATOM 1628 C ASP A 105 -21.080 7.180 -1.133 1.00 0.00 C ATOM 1629 O ASP A 105 -21.884 8.110 -1.013 1.00 0.00 O ATOM 1630 CB ASP A 105 -22.052 6.492 -3.352 1.00 0.00 C ATOM 1631 CG ASP A 105 -21.198 7.488 -4.137 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -20.142 7.944 -3.668 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -21.661 7.834 -5.262 1.00 0.00 O ATOM 0 H ASP A 105 -23.306 5.520 -1.363 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.509 5.442 -2.294 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.264 5.634 -3.990 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.008 6.960 -3.118 1.00 0.00 H new ATOM 1638 N PRO A 106 -20.049 7.052 -0.270 1.00 0.00 N ATOM 1639 CA PRO A 106 -19.710 8.025 0.771 1.00 0.00 C ATOM 1640 C PRO A 106 -19.467 9.450 0.268 1.00 0.00 C ATOM 1641 O PRO A 106 -19.616 10.382 1.063 1.00 0.00 O ATOM 1642 CB PRO A 106 -18.456 7.466 1.461 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.851 6.551 0.406 1.00 0.00 C ATOM 1644 CD PRO A 106 -19.063 5.984 -0.291 1.00 0.00 C ATOM 0 HA PRO A 106 -20.559 8.136 1.445 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.767 8.261 1.747 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -18.707 6.920 2.370 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -17.209 7.100 -0.283 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -17.240 5.767 0.854 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -18.826 5.686 -1.313 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -19.433 5.096 0.222 1.00 0.00 H new ATOM 1652 N GLY A 107 -19.128 9.653 -1.005 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.754 10.953 -1.542 1.00 0.00 C ATOM 1654 C GLY A 107 -17.377 10.880 -2.181 1.00 0.00 C ATOM 1655 O GLY A 107 -16.724 9.836 -2.150 1.00 0.00 O ATOM 0 H GLY A 107 -19.106 8.906 -1.699 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -19.489 11.275 -2.280 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.755 11.697 -0.746 1.00 0.00 H new ATOM 1659 N ASP A 108 -16.950 11.995 -2.777 1.00 0.00 N ATOM 1660 CA ASP A 108 -15.729 12.055 -3.576 1.00 0.00 C ATOM 1661 C ASP A 108 -14.472 11.781 -2.747 1.00 0.00 C ATOM 1662 O ASP A 108 -13.448 11.438 -3.331 1.00 0.00 O ATOM 1663 CB ASP A 108 -15.606 13.423 -4.253 1.00 0.00 C ATOM 1664 CG ASP A 108 -14.492 13.468 -5.309 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -14.650 12.907 -6.423 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -13.481 14.171 -5.071 1.00 0.00 O ATOM 0 H ASP A 108 -17.445 12.885 -2.717 1.00 0.00 H new ATOM 0 HA ASP A 108 -15.805 11.271 -4.329 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -16.556 13.677 -4.723 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -15.412 14.182 -3.495 1.00 0.00 H new ATOM 1671 N SER A 109 -14.513 11.871 -1.411 1.00 0.00 N ATOM 1672 CA SER A 109 -13.419 11.387 -0.588 1.00 0.00 C ATOM 1673 C SER A 109 -13.908 10.492 0.539 1.00 0.00 C ATOM 1674 O SER A 109 -15.069 10.530 0.944 1.00 0.00 O ATOM 1675 CB SER A 109 -12.537 12.543 -0.105 1.00 0.00 C ATOM 1676 OG SER A 109 -13.250 13.578 0.556 1.00 0.00 O ATOM 0 H SER A 109 -15.291 12.273 -0.888 1.00 0.00 H new ATOM 0 HA SER A 109 -12.785 10.754 -1.209 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.779 12.149 0.572 1.00 0.00 H new ATOM 0 HB3 SER A 109 -12.012 12.967 -0.961 1.00 0.00 H new ATOM 0 HG SER A 109 -12.625 14.278 0.837 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.988 9.688 1.065 1.00 0.00 N ATOM 1683 CA VAL A 110 -13.203 8.773 2.171 1.00 0.00 C ATOM 1684 C VAL A 110 -11.959 8.774 3.049 1.00 0.00 C ATOM 1685 O VAL A 110 -10.907 9.293 2.654 1.00 0.00 O ATOM 1686 CB VAL A 110 -13.509 7.353 1.648 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -14.812 7.299 0.873 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -12.382 6.752 0.790 1.00 0.00 C ATOM 0 H VAL A 110 -12.031 9.659 0.713 1.00 0.00 H new ATOM 0 HA VAL A 110 -14.062 9.096 2.758 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.597 6.744 2.548 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.986 6.281 0.524 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -15.633 7.606 1.520 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -14.754 7.971 0.017 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.669 5.754 0.459 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -12.209 7.387 -0.079 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -11.469 6.689 1.381 1.00 0.00 H new ATOM 1698 N GLN A 111 -12.060 8.157 4.223 1.00 0.00 N ATOM 1699 CA GLN A 111 -10.902 7.698 4.963 1.00 0.00 C ATOM 1700 C GLN A 111 -10.824 6.176 4.789 1.00 0.00 C ATOM 1701 O GLN A 111 -11.811 5.514 4.470 1.00 0.00 O ATOM 1702 CB GLN A 111 -10.983 8.223 6.410 1.00 0.00 C ATOM 1703 CG GLN A 111 -10.007 7.536 7.372 1.00 0.00 C ATOM 1704 CD GLN A 111 -9.524 8.425 8.509 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -8.259 8.818 8.486 1.00 0.00 O flip ATOM 1706 NE2 GLN A 111 -10.245 8.682 9.467 1.00 0.00 N flip ATOM 0 H GLN A 111 -12.950 7.964 4.683 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.957 8.093 4.592 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -10.784 9.295 6.410 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -11.999 8.087 6.780 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.490 6.655 7.794 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -9.143 7.186 6.807 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -11.217 8.373 9.471 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -9.873 9.205 10.260 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.622 5.636 4.945 1.00 0.00 N ATOM 1716 CA CYS A 112 -9.216 4.244 4.815 1.00 0.00 C ATOM 1717 C CYS A 112 -7.968 4.020 5.654 1.00 0.00 C ATOM 1718 O CYS A 112 -7.270 4.979 6.006 1.00 0.00 O ATOM 1719 CB CYS A 112 -9.016 3.844 3.338 1.00 0.00 C ATOM 1720 SG CYS A 112 -8.701 5.268 2.301 1.00 0.00 S ATOM 0 H CYS A 112 -8.826 6.224 5.191 1.00 0.00 H new ATOM 0 HA CYS A 112 -10.009 3.595 5.188 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -8.182 3.146 3.260 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -9.903 3.322 2.979 1.00 0.00 H new ATOM 0 HG CYS A 112 -8.748 4.913 1.051 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.674 2.753 5.950 1.00 0.00 N ATOM 1727 CA PHE A 113 -6.401 2.383 6.551 1.00 0.00 C ATOM 1728 C PHE A 113 -5.369 2.146 5.450 1.00 0.00 C ATOM 1729 O PHE A 113 -5.726 1.806 4.318 1.00 0.00 O ATOM 1730 CB PHE A 113 -6.549 1.161 7.468 1.00 0.00 C ATOM 1731 CG PHE A 113 -7.504 1.347 8.630 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -7.388 2.466 9.479 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -8.499 0.383 8.881 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -8.289 2.642 10.544 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -9.407 0.570 9.936 1.00 0.00 C ATOM 1736 CZ PHE A 113 -9.314 1.704 10.758 1.00 0.00 C ATOM 0 H PHE A 113 -8.304 1.968 5.781 1.00 0.00 H new ATOM 0 HA PHE A 113 -6.054 3.202 7.181 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.888 0.315 6.870 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.567 0.900 7.862 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.605 3.190 9.311 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.564 -0.500 8.262 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -8.194 3.497 11.197 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.180 -0.162 10.116 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.029 1.856 11.553 1.00 0.00 H new ATOM 1746 N VAL A 114 -4.102 2.347 5.805 1.00 0.00 N ATOM 1747 CA VAL A 114 -2.904 2.139 5.003 1.00 0.00 C ATOM 1748 C VAL A 114 -1.822 1.604 5.938 1.00 0.00 C ATOM 1749 O VAL A 114 -1.806 1.958 7.116 1.00 0.00 O ATOM 1750 CB VAL A 114 -2.486 3.475 4.338 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -1.055 3.506 3.786 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -3.388 3.777 3.139 1.00 0.00 C ATOM 0 H VAL A 114 -3.871 2.688 6.738 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.075 1.422 4.200 1.00 0.00 H new ATOM 0 HB VAL A 114 -2.569 4.203 5.145 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -0.858 4.481 3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -0.348 3.327 4.596 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -0.941 2.732 3.028 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.083 4.718 2.682 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.302 2.974 2.407 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.423 3.855 3.473 1.00 0.00 H new ATOM 1762 N TYR A 115 -0.889 0.805 5.421 1.00 0.00 N ATOM 1763 CA TYR A 115 0.319 0.408 6.133 1.00 0.00 C ATOM 1764 C TYR A 115 1.413 1.384 5.715 1.00 0.00 C ATOM 1765 O TYR A 115 1.915 1.331 4.589 1.00 0.00 O ATOM 1766 CB TYR A 115 0.665 -1.064 5.860 1.00 0.00 C ATOM 1767 CG TYR A 115 -0.071 -2.050 6.758 1.00 0.00 C ATOM 1768 CD1 TYR A 115 -1.463 -1.946 6.950 1.00 0.00 C ATOM 1769 CD2 TYR A 115 0.638 -3.078 7.412 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -2.143 -2.845 7.783 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -0.036 -3.984 8.252 1.00 0.00 C ATOM 1772 CZ TYR A 115 -1.432 -3.866 8.444 1.00 0.00 C ATOM 1773 OH TYR A 115 -2.124 -4.740 9.221 1.00 0.00 O ATOM 0 H TYR A 115 -0.955 0.411 4.482 1.00 0.00 H new ATOM 0 HA TYR A 115 0.188 0.460 7.214 1.00 0.00 H new ATOM 0 HB2 TYR A 115 0.435 -1.294 4.820 1.00 0.00 H new ATOM 0 HB3 TYR A 115 1.738 -1.204 5.987 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -2.013 -1.163 6.449 1.00 0.00 H new ATOM 0 HD2 TYR A 115 1.704 -3.171 7.268 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -3.211 -2.755 7.918 1.00 0.00 H new ATOM 0 HE2 TYR A 115 0.513 -4.769 8.750 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.666 -5.326 8.652 1.00 0.00 H new ATOM 1783 N THR A 116 1.717 2.336 6.591 1.00 0.00 N ATOM 1784 CA THR A 116 2.757 3.336 6.409 1.00 0.00 C ATOM 1785 C THR A 116 3.967 2.945 7.258 1.00 0.00 C ATOM 1786 O THR A 116 4.027 1.857 7.822 1.00 0.00 O ATOM 1787 CB THR A 116 2.206 4.728 6.783 1.00 0.00 C ATOM 1788 OG1 THR A 116 1.736 4.748 8.114 1.00 0.00 O ATOM 1789 CG2 THR A 116 1.050 5.158 5.893 1.00 0.00 C ATOM 0 H THR A 116 1.226 2.434 7.480 1.00 0.00 H new ATOM 0 HA THR A 116 3.074 3.383 5.367 1.00 0.00 H new ATOM 0 HB THR A 116 3.042 5.415 6.652 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.527 5.670 8.373 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.701 6.144 6.200 1.00 0.00 H new ATOM 0 HG22 THR A 116 1.384 5.198 4.856 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.235 4.440 5.984 1.00 0.00 H new ATOM 1797 N THR A 117 4.916 3.852 7.417 1.00 0.00 N ATOM 1798 CA THR A 117 5.830 3.865 8.542 1.00 0.00 C ATOM 1799 C THR A 117 5.924 5.315 9.009 1.00 0.00 C ATOM 1800 O THR A 117 5.676 6.246 8.232 1.00 0.00 O ATOM 1801 CB THR A 117 7.180 3.240 8.142 1.00 0.00 C ATOM 1802 OG1 THR A 117 8.131 3.427 9.171 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.734 3.817 6.833 1.00 0.00 C ATOM 0 H THR A 117 5.074 4.612 6.755 1.00 0.00 H new ATOM 0 HA THR A 117 5.479 3.255 9.374 1.00 0.00 H new ATOM 0 HB THR A 117 6.997 2.177 7.986 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.783 4.104 8.895 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.686 3.341 6.600 1.00 0.00 H new ATOM 0 HG22 THR A 117 7.027 3.630 6.025 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.883 4.891 6.943 1.00 0.00 H new ATOM 1811 N ALA A 118 6.287 5.492 10.276 1.00 0.00 N ATOM 1812 CA ALA A 118 6.615 6.771 10.881 1.00 0.00 C ATOM 1813 C ALA A 118 8.024 6.740 11.490 1.00 0.00 C ATOM 1814 O ALA A 118 8.414 7.704 12.148 1.00 0.00 O ATOM 1815 CB ALA A 118 5.560 7.095 11.937 1.00 0.00 C ATOM 0 H ALA A 118 6.362 4.715 10.932 1.00 0.00 H new ATOM 0 HA ALA A 118 6.614 7.551 10.120 1.00 0.00 H new ATOM 0 HB1 ALA A 118 5.792 8.053 12.401 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.578 7.148 11.466 1.00 0.00 H new ATOM 0 HB3 ALA A 118 5.556 6.315 12.698 1.00 0.00 H new ATOM 1821 N THR A 119 8.777 5.649 11.300 1.00 0.00 N ATOM 1822 CA THR A 119 10.073 5.418 11.930 1.00 0.00 C ATOM 1823 C THR A 119 11.083 4.958 10.867 1.00 0.00 C ATOM 1824 O THR A 119 11.737 3.920 10.970 1.00 0.00 O ATOM 1825 CB THR A 119 9.877 4.496 13.152 1.00 0.00 C ATOM 1826 OG1 THR A 119 11.109 4.232 13.794 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.137 3.189 12.841 1.00 0.00 C ATOM 0 H THR A 119 8.490 4.886 10.687 1.00 0.00 H new ATOM 0 HA THR A 119 10.514 6.327 12.338 1.00 0.00 H new ATOM 0 HB THR A 119 9.229 5.050 13.831 1.00 0.00 H new ATOM 0 HG1 THR A 119 11.752 3.888 13.139 1.00 0.00 H new ATOM 0 HG21 THR A 119 9.041 2.599 13.753 1.00 0.00 H new ATOM 0 HG22 THR A 119 8.145 3.417 12.450 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.698 2.621 12.099 1.00 0.00 H new ATOM 1835 N TYR A 120 11.193 5.753 9.809 1.00 0.00 N ATOM 1836 CA TYR A 120 12.151 5.578 8.731 1.00 0.00 C ATOM 1837 C TYR A 120 13.580 5.815 9.241 1.00 0.00 C ATOM 1838 O TYR A 120 13.794 6.569 10.197 1.00 0.00 O ATOM 1839 CB TYR A 120 11.772 6.550 7.599 1.00 0.00 C ATOM 1840 CG TYR A 120 11.311 7.927 8.057 1.00 0.00 C ATOM 1841 CD1 TYR A 120 12.243 8.964 8.243 1.00 0.00 C ATOM 1842 CD2 TYR A 120 9.948 8.152 8.345 1.00 0.00 C ATOM 1843 CE1 TYR A 120 11.820 10.218 8.718 1.00 0.00 C ATOM 1844 CE2 TYR A 120 9.518 9.404 8.821 1.00 0.00 C ATOM 1845 CZ TYR A 120 10.457 10.442 9.014 1.00 0.00 C ATOM 1846 OH TYR A 120 10.058 11.665 9.463 1.00 0.00 O ATOM 0 H TYR A 120 10.593 6.567 9.676 1.00 0.00 H new ATOM 0 HA TYR A 120 12.123 4.557 8.349 1.00 0.00 H new ATOM 0 HB2 TYR A 120 12.633 6.672 6.942 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.979 6.098 7.003 1.00 0.00 H new ATOM 0 HD1 TYR A 120 13.286 8.797 8.020 1.00 0.00 H new ATOM 0 HD2 TYR A 120 9.231 7.358 8.199 1.00 0.00 H new ATOM 0 HE1 TYR A 120 12.539 11.012 8.857 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.473 9.571 9.038 1.00 0.00 H new ATOM 0 HH TYR A 120 9.091 11.656 9.619 1.00 0.00 H new ATOM 1856 N ALA A 121 14.573 5.199 8.590 1.00 0.00 N ATOM 1857 CA ALA A 121 15.964 5.623 8.736 1.00 0.00 C ATOM 1858 C ALA A 121 16.103 7.019 8.108 1.00 0.00 C ATOM 1859 O ALA A 121 15.378 7.318 7.155 1.00 0.00 O ATOM 1860 CB ALA A 121 16.894 4.617 8.050 1.00 0.00 C ATOM 0 H ALA A 121 14.437 4.408 7.960 1.00 0.00 H new ATOM 0 HA ALA A 121 16.244 5.665 9.789 1.00 0.00 H new ATOM 0 HB1 ALA A 121 17.928 4.941 8.164 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.769 3.635 8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.647 4.558 6.990 1.00 0.00 H new ATOM 1866 N PRO A 122 17.006 7.886 8.593 1.00 0.00 N ATOM 1867 CA PRO A 122 17.030 9.278 8.164 1.00 0.00 C ATOM 1868 C PRO A 122 17.380 9.429 6.685 1.00 0.00 C ATOM 1869 O PRO A 122 16.817 10.296 6.012 1.00 0.00 O ATOM 1870 CB PRO A 122 18.022 9.989 9.091 1.00 0.00 C ATOM 1871 CG PRO A 122 18.923 8.858 9.586 1.00 0.00 C ATOM 1872 CD PRO A 122 17.984 7.654 9.644 1.00 0.00 C ATOM 0 HA PRO A 122 16.041 9.730 8.243 1.00 0.00 H new ATOM 0 HB2 PRO A 122 18.591 10.752 8.560 1.00 0.00 H new ATOM 0 HB3 PRO A 122 17.513 10.487 9.916 1.00 0.00 H new ATOM 0 HG2 PRO A 122 19.758 8.684 8.907 1.00 0.00 H new ATOM 0 HG3 PRO A 122 19.349 9.083 10.564 1.00 0.00 H new ATOM 0 HD2 PRO A 122 18.526 6.723 9.480 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.504 7.575 10.619 1.00 0.00 H new ATOM 1880 N GLU A 123 18.264 8.586 6.152 1.00 0.00 N ATOM 1881 CA GLU A 123 18.629 8.594 4.738 1.00 0.00 C ATOM 1882 C GLU A 123 17.444 8.395 3.798 1.00 0.00 C ATOM 1883 O GLU A 123 17.494 8.865 2.668 1.00 0.00 O ATOM 1884 CB GLU A 123 19.737 7.573 4.443 1.00 0.00 C ATOM 1885 CG GLU A 123 19.444 6.174 5.013 1.00 0.00 C ATOM 1886 CD GLU A 123 20.283 5.924 6.263 1.00 0.00 C ATOM 1887 OE1 GLU A 123 20.072 6.646 7.260 1.00 0.00 O ATOM 1888 OE2 GLU A 123 21.195 5.061 6.218 1.00 0.00 O ATOM 0 H GLU A 123 18.750 7.873 6.695 1.00 0.00 H new ATOM 0 HA GLU A 123 19.010 9.595 4.538 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.873 7.497 3.364 1.00 0.00 H new ATOM 0 HB3 GLU A 123 20.677 7.937 4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 123 18.385 6.087 5.255 1.00 0.00 H new ATOM 0 HG3 GLU A 123 19.663 5.415 4.262 1.00 0.00 H new ATOM 1895 N TRP A 124 16.346 7.783 4.236 1.00 0.00 N ATOM 1896 CA TRP A 124 15.204 7.527 3.393 1.00 0.00 C ATOM 1897 C TRP A 124 14.532 8.822 2.928 1.00 0.00 C ATOM 1898 O TRP A 124 13.811 8.824 1.937 1.00 0.00 O ATOM 1899 CB TRP A 124 14.274 6.565 4.121 1.00 0.00 C ATOM 1900 CG TRP A 124 14.890 5.227 4.444 1.00 0.00 C ATOM 1901 CD1 TRP A 124 16.117 4.787 4.068 1.00 0.00 C ATOM 1902 CD2 TRP A 124 14.292 4.108 5.158 1.00 0.00 C ATOM 1903 NE1 TRP A 124 16.323 3.504 4.519 1.00 0.00 N ATOM 1904 CE2 TRP A 124 15.219 3.022 5.181 1.00 0.00 C ATOM 1905 CE3 TRP A 124 13.010 3.878 5.694 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 14.903 1.777 5.737 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 12.690 2.642 6.281 1.00 0.00 C ATOM 1908 CH2 TRP A 124 13.634 1.599 6.310 1.00 0.00 C ATOM 0 H TRP A 124 16.233 7.452 5.194 1.00 0.00 H new ATOM 0 HA TRP A 124 15.519 7.048 2.466 1.00 0.00 H new ATOM 0 HB2 TRP A 124 13.942 7.032 5.048 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.386 6.404 3.509 1.00 0.00 H new ATOM 0 HD1 TRP A 124 16.830 5.362 3.496 1.00 0.00 H new ATOM 0 HE1 TRP A 124 17.185 2.977 4.380 1.00 0.00 H new ATOM 0 HE3 TRP A 124 12.266 4.659 5.653 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 15.621 0.970 5.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.712 2.491 6.713 1.00 0.00 H new ATOM 0 HH2 TRP A 124 13.381 0.658 6.775 1.00 0.00 H new ATOM 1919 N LEU A 125 14.829 9.949 3.580 1.00 0.00 N ATOM 1920 CA LEU A 125 14.418 11.284 3.165 1.00 0.00 C ATOM 1921 C LEU A 125 15.181 11.773 1.916 1.00 0.00 C ATOM 1922 O LEU A 125 14.960 12.918 1.517 1.00 0.00 O ATOM 1923 CB LEU A 125 14.605 12.260 4.344 1.00 0.00 C ATOM 1924 CG LEU A 125 13.800 11.913 5.618 1.00 0.00 C ATOM 1925 CD1 LEU A 125 14.319 12.768 6.771 1.00 0.00 C ATOM 1926 CD2 LEU A 125 12.291 12.146 5.453 1.00 0.00 C ATOM 0 H LEU A 125 15.380 9.953 4.438 1.00 0.00 H new ATOM 0 HA LEU A 125 13.366 11.244 2.884 1.00 0.00 H new ATOM 0 HB2 LEU A 125 15.664 12.296 4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.322 13.260 4.016 1.00 0.00 H new ATOM 0 HG LEU A 125 13.938 10.850 5.818 1.00 0.00 H new ATOM 0 HD11 LEU A 125 13.760 12.534 7.677 1.00 0.00 H new ATOM 0 HD12 LEU A 125 15.376 12.558 6.932 1.00 0.00 H new ATOM 0 HD13 LEU A 125 14.191 13.823 6.528 1.00 0.00 H new ATOM 0 HD21 LEU A 125 11.779 11.885 6.379 1.00 0.00 H new ATOM 0 HD22 LEU A 125 12.108 13.195 5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.913 11.523 4.642 1.00 0.00 H new ATOM 1938 N PHE A 126 16.069 10.972 1.310 1.00 0.00 N ATOM 1939 CA PHE A 126 16.839 11.306 0.103 1.00 0.00 C ATOM 1940 C PHE A 126 16.464 10.466 -1.119 1.00 0.00 C ATOM 1941 O PHE A 126 16.899 10.755 -2.241 1.00 0.00 O ATOM 1942 CB PHE A 126 18.328 11.095 0.381 1.00 0.00 C ATOM 1943 CG PHE A 126 18.927 12.113 1.338 1.00 0.00 C ATOM 1944 CD1 PHE A 126 18.888 13.491 1.047 1.00 0.00 C ATOM 1945 CD2 PHE A 126 19.523 11.682 2.537 1.00 0.00 C ATOM 1946 CE1 PHE A 126 19.432 14.419 1.954 1.00 0.00 C ATOM 1947 CE2 PHE A 126 20.098 12.606 3.426 1.00 0.00 C ATOM 1948 CZ PHE A 126 20.041 13.980 3.142 1.00 0.00 C ATOM 0 H PHE A 126 16.279 10.037 1.661 1.00 0.00 H new ATOM 0 HA PHE A 126 16.606 12.345 -0.129 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.473 10.096 0.792 1.00 0.00 H new ATOM 0 HB3 PHE A 126 18.873 11.134 -0.562 1.00 0.00 H new ATOM 0 HD1 PHE A 126 18.440 13.835 0.127 1.00 0.00 H new ATOM 0 HD2 PHE A 126 19.539 10.629 2.777 1.00 0.00 H new ATOM 0 HE1 PHE A 126 19.381 15.476 1.736 1.00 0.00 H new ATOM 0 HE2 PHE A 126 20.583 12.260 4.327 1.00 0.00 H new ATOM 0 HZ PHE A 126 20.463 14.695 3.833 1.00 0.00 H new ATOM 1958 N LEU A 127 15.695 9.406 -0.911 1.00 0.00 N ATOM 1959 CA LEU A 127 15.268 8.445 -1.918 1.00 0.00 C ATOM 1960 C LEU A 127 14.311 9.156 -2.878 1.00 0.00 C ATOM 1961 O LEU A 127 13.549 10.007 -2.411 1.00 0.00 O ATOM 1962 CB LEU A 127 14.512 7.338 -1.180 1.00 0.00 C ATOM 1963 CG LEU A 127 15.311 6.283 -0.392 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.802 5.180 -1.314 1.00 0.00 C ATOM 1965 CD2 LEU A 127 16.562 6.781 0.276 1.00 0.00 C ATOM 0 H LEU A 127 15.333 9.182 0.016 1.00 0.00 H new ATOM 0 HA LEU A 127 16.110 8.036 -2.476 1.00 0.00 H new ATOM 0 HB2 LEU A 127 13.825 7.818 -0.483 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.904 6.809 -1.914 1.00 0.00 H new ATOM 0 HG LEU A 127 14.597 5.957 0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 127 16.364 4.446 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 127 14.948 4.694 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 127 16.447 5.608 -2.082 1.00 0.00 H new ATOM 0 HD21 LEU A 127 17.046 5.958 0.802 1.00 0.00 H new ATOM 0 HD22 LEU A 127 17.242 7.181 -0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 127 16.307 7.566 0.988 1.00 0.00 H new ATOM 1977 N PRO A 128 14.285 8.812 -4.176 1.00 0.00 N ATOM 1978 CA PRO A 128 13.339 9.421 -5.099 1.00 0.00 C ATOM 1979 C PRO A 128 11.916 9.041 -4.687 1.00 0.00 C ATOM 1980 O PRO A 128 11.683 7.956 -4.144 1.00 0.00 O ATOM 1981 CB PRO A 128 13.708 8.885 -6.484 1.00 0.00 C ATOM 1982 CG PRO A 128 14.343 7.532 -6.183 1.00 0.00 C ATOM 1983 CD PRO A 128 15.043 7.764 -4.842 1.00 0.00 C ATOM 0 HA PRO A 128 13.381 10.510 -5.097 1.00 0.00 H new ATOM 0 HB2 PRO A 128 12.830 8.784 -7.122 1.00 0.00 H new ATOM 0 HB3 PRO A 128 14.402 9.549 -7.000 1.00 0.00 H new ATOM 0 HG2 PRO A 128 13.595 6.742 -6.115 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.049 7.237 -6.960 1.00 0.00 H new ATOM 0 HD2 PRO A 128 15.057 6.852 -4.245 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.080 8.065 -4.989 1.00 0.00 H new ATOM 1991 N TYR A 129 10.959 9.921 -4.953 1.00 0.00 N ATOM 1992 CA TYR A 129 9.554 9.648 -4.699 1.00 0.00 C ATOM 1993 C TYR A 129 8.940 8.994 -5.924 1.00 0.00 C ATOM 1994 O TYR A 129 9.371 9.224 -7.057 1.00 0.00 O ATOM 1995 CB TYR A 129 8.846 10.950 -4.338 1.00 0.00 C ATOM 1996 CG TYR A 129 9.368 11.650 -3.101 1.00 0.00 C ATOM 1997 CD1 TYR A 129 9.738 10.904 -1.967 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.519 13.050 -3.105 1.00 0.00 C ATOM 1999 CE1 TYR A 129 10.269 11.549 -0.841 1.00 0.00 C ATOM 2000 CE2 TYR A 129 10.033 13.702 -1.975 1.00 0.00 C ATOM 2001 CZ TYR A 129 10.410 12.950 -0.842 1.00 0.00 C ATOM 2002 OH TYR A 129 10.878 13.574 0.266 1.00 0.00 O ATOM 0 H TYR A 129 11.137 10.843 -5.351 1.00 0.00 H new ATOM 0 HA TYR A 129 9.444 8.961 -3.860 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.926 11.634 -5.183 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.786 10.740 -4.196 1.00 0.00 H new ATOM 0 HD1 TYR A 129 9.613 9.831 -1.964 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.239 13.621 -3.978 1.00 0.00 H new ATOM 0 HE1 TYR A 129 10.568 10.974 0.023 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.140 14.777 -1.972 1.00 0.00 H new ATOM 0 HH TYR A 129 10.918 14.540 0.105 1.00 0.00 H new ATOM 2012 N HIS A 130 7.907 8.192 -5.691 1.00 0.00 N ATOM 2013 CA HIS A 130 7.154 7.508 -6.731 1.00 0.00 C ATOM 2014 C HIS A 130 5.696 7.929 -6.618 1.00 0.00 C ATOM 2015 O HIS A 130 5.152 7.992 -5.518 1.00 0.00 O ATOM 2016 CB HIS A 130 7.354 5.994 -6.581 1.00 0.00 C ATOM 2017 CG HIS A 130 8.789 5.553 -6.774 1.00 0.00 C ATOM 2018 ND1 HIS A 130 9.307 4.941 -7.894 1.00 0.00 N ATOM 2019 CD2 HIS A 130 9.812 5.698 -5.874 1.00 0.00 C ATOM 2020 CE1 HIS A 130 10.609 4.708 -7.667 1.00 0.00 C ATOM 2021 NE2 HIS A 130 10.972 5.173 -6.460 1.00 0.00 N ATOM 0 H HIS A 130 7.563 7.996 -4.751 1.00 0.00 H new ATOM 0 HA HIS A 130 7.503 7.778 -7.728 1.00 0.00 H new ATOM 0 HB2 HIS A 130 7.018 5.687 -5.590 1.00 0.00 H new ATOM 0 HB3 HIS A 130 6.723 5.479 -7.305 1.00 0.00 H new ATOM 0 HD2 HIS A 130 9.738 6.138 -4.890 1.00 0.00 H new ATOM 0 HE1 HIS A 130 11.274 4.214 -8.360 1.00 0.00 H new ATOM 0 HE2 HIS A 130 11.906 5.149 -6.051 1.00 0.00 H new ATOM 2029 N GLU A 131 5.077 8.242 -7.754 1.00 0.00 N ATOM 2030 CA GLU A 131 3.666 8.627 -7.837 1.00 0.00 C ATOM 2031 C GLU A 131 2.764 7.395 -7.883 1.00 0.00 C ATOM 2032 O GLU A 131 1.563 7.469 -7.647 1.00 0.00 O ATOM 2033 CB GLU A 131 3.467 9.455 -9.108 1.00 0.00 C ATOM 2034 CG GLU A 131 2.264 10.405 -8.999 1.00 0.00 C ATOM 2035 CD GLU A 131 1.637 10.678 -10.363 1.00 0.00 C ATOM 2036 OE1 GLU A 131 2.069 11.652 -11.020 1.00 0.00 O ATOM 2037 OE2 GLU A 131 0.700 9.942 -10.761 1.00 0.00 O ATOM 0 H GLU A 131 5.548 8.236 -8.659 1.00 0.00 H new ATOM 0 HA GLU A 131 3.399 9.207 -6.954 1.00 0.00 H new ATOM 0 HB2 GLU A 131 4.369 10.034 -9.307 1.00 0.00 H new ATOM 0 HB3 GLU A 131 3.324 8.786 -9.957 1.00 0.00 H new ATOM 0 HG2 GLU A 131 1.516 9.971 -8.335 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.582 11.346 -8.550 1.00 0.00 H new ATOM 2044 N SER A 132 3.338 6.232 -8.166 1.00 0.00 N ATOM 2045 CA SER A 132 2.711 4.959 -7.923 1.00 0.00 C ATOM 2046 C SER A 132 3.810 3.915 -8.001 1.00 0.00 C ATOM 2047 O SER A 132 4.766 4.055 -8.771 1.00 0.00 O ATOM 2048 CB SER A 132 1.616 4.693 -8.965 1.00 0.00 C ATOM 2049 OG SER A 132 0.575 3.890 -8.434 1.00 0.00 O ATOM 0 H SER A 132 4.268 6.157 -8.578 1.00 0.00 H new ATOM 0 HA SER A 132 2.227 4.934 -6.947 1.00 0.00 H new ATOM 0 HB2 SER A 132 1.204 5.641 -9.311 1.00 0.00 H new ATOM 0 HB3 SER A 132 2.051 4.198 -9.833 1.00 0.00 H new ATOM 0 HG SER A 132 -0.291 4.299 -8.640 1.00 0.00 H new ATOM 2055 N TYR A 133 3.652 2.867 -7.208 1.00 0.00 N ATOM 2056 CA TYR A 133 4.465 1.677 -7.305 1.00 0.00 C ATOM 2057 C TYR A 133 3.833 0.735 -8.324 1.00 0.00 C ATOM 2058 O TYR A 133 2.607 0.731 -8.520 1.00 0.00 O ATOM 2059 CB TYR A 133 4.534 1.049 -5.911 1.00 0.00 C ATOM 2060 CG TYR A 133 5.309 -0.245 -5.781 1.00 0.00 C ATOM 2061 CD1 TYR A 133 6.565 -0.383 -6.396 1.00 0.00 C ATOM 2062 CD2 TYR A 133 4.833 -1.264 -4.937 1.00 0.00 C ATOM 2063 CE1 TYR A 133 7.364 -1.499 -6.133 1.00 0.00 C ATOM 2064 CE2 TYR A 133 5.627 -2.389 -4.667 1.00 0.00 C ATOM 2065 CZ TYR A 133 6.918 -2.480 -5.230 1.00 0.00 C ATOM 2066 OH TYR A 133 7.780 -3.432 -4.804 1.00 0.00 O ATOM 0 H TYR A 133 2.946 2.824 -6.473 1.00 0.00 H new ATOM 0 HA TYR A 133 5.478 1.899 -7.641 1.00 0.00 H new ATOM 0 HB2 TYR A 133 4.975 1.778 -5.232 1.00 0.00 H new ATOM 0 HB3 TYR A 133 3.515 0.870 -5.569 1.00 0.00 H new ATOM 0 HD1 TYR A 133 6.915 0.379 -7.077 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.851 -1.180 -4.494 1.00 0.00 H new ATOM 0 HE1 TYR A 133 8.321 -1.608 -6.622 1.00 0.00 H new ATOM 0 HE2 TYR A 133 5.253 -3.179 -4.033 1.00 0.00 H new ATOM 0 HH TYR A 133 7.868 -3.381 -3.829 1.00 0.00 H new ATOM 2076 N ASP A 134 4.669 -0.071 -8.967 1.00 0.00 N ATOM 2077 CA ASP A 134 4.317 -1.188 -9.810 1.00 0.00 C ATOM 2078 C ASP A 134 5.441 -2.227 -9.833 1.00 0.00 C ATOM 2079 O ASP A 134 6.583 -1.988 -9.449 1.00 0.00 O ATOM 2080 CB ASP A 134 3.991 -0.731 -11.241 1.00 0.00 C ATOM 2081 CG ASP A 134 5.135 -0.197 -12.069 1.00 0.00 C ATOM 2082 OD1 ASP A 134 6.196 0.125 -11.497 1.00 0.00 O ATOM 2083 OD2 ASP A 134 4.926 -0.158 -13.300 1.00 0.00 O ATOM 0 H ASP A 134 5.679 0.054 -8.903 1.00 0.00 H new ATOM 0 HA ASP A 134 3.423 -1.646 -9.388 1.00 0.00 H new ATOM 0 HB2 ASP A 134 3.552 -1.575 -11.774 1.00 0.00 H new ATOM 0 HB3 ASP A 134 3.225 0.042 -11.183 1.00 0.00 H new ATOM 2088 N SER A 135 5.076 -3.425 -10.263 1.00 0.00 N ATOM 2089 CA SER A 135 5.933 -4.598 -10.383 1.00 0.00 C ATOM 2090 C SER A 135 6.535 -4.753 -11.785 1.00 0.00 C ATOM 2091 O SER A 135 7.213 -5.748 -12.035 1.00 0.00 O ATOM 2092 CB SER A 135 5.075 -5.826 -10.058 1.00 0.00 C ATOM 2093 OG SER A 135 3.823 -5.765 -10.724 1.00 0.00 O ATOM 0 H SER A 135 4.118 -3.617 -10.555 1.00 0.00 H new ATOM 0 HA SER A 135 6.771 -4.490 -9.695 1.00 0.00 H new ATOM 0 HB2 SER A 135 5.604 -6.732 -10.354 1.00 0.00 H new ATOM 0 HB3 SER A 135 4.915 -5.887 -8.982 1.00 0.00 H new ATOM 0 HG SER A 135 3.659 -6.611 -11.191 1.00 0.00 H new ATOM 2099 N GLU A 136 6.242 -3.834 -12.710 1.00 0.00 N ATOM 2100 CA GLU A 136 6.459 -3.994 -14.152 1.00 0.00 C ATOM 2101 C GLU A 136 6.904 -2.655 -14.759 1.00 0.00 C ATOM 2102 O GLU A 136 6.697 -2.398 -15.946 1.00 0.00 O ATOM 2103 CB GLU A 136 5.174 -4.546 -14.808 1.00 0.00 C ATOM 2104 CG GLU A 136 4.867 -5.957 -14.283 1.00 0.00 C ATOM 2105 CD GLU A 136 3.603 -6.616 -14.823 1.00 0.00 C ATOM 2106 OE1 GLU A 136 2.770 -5.931 -15.459 1.00 0.00 O ATOM 2107 OE2 GLU A 136 3.407 -7.817 -14.527 1.00 0.00 O ATOM 0 H GLU A 136 5.835 -2.930 -12.469 1.00 0.00 H new ATOM 0 HA GLU A 136 7.256 -4.714 -14.340 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.336 -3.882 -14.596 1.00 0.00 H new ATOM 0 HB3 GLU A 136 5.294 -4.572 -15.891 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.715 -6.601 -14.515 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.791 -5.909 -13.197 1.00 0.00 H new ATOM 2114 N GLY A 137 7.467 -1.774 -13.925 1.00 0.00 N ATOM 2115 CA GLY A 137 7.705 -0.382 -14.259 1.00 0.00 C ATOM 2116 C GLY A 137 9.102 -0.105 -14.788 1.00 0.00 C ATOM 2117 O GLY A 137 9.959 -1.004 -14.758 1.00 0.00 O ATOM 0 H GLY A 137 7.772 -2.022 -12.984 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.976 -0.068 -15.006 1.00 0.00 H new ATOM 0 HA3 GLY A 137 7.536 0.228 -13.372 1.00 0.00 H new ATOM 2121 N PRO A 138 9.384 1.157 -15.164 1.00 0.00 N ATOM 2122 CA PRO A 138 10.736 1.604 -15.465 1.00 0.00 C ATOM 2123 C PRO A 138 11.627 1.545 -14.217 1.00 0.00 C ATOM 2124 O PRO A 138 12.842 1.388 -14.336 1.00 0.00 O ATOM 2125 CB PRO A 138 10.584 3.031 -15.989 1.00 0.00 C ATOM 2126 CG PRO A 138 9.319 3.543 -15.311 1.00 0.00 C ATOM 2127 CD PRO A 138 8.460 2.287 -15.171 1.00 0.00 C ATOM 0 HA PRO A 138 11.223 0.964 -16.201 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.449 3.644 -15.734 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.490 3.049 -17.075 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.536 3.992 -14.342 1.00 0.00 H new ATOM 0 HG3 PRO A 138 8.822 4.305 -15.911 1.00 0.00 H new ATOM 0 HD2 PRO A 138 7.875 2.317 -14.252 1.00 0.00 H new ATOM 0 HD3 PRO A 138 7.753 2.206 -15.996 1.00 0.00 H new ATOM 2135 N HIS A 139 11.035 1.620 -13.020 1.00 0.00 N ATOM 2136 CA HIS A 139 11.710 1.510 -11.744 1.00 0.00 C ATOM 2137 C HIS A 139 12.089 0.041 -11.522 1.00 0.00 C ATOM 2138 O HIS A 139 11.384 -0.705 -10.844 1.00 0.00 O ATOM 2139 CB HIS A 139 10.852 2.075 -10.605 1.00 0.00 C ATOM 2140 CG HIS A 139 10.192 3.403 -10.886 1.00 0.00 C ATOM 2141 ND1 HIS A 139 10.791 4.626 -11.109 1.00 0.00 N ATOM 2142 CD2 HIS A 139 8.842 3.604 -10.870 1.00 0.00 C ATOM 2143 CE1 HIS A 139 9.810 5.545 -11.181 1.00 0.00 C ATOM 2144 NE2 HIS A 139 8.601 4.975 -11.014 1.00 0.00 N ATOM 0 H HIS A 139 10.030 1.765 -12.921 1.00 0.00 H new ATOM 0 HA HIS A 139 12.620 2.110 -11.751 1.00 0.00 H new ATOM 0 HB2 HIS A 139 10.077 1.348 -10.362 1.00 0.00 H new ATOM 0 HB3 HIS A 139 11.479 2.181 -9.719 1.00 0.00 H new ATOM 0 HD2 HIS A 139 8.089 2.837 -10.764 1.00 0.00 H new ATOM 0 HE1 HIS A 139 9.971 6.599 -11.350 1.00 0.00 H new ATOM 0 HE2 HIS A 139 7.696 5.446 -10.996 1.00 0.00 H new ATOM 2152 N GLY A 140 13.190 -0.386 -12.129 1.00 0.00 N ATOM 2153 CA GLY A 140 13.715 -1.752 -12.082 1.00 0.00 C ATOM 2154 C GLY A 140 14.046 -2.257 -10.671 1.00 0.00 C ATOM 2155 O GLY A 140 14.129 -3.465 -10.464 1.00 0.00 O ATOM 0 H GLY A 140 13.769 0.235 -12.693 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.985 -2.424 -12.533 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.616 -1.803 -12.693 1.00 0.00 H new ATOM 2159 N LEU A 141 14.186 -1.359 -9.691 1.00 0.00 N ATOM 2160 CA LEU A 141 14.262 -1.648 -8.256 1.00 0.00 C ATOM 2161 C LEU A 141 12.933 -2.202 -7.719 1.00 0.00 C ATOM 2162 O LEU A 141 12.190 -1.507 -7.015 1.00 0.00 O ATOM 2163 CB LEU A 141 14.685 -0.399 -7.453 1.00 0.00 C ATOM 2164 CG LEU A 141 14.017 0.931 -7.862 1.00 0.00 C ATOM 2165 CD1 LEU A 141 13.361 1.637 -6.682 1.00 0.00 C ATOM 2166 CD2 LEU A 141 15.033 1.879 -8.498 1.00 0.00 C ATOM 0 H LEU A 141 14.253 -0.360 -9.887 1.00 0.00 H new ATOM 0 HA LEU A 141 15.026 -2.415 -8.126 1.00 0.00 H new ATOM 0 HB2 LEU A 141 14.472 -0.580 -6.400 1.00 0.00 H new ATOM 0 HB3 LEU A 141 15.765 -0.282 -7.544 1.00 0.00 H new ATOM 0 HG LEU A 141 13.243 0.673 -8.585 1.00 0.00 H new ATOM 0 HD11 LEU A 141 12.906 2.567 -7.022 1.00 0.00 H new ATOM 0 HD12 LEU A 141 12.594 0.993 -6.253 1.00 0.00 H new ATOM 0 HD13 LEU A 141 14.114 1.857 -5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 141 14.538 2.809 -8.777 1.00 0.00 H new ATOM 0 HD22 LEU A 141 15.829 2.092 -7.784 1.00 0.00 H new ATOM 0 HD23 LEU A 141 15.458 1.413 -9.387 1.00 0.00 H new ATOM 2178 N ARG A 142 12.597 -3.447 -8.048 1.00 0.00 N ATOM 2179 CA ARG A 142 11.308 -4.035 -7.688 1.00 0.00 C ATOM 2180 C ARG A 142 11.436 -4.924 -6.451 1.00 0.00 C ATOM 2181 O ARG A 142 12.561 -5.261 -6.068 1.00 0.00 O ATOM 2182 CB ARG A 142 10.738 -4.807 -8.889 1.00 0.00 C ATOM 2183 CG ARG A 142 10.977 -4.132 -10.258 1.00 0.00 C ATOM 2184 CD ARG A 142 9.725 -4.162 -11.113 1.00 0.00 C ATOM 2185 NE ARG A 142 9.960 -3.695 -12.492 1.00 0.00 N ATOM 2186 CZ ARG A 142 9.959 -4.462 -13.593 1.00 0.00 C ATOM 2187 NH1 ARG A 142 9.949 -5.790 -13.517 1.00 0.00 N ATOM 2188 NH2 ARG A 142 9.954 -3.880 -14.786 1.00 0.00 N ATOM 0 H ARG A 142 13.208 -4.075 -8.570 1.00 0.00 H new ATOM 0 HA ARG A 142 10.611 -3.237 -7.432 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.180 -5.803 -8.907 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.665 -4.937 -8.745 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.292 -3.100 -10.107 1.00 0.00 H new ATOM 0 HG3 ARG A 142 11.788 -4.640 -10.780 1.00 0.00 H new ATOM 0 HD2 ARG A 142 9.335 -5.179 -11.141 1.00 0.00 H new ATOM 0 HD3 ARG A 142 8.960 -3.539 -10.649 1.00 0.00 H new ATOM 0 HE ARG A 142 10.139 -2.699 -12.620 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.942 -6.249 -12.606 1.00 0.00 H new ATOM 0 HH12 ARG A 142 9.948 -6.350 -14.370 1.00 0.00 H new ATOM 0 HH21 ARG A 142 9.951 -2.862 -14.857 1.00 0.00 H new ATOM 0 HH22 ARG A 142 9.953 -4.450 -15.632 1.00 0.00 H new ATOM 2202 N TYR A 143 10.310 -5.306 -5.825 1.00 0.00 N ATOM 2203 CA TYR A 143 10.367 -6.085 -4.583 1.00 0.00 C ATOM 2204 C TYR A 143 11.118 -7.381 -4.842 1.00 0.00 C ATOM 2205 O TYR A 143 10.925 -7.974 -5.904 1.00 0.00 O ATOM 2206 CB TYR A 143 8.977 -6.448 -4.032 1.00 0.00 C ATOM 2207 CG TYR A 143 9.030 -7.182 -2.704 1.00 0.00 C ATOM 2208 CD1 TYR A 143 9.802 -6.670 -1.642 1.00 0.00 C ATOM 2209 CD2 TYR A 143 8.335 -8.393 -2.533 1.00 0.00 C ATOM 2210 CE1 TYR A 143 9.926 -7.400 -0.450 1.00 0.00 C ATOM 2211 CE2 TYR A 143 8.411 -9.103 -1.324 1.00 0.00 C ATOM 2212 CZ TYR A 143 9.244 -8.626 -0.287 1.00 0.00 C ATOM 2213 OH TYR A 143 9.408 -9.348 0.851 1.00 0.00 O ATOM 0 H TYR A 143 9.368 -5.092 -6.153 1.00 0.00 H new ATOM 0 HA TYR A 143 10.869 -5.460 -3.845 1.00 0.00 H new ATOM 0 HB2 TYR A 143 8.392 -5.536 -3.912 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.455 -7.068 -4.761 1.00 0.00 H new ATOM 0 HD1 TYR A 143 10.298 -5.716 -1.745 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.735 -8.782 -3.342 1.00 0.00 H new ATOM 0 HE1 TYR A 143 10.547 -7.022 0.348 1.00 0.00 H new ATOM 0 HE2 TYR A 143 7.837 -10.007 -1.188 1.00 0.00 H new ATOM 0 HH TYR A 143 8.867 -10.164 0.802 1.00 0.00 H new ATOM 2223 N ASN A 144 11.926 -7.831 -3.882 1.00 0.00 N ATOM 2224 CA ASN A 144 12.764 -9.009 -4.049 1.00 0.00 C ATOM 2225 C ASN A 144 12.443 -10.039 -2.971 1.00 0.00 C ATOM 2226 O ASN A 144 13.108 -10.045 -1.935 1.00 0.00 O ATOM 2227 CB ASN A 144 14.258 -8.634 -4.098 1.00 0.00 C ATOM 2228 CG ASN A 144 14.787 -8.520 -5.516 1.00 0.00 C ATOM 2229 OD1 ASN A 144 15.682 -9.268 -5.894 1.00 0.00 O ATOM 2230 ND2 ASN A 144 14.318 -7.572 -6.309 1.00 0.00 N ATOM 0 H ASN A 144 12.015 -7.386 -2.968 1.00 0.00 H new ATOM 0 HA ASN A 144 12.541 -9.469 -5.012 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.408 -7.686 -3.581 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.835 -9.385 -3.559 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.701 -7.456 -7.247 1.00 0.00 H new ATOM 0 HD22 ASN A 144 13.573 -6.956 -5.983 1.00 0.00 H new ATOM 2237 N PRO A 145 11.422 -10.891 -3.151 1.00 0.00 N ATOM 2238 CA PRO A 145 11.122 -11.938 -2.185 1.00 0.00 C ATOM 2239 C PRO A 145 12.096 -13.117 -2.289 1.00 0.00 C ATOM 2240 O PRO A 145 12.655 -13.543 -1.274 1.00 0.00 O ATOM 2241 CB PRO A 145 9.694 -12.369 -2.515 1.00 0.00 C ATOM 2242 CG PRO A 145 9.557 -12.074 -4.007 1.00 0.00 C ATOM 2243 CD PRO A 145 10.415 -10.834 -4.202 1.00 0.00 C ATOM 0 HA PRO A 145 11.223 -11.579 -1.161 1.00 0.00 H new ATOM 0 HB2 PRO A 145 9.536 -13.426 -2.301 1.00 0.00 H new ATOM 0 HB3 PRO A 145 8.963 -11.812 -1.929 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.910 -12.907 -4.615 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.519 -11.893 -4.287 1.00 0.00 H new ATOM 0 HD2 PRO A 145 10.877 -10.827 -5.189 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.817 -9.926 -4.124 1.00 0.00 H new ATOM 2251 N ARG A 146 12.236 -13.722 -3.479 1.00 0.00 N ATOM 2252 CA ARG A 146 12.845 -15.024 -3.688 1.00 0.00 C ATOM 2253 C ARG A 146 12.890 -15.421 -5.160 1.00 0.00 C ATOM 2254 O ARG A 146 13.037 -16.611 -5.415 1.00 0.00 O ATOM 2255 CB ARG A 146 12.034 -16.089 -2.905 1.00 0.00 C ATOM 2256 CG ARG A 146 12.978 -17.084 -2.217 1.00 0.00 C ATOM 2257 CD ARG A 146 12.660 -17.228 -0.720 1.00 0.00 C ATOM 2258 NE ARG A 146 13.836 -16.961 0.123 1.00 0.00 N ATOM 2259 CZ ARG A 146 14.934 -17.715 0.236 1.00 0.00 C ATOM 2260 NH1 ARG A 146 15.051 -18.834 -0.466 1.00 0.00 N ATOM 2261 NH2 ARG A 146 15.923 -17.312 1.018 1.00 0.00 N ATOM 0 H ARG A 146 11.913 -13.294 -4.347 1.00 0.00 H new ATOM 0 HA ARG A 146 13.873 -14.967 -3.332 1.00 0.00 H new ATOM 0 HB2 ARG A 146 11.405 -15.601 -2.160 1.00 0.00 H new ATOM 0 HB3 ARG A 146 11.369 -16.621 -3.585 1.00 0.00 H new ATOM 0 HG2 ARG A 146 12.897 -18.057 -2.701 1.00 0.00 H new ATOM 0 HG3 ARG A 146 14.009 -16.752 -2.340 1.00 0.00 H new ATOM 0 HD2 ARG A 146 11.858 -16.540 -0.452 1.00 0.00 H new ATOM 0 HD3 ARG A 146 12.294 -18.236 -0.523 1.00 0.00 H new ATOM 0 HE ARG A 146 13.811 -16.108 0.682 1.00 0.00 H new ATOM 0 HH11 ARG A 146 14.302 -19.122 -1.095 1.00 0.00 H new ATOM 0 HH12 ARG A 146 15.890 -19.407 -0.377 1.00 0.00 H new ATOM 0 HH21 ARG A 146 15.844 -16.432 1.528 1.00 0.00 H new ATOM 0 HH22 ARG A 146 16.765 -17.881 1.110 1.00 0.00 H new ATOM 2275 N GLU A 147 12.684 -14.502 -6.104 1.00 0.00 N ATOM 2276 CA GLU A 147 12.297 -14.766 -7.475 1.00 0.00 C ATOM 2277 C GLU A 147 13.426 -15.496 -8.201 1.00 0.00 C ATOM 2278 O GLU A 147 14.323 -14.881 -8.775 1.00 0.00 O ATOM 2279 CB GLU A 147 11.796 -13.469 -8.140 1.00 0.00 C ATOM 2280 CG GLU A 147 12.902 -12.445 -8.377 1.00 0.00 C ATOM 2281 CD GLU A 147 12.619 -11.075 -7.791 1.00 0.00 C ATOM 2282 OE1 GLU A 147 12.760 -10.992 -6.555 1.00 0.00 O ATOM 2283 OE2 GLU A 147 12.339 -10.114 -8.551 1.00 0.00 O ATOM 0 H GLU A 147 12.790 -13.505 -5.915 1.00 0.00 H new ATOM 0 HA GLU A 147 11.447 -15.447 -7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 147 11.328 -13.715 -9.093 1.00 0.00 H new ATOM 0 HB3 GLU A 147 11.025 -13.022 -7.513 1.00 0.00 H new ATOM 0 HG2 GLU A 147 13.830 -12.825 -7.951 1.00 0.00 H new ATOM 0 HG3 GLU A 147 13.062 -12.342 -9.450 1.00 0.00 H new ATOM 2290 N ASN A 148 13.416 -16.826 -8.141 1.00 0.00 N ATOM 2291 CA ASN A 148 14.559 -17.686 -8.379 1.00 0.00 C ATOM 2292 C ASN A 148 15.725 -17.229 -7.506 1.00 0.00 C ATOM 2293 O ASN A 148 16.648 -16.566 -7.987 1.00 0.00 O ATOM 2294 CB ASN A 148 14.895 -17.678 -9.862 1.00 0.00 C ATOM 2295 CG ASN A 148 13.761 -18.177 -10.728 1.00 0.00 C ATOM 2296 OD1 ASN A 148 13.240 -19.274 -10.523 1.00 0.00 O ATOM 2297 ND2 ASN A 148 13.324 -17.360 -11.670 1.00 0.00 N ATOM 0 H ASN A 148 12.571 -17.351 -7.915 1.00 0.00 H new ATOM 0 HA ASN A 148 14.333 -18.716 -8.104 1.00 0.00 H new ATOM 0 HB2 ASN A 148 15.156 -16.664 -10.164 1.00 0.00 H new ATOM 0 HB3 ASN A 148 15.775 -18.298 -10.033 1.00 0.00 H new ATOM 0 HD21 ASN A 148 12.532 -17.631 -12.253 1.00 0.00 H new ATOM 0 HD22 ASN A 148 13.778 -16.458 -11.814 1.00 0.00 H new ATOM 2304 N ARG A 149 15.647 -17.502 -6.200 1.00 0.00 N ATOM 2305 CA ARG A 149 16.741 -17.242 -5.270 1.00 0.00 C ATOM 2306 C ARG A 149 18.008 -17.912 -5.783 1.00 0.00 C ATOM 2307 O ARG A 149 18.045 -19.158 -5.850 1.00 0.00 O ATOM 2308 CB ARG A 149 16.382 -17.687 -3.851 1.00 0.00 C ATOM 2309 CG ARG A 149 17.209 -16.945 -2.784 1.00 0.00 C ATOM 2310 CD ARG A 149 16.817 -15.459 -2.655 1.00 0.00 C ATOM 2311 NE ARG A 149 17.980 -14.572 -2.834 1.00 0.00 N ATOM 2312 CZ ARG A 149 18.045 -13.316 -3.299 1.00 0.00 C ATOM 2313 NH1 ARG A 149 16.976 -12.655 -3.736 1.00 0.00 N ATOM 2314 NH2 ARG A 149 19.221 -12.700 -3.324 1.00 0.00 N ATOM 0 H ARG A 149 14.821 -17.910 -5.761 1.00 0.00 H new ATOM 0 HA ARG A 149 16.921 -16.168 -5.215 1.00 0.00 H new ATOM 0 HB2 ARG A 149 15.321 -17.511 -3.674 1.00 0.00 H new ATOM 0 HB3 ARG A 149 16.547 -18.760 -3.755 1.00 0.00 H new ATOM 0 HG2 ARG A 149 17.076 -17.437 -1.820 1.00 0.00 H new ATOM 0 HG3 ARG A 149 18.267 -17.017 -3.035 1.00 0.00 H new ATOM 0 HD2 ARG A 149 16.057 -15.217 -3.398 1.00 0.00 H new ATOM 0 HD3 ARG A 149 16.373 -15.283 -1.675 1.00 0.00 H new ATOM 0 HE ARG A 149 18.876 -14.977 -2.562 1.00 0.00 H new ATOM 0 HH11 ARG A 149 16.060 -13.103 -3.726 1.00 0.00 H new ATOM 0 HH12 ARG A 149 17.073 -11.700 -4.081 1.00 0.00 H new ATOM 0 HH21 ARG A 149 20.056 -13.182 -2.993 1.00 0.00 H new ATOM 0 HH22 ARG A 149 19.289 -11.745 -3.674 1.00 0.00 H new TER 2328 ARG A 149