USER MOD reduce.3.24.130724 H: found=0, std=0, add=1192, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1192 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: B 70 SER OG : rot -79:sc= -1.54! USER MOD Set 1.2: B 73 GLN : amide:sc= 1.04 K(o=-0.5,f=-10!) USER MOD Set 2.1: B 6 ASN : amide:sc= 0.0134 K(o=-1.1,f=-2.5) USER MOD Set 2.2: B 39 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.5) USER MOD Set 3.1: A 44 THR OG1 : rot 7:sc= 0.215 USER MOD Set 3.2: B 3 HIS : no HE2:sc= 1.02 K(o=1.2,f=-5.6!) USER MOD Set 4.1: A 4 MET CE :methyl -133:sc= -0.0459 (180deg=-0.388) USER MOD Set 4.2: A 6 ASN : amide:sc=-0.00822 X(o=-0.054,f=-0.26) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HE2:sc= 0.623 K(o=1.7,f=-7.6!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 CYS SG : rot 138:sc= 1.17 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 138:sc= -0.203 (180deg=-0.793!) USER MOD Single : A 21 GLN : amide:sc= -0.648 X(o=-0.65,f=-0.67) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 82:sc= 0.757 USER MOD Single : A 30 ASN : amide:sc= 0.512 K(o=0.51,f=-8.2!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -172:sc= 1.55 (180deg=1.36) USER MOD Single : A 39 GLN : amide:sc= -3.09! C(o=-3.1!,f=-6!) USER MOD Single : A 45 HIS : no HD1:sc= -6.52! C(o=-6.5!,f=-7.5!) USER MOD Single : A 54 ASN : amide:sc= -0.253 K(o=-0.25,f=-6.4!) USER MOD Single : A 57 GLN : amide:sc= -1.53 K(o=-1.5,f=-3.1!) USER MOD Single : A 64 MET CE :methyl 168:sc= -1.09 (180deg=-1.23) USER MOD Single : A 66 GLN : amide:sc= -0.177 X(o=-0.18,f=-0.26) USER MOD Single : A 67 ASN : amide:sc= -0.0439 X(o=-0.044,f=-0.023) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot -44:sc= 0.0657 USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 74 LYS NZ :NH3+ 168:sc= -0.0112 (180deg=-0.145) USER MOD Single : B 1 GLY N :NH3+ -124:sc= 0.0971 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 4 MET CE :methyl -159:sc= -0.134 (180deg=-0.677) USER MOD Single : B 9 LYS NZ :NH3+ 166:sc= -0.0397 (180deg=-0.254) USER MOD Single : B 15 CYS SG : rot 11:sc= 0.645 USER MOD Single : B 19 MET CE :methyl -139:sc= -0.121 (180deg=-2.98!) USER MOD Single : B 20 LYS NZ :NH3+ 136:sc= -0.482 (180deg=-1.91!) USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot -92:sc= 0.967 USER MOD Single : B 30 ASN : amide:sc= 0.221 K(o=0.22,f=-8.4!) USER MOD Single : B 34 LYS NZ :NH3+ -129:sc= 0.0139 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -162:sc= 1.21 (180deg=0.834) USER MOD Single : B 44 THR OG1 : rot 82:sc= 1.22 USER MOD Single : B 45 HIS : no HE2:sc= -8.29! C(o=-8.3!,f=-14!) USER MOD Single : B 54 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 57 GLN : amide:sc= -1.58 K(o=-1.6,f=-0.48) USER MOD Single : B 64 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 66 GLN : amide:sc= -0.596 X(o=-0.6,f=-0.27) USER MOD Single : B 67 ASN : amide:sc= -0.166 X(o=-0.17,f=-0.068) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0605) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.873 -16.961 9.027 1.00 0.00 N ATOM 2 CA GLY A 1 -7.177 -17.535 7.730 1.00 0.00 C ATOM 3 C GLY A 1 -6.111 -17.199 6.739 1.00 0.00 C ATOM 4 O GLY A 1 -4.935 -17.489 6.973 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.626 -17.207 9.701 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.966 -17.338 9.369 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.808 -15.926 8.942 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.269 -18.617 7.819 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.138 -17.161 7.378 1.00 0.00 H new ATOM 10 N SER A 2 -6.485 -16.547 5.666 1.00 0.00 N ATOM 11 CA SER A 2 -5.543 -16.236 4.620 1.00 0.00 C ATOM 12 C SER A 2 -5.279 -14.727 4.504 1.00 0.00 C ATOM 13 O SER A 2 -4.576 -14.282 3.594 1.00 0.00 O ATOM 14 CB SER A 2 -6.061 -16.796 3.304 1.00 0.00 C ATOM 15 OG SER A 2 -6.344 -18.183 3.431 1.00 0.00 O ATOM 0 H SER A 2 -7.436 -16.221 5.494 1.00 0.00 H new ATOM 0 HA SER A 2 -4.588 -16.699 4.870 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.962 -16.261 3.004 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.321 -16.640 2.519 1.00 0.00 H new ATOM 0 HG SER A 2 -6.678 -18.528 2.577 1.00 0.00 H new ATOM 21 N HIS A 3 -5.812 -13.942 5.432 1.00 0.00 N ATOM 22 CA HIS A 3 -5.608 -12.493 5.388 1.00 0.00 C ATOM 23 C HIS A 3 -5.951 -11.868 6.728 1.00 0.00 C ATOM 24 O HIS A 3 -6.493 -12.520 7.608 1.00 0.00 O ATOM 25 CB HIS A 3 -6.494 -11.822 4.294 1.00 0.00 C ATOM 26 CG HIS A 3 -7.973 -11.814 4.611 1.00 0.00 C ATOM 27 ND1 HIS A 3 -8.591 -10.768 5.268 1.00 0.00 N ATOM 28 CD2 HIS A 3 -8.930 -12.741 4.420 1.00 0.00 C ATOM 29 CE1 HIS A 3 -9.850 -11.067 5.467 1.00 0.00 C ATOM 30 NE2 HIS A 3 -10.077 -12.252 4.962 1.00 0.00 N ATOM 0 H HIS A 3 -6.379 -14.273 6.212 1.00 0.00 H new ATOM 0 HA HIS A 3 -4.557 -12.327 5.150 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -6.159 -10.795 4.151 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -6.340 -12.342 3.348 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -8.138 -9.900 5.553 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -8.809 -13.695 3.928 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -10.577 -10.442 5.964 1.00 0.00 H new ATOM 39 N MET A 4 -5.669 -10.616 6.855 1.00 0.00 N ATOM 40 CA MET A 4 -6.064 -9.851 7.997 1.00 0.00 C ATOM 41 C MET A 4 -6.804 -8.631 7.487 1.00 0.00 C ATOM 42 O MET A 4 -7.209 -8.600 6.304 1.00 0.00 O ATOM 43 CB MET A 4 -4.842 -9.471 8.846 1.00 0.00 C ATOM 44 CG MET A 4 -4.172 -10.653 9.534 1.00 0.00 C ATOM 45 SD MET A 4 -2.725 -10.184 10.515 1.00 0.00 S ATOM 46 CE MET A 4 -1.594 -9.644 9.228 1.00 0.00 C ATOM 0 H MET A 4 -5.149 -10.083 6.158 1.00 0.00 H new ATOM 0 HA MET A 4 -6.717 -10.431 8.649 1.00 0.00 H new ATOM 0 HB2 MET A 4 -4.111 -8.973 8.209 1.00 0.00 H new ATOM 0 HB3 MET A 4 -5.149 -8.750 9.603 1.00 0.00 H new ATOM 0 HG2 MET A 4 -4.897 -11.146 10.181 1.00 0.00 H new ATOM 0 HG3 MET A 4 -3.871 -11.380 8.780 1.00 0.00 H new ATOM 0 HE1 MET A 4 -0.614 -10.091 9.394 1.00 0.00 H new ATOM 0 HE2 MET A 4 -1.975 -9.955 8.255 1.00 0.00 H new ATOM 0 HE3 MET A 4 -1.506 -8.558 9.253 1.00 0.00 H new ATOM 56 N VAL A 5 -7.060 -7.688 8.336 1.00 0.00 N ATOM 57 CA VAL A 5 -7.655 -6.448 7.915 1.00 0.00 C ATOM 58 C VAL A 5 -6.594 -5.381 8.017 1.00 0.00 C ATOM 59 O VAL A 5 -6.262 -4.918 9.119 1.00 0.00 O ATOM 60 CB VAL A 5 -8.897 -6.054 8.767 1.00 0.00 C ATOM 61 CG1 VAL A 5 -9.517 -4.755 8.255 1.00 0.00 C ATOM 62 CG2 VAL A 5 -9.933 -7.170 8.762 1.00 0.00 C ATOM 0 H VAL A 5 -6.866 -7.749 9.336 1.00 0.00 H new ATOM 0 HA VAL A 5 -8.015 -6.559 6.892 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.563 -5.897 9.793 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.383 -4.500 8.866 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.782 -3.953 8.315 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.829 -4.885 7.219 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.792 -6.872 9.364 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -10.256 -7.362 7.739 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -9.494 -8.076 9.180 1.00 0.00 H new ATOM 72 N ASN A 6 -6.006 -5.044 6.893 1.00 0.00 N ATOM 73 CA ASN A 6 -4.928 -4.069 6.872 1.00 0.00 C ATOM 74 C ASN A 6 -5.081 -3.112 5.745 1.00 0.00 C ATOM 75 O ASN A 6 -4.766 -3.390 4.582 1.00 0.00 O ATOM 76 CB ASN A 6 -3.557 -4.734 6.808 1.00 0.00 C ATOM 77 CG ASN A 6 -3.180 -5.394 8.088 1.00 0.00 C ATOM 78 OD1 ASN A 6 -2.617 -4.773 8.985 1.00 0.00 O ATOM 79 ND2 ASN A 6 -3.427 -6.653 8.179 1.00 0.00 N ATOM 0 H ASN A 6 -6.252 -5.427 5.980 1.00 0.00 H new ATOM 0 HA ASN A 6 -4.993 -3.517 7.809 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -3.553 -5.474 6.007 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -2.806 -3.986 6.554 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -3.153 -7.167 9.016 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.897 -7.137 7.414 1.00 0.00 H new ATOM 86 N VAL A 7 -5.591 -2.014 6.064 1.00 0.00 N ATOM 87 CA VAL A 7 -5.787 -0.965 5.102 1.00 0.00 C ATOM 88 C VAL A 7 -4.953 0.208 5.537 1.00 0.00 C ATOM 89 O VAL A 7 -5.022 0.605 6.697 1.00 0.00 O ATOM 90 CB VAL A 7 -7.269 -0.526 5.027 1.00 0.00 C ATOM 91 CG1 VAL A 7 -7.544 0.494 3.928 1.00 0.00 C ATOM 92 CG2 VAL A 7 -8.207 -1.719 4.985 1.00 0.00 C ATOM 0 H VAL A 7 -5.900 -1.783 7.008 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.498 -1.327 4.115 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.480 0.005 5.955 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -8.602 0.757 3.932 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.947 1.389 4.104 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.280 0.066 2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -9.238 -1.369 4.933 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.985 -2.326 4.107 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.073 -2.319 5.885 1.00 0.00 H new ATOM 102 N LEU A 8 -4.194 0.764 4.646 1.00 0.00 N ATOM 103 CA LEU A 8 -3.300 1.821 5.011 1.00 0.00 C ATOM 104 C LEU A 8 -2.937 2.686 3.815 1.00 0.00 C ATOM 105 O LEU A 8 -3.269 2.349 2.671 1.00 0.00 O ATOM 106 CB LEU A 8 -2.057 1.259 5.720 1.00 0.00 C ATOM 107 CG LEU A 8 -1.102 0.356 4.938 1.00 0.00 C ATOM 108 CD1 LEU A 8 0.005 -0.038 5.845 1.00 0.00 C ATOM 109 CD2 LEU A 8 -1.746 -0.904 4.357 1.00 0.00 C ATOM 0 H LEU A 8 -4.174 0.505 3.660 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.815 2.472 5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.479 2.105 6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.399 0.700 6.591 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.756 0.932 4.080 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.701 -0.684 5.310 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.529 0.854 6.189 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.401 -0.574 6.703 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.994 -1.482 3.820 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.159 -1.507 5.165 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.545 -0.621 3.671 1.00 0.00 H new ATOM 121 N LYS A 9 -2.260 3.779 4.083 1.00 0.00 N ATOM 122 CA LYS A 9 -1.933 4.770 3.073 1.00 0.00 C ATOM 123 C LYS A 9 -0.437 4.842 2.834 1.00 0.00 C ATOM 124 O LYS A 9 0.354 4.771 3.784 1.00 0.00 O ATOM 125 CB LYS A 9 -2.426 6.120 3.538 1.00 0.00 C ATOM 126 CG LYS A 9 -2.112 7.270 2.588 1.00 0.00 C ATOM 127 CD LYS A 9 -2.533 8.602 3.163 1.00 0.00 C ATOM 128 CE LYS A 9 -4.042 8.669 3.357 1.00 0.00 C ATOM 129 NZ LYS A 9 -4.497 9.965 3.876 1.00 0.00 N ATOM 0 H LYS A 9 -1.916 4.011 5.015 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.414 4.484 2.138 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -3.505 6.069 3.682 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -1.985 6.338 4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.043 7.286 2.378 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.621 7.107 1.638 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.034 8.762 4.119 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.214 9.405 2.498 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.534 8.472 2.405 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.350 7.881 4.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.531 9.951 3.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.052 10.145 4.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -4.231 10.718 3.210 1.00 0.00 H new ATOM 143 N GLY A 10 -0.051 4.996 1.576 1.00 0.00 N ATOM 144 CA GLY A 10 1.328 5.081 1.241 1.00 0.00 C ATOM 145 C GLY A 10 1.600 4.700 -0.189 1.00 0.00 C ATOM 146 O GLY A 10 0.780 4.941 -1.085 1.00 0.00 O ATOM 0 H GLY A 10 -0.688 5.063 0.783 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.678 6.098 1.415 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.900 4.429 1.902 1.00 0.00 H new ATOM 150 N VAL A 11 2.738 4.124 -0.394 1.00 0.00 N ATOM 151 CA VAL A 11 3.194 3.682 -1.669 1.00 0.00 C ATOM 152 C VAL A 11 3.275 2.173 -1.672 1.00 0.00 C ATOM 153 O VAL A 11 3.800 1.546 -0.738 1.00 0.00 O ATOM 154 CB VAL A 11 4.594 4.281 -2.040 1.00 0.00 C ATOM 155 CG1 VAL A 11 5.045 3.846 -3.427 1.00 0.00 C ATOM 156 CG2 VAL A 11 4.580 5.790 -1.957 1.00 0.00 C ATOM 0 H VAL A 11 3.404 3.941 0.356 1.00 0.00 H new ATOM 0 HA VAL A 11 2.481 4.030 -2.416 1.00 0.00 H new ATOM 0 HB VAL A 11 5.306 3.893 -1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.020 4.282 -3.646 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.118 2.759 -3.462 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.321 4.185 -4.168 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.564 6.178 -2.220 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.837 6.186 -2.650 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.328 6.096 -0.942 1.00 0.00 H new ATOM 166 N LEU A 12 2.742 1.620 -2.697 1.00 0.00 N ATOM 167 CA LEU A 12 2.737 0.220 -2.936 1.00 0.00 C ATOM 168 C LEU A 12 3.858 -0.080 -3.896 1.00 0.00 C ATOM 169 O LEU A 12 3.844 0.393 -5.014 1.00 0.00 O ATOM 170 CB LEU A 12 1.401 -0.166 -3.581 1.00 0.00 C ATOM 171 CG LEU A 12 1.316 -1.554 -4.217 1.00 0.00 C ATOM 172 CD1 LEU A 12 1.459 -2.641 -3.188 1.00 0.00 C ATOM 173 CD2 LEU A 12 0.027 -1.704 -4.981 1.00 0.00 C ATOM 0 H LEU A 12 2.274 2.154 -3.429 1.00 0.00 H new ATOM 0 HA LEU A 12 2.866 -0.337 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.623 -0.093 -2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.168 0.573 -4.347 1.00 0.00 H new ATOM 0 HG LEU A 12 2.147 -1.654 -4.915 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.394 -3.614 -3.675 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.425 -2.548 -2.692 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.662 -2.551 -2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.018 -2.697 -5.428 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.816 -1.573 -4.302 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.020 -0.950 -5.767 1.00 0.00 H new ATOM 185 N ILE A 13 4.820 -0.814 -3.464 1.00 0.00 N ATOM 186 CA ILE A 13 5.922 -1.164 -4.312 1.00 0.00 C ATOM 187 C ILE A 13 5.767 -2.573 -4.801 1.00 0.00 C ATOM 188 O ILE A 13 5.427 -3.463 -4.018 1.00 0.00 O ATOM 189 CB ILE A 13 7.271 -1.191 -3.545 1.00 0.00 C ATOM 190 CG1 ILE A 13 7.575 0.072 -2.769 1.00 0.00 C ATOM 191 CG2 ILE A 13 8.440 -1.521 -4.470 1.00 0.00 C ATOM 192 CD1 ILE A 13 7.712 1.338 -3.570 1.00 0.00 C ATOM 0 H ILE A 13 4.874 -1.192 -2.518 1.00 0.00 H new ATOM 0 HA ILE A 13 5.925 -0.418 -5.107 1.00 0.00 H new ATOM 0 HB ILE A 13 7.149 -1.987 -2.810 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.784 0.218 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.501 -0.083 -2.215 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.367 -1.530 -3.896 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.282 -2.501 -4.920 1.00 0.00 H new ATOM 0 HG23 ILE A 13 8.507 -0.767 -5.255 1.00 0.00 H new ATOM 0 HD11 ILE A 13 7.929 2.170 -2.901 1.00 0.00 H new ATOM 0 HD12 ILE A 13 8.525 1.228 -4.288 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.781 1.534 -4.103 1.00 0.00 H new ATOM 204 N GLU A 14 5.929 -2.770 -6.065 1.00 0.00 N ATOM 205 CA GLU A 14 6.270 -4.037 -6.546 1.00 0.00 C ATOM 206 C GLU A 14 7.241 -3.842 -7.631 1.00 0.00 C ATOM 207 O GLU A 14 6.952 -3.193 -8.632 1.00 0.00 O ATOM 208 CB GLU A 14 5.097 -4.826 -7.055 1.00 0.00 C ATOM 209 CG GLU A 14 5.485 -6.141 -7.729 1.00 0.00 C ATOM 210 CD GLU A 14 4.297 -6.885 -8.234 1.00 0.00 C ATOM 211 OE1 GLU A 14 3.564 -6.343 -9.055 1.00 0.00 O ATOM 212 OE2 GLU A 14 4.042 -8.004 -7.755 1.00 0.00 O ATOM 0 H GLU A 14 5.826 -2.051 -6.781 1.00 0.00 H new ATOM 0 HA GLU A 14 6.680 -4.617 -5.719 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.426 -5.039 -6.223 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.540 -4.215 -7.765 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.163 -5.937 -8.558 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.028 -6.765 -7.019 1.00 0.00 H new ATOM 219 N CYS A 15 8.357 -4.365 -7.408 1.00 0.00 N ATOM 220 CA CYS A 15 9.394 -4.465 -8.361 1.00 0.00 C ATOM 221 C CYS A 15 9.776 -5.900 -8.361 1.00 0.00 C ATOM 222 O CYS A 15 9.031 -6.724 -7.826 1.00 0.00 O ATOM 223 CB CYS A 15 10.565 -3.606 -7.929 1.00 0.00 C ATOM 224 SG CYS A 15 10.191 -1.837 -7.895 1.00 0.00 S ATOM 0 H CYS A 15 8.604 -4.766 -6.503 1.00 0.00 H new ATOM 0 HA CYS A 15 9.089 -4.126 -9.351 1.00 0.00 H new ATOM 0 HB2 CYS A 15 10.888 -3.920 -6.936 1.00 0.00 H new ATOM 0 HB3 CYS A 15 11.401 -3.779 -8.606 1.00 0.00 H new ATOM 0 HG CYS A 15 10.711 -1.304 -6.830 1.00 0.00 H new ATOM 230 N ASP A 16 10.886 -6.234 -8.929 1.00 0.00 N ATOM 231 CA ASP A 16 11.324 -7.593 -8.828 1.00 0.00 C ATOM 232 C ASP A 16 11.824 -7.793 -7.381 1.00 0.00 C ATOM 233 O ASP A 16 12.245 -6.809 -6.729 1.00 0.00 O ATOM 234 CB ASP A 16 12.405 -7.940 -9.871 1.00 0.00 C ATOM 235 CG ASP A 16 13.804 -7.569 -9.473 1.00 0.00 C ATOM 236 OD1 ASP A 16 14.144 -6.367 -9.446 1.00 0.00 O ATOM 237 OD2 ASP A 16 14.604 -8.498 -9.191 1.00 0.00 O ATOM 0 H ASP A 16 11.495 -5.608 -9.455 1.00 0.00 H new ATOM 0 HA ASP A 16 10.501 -8.274 -9.046 1.00 0.00 H new ATOM 0 HB2 ASP A 16 12.370 -9.012 -10.068 1.00 0.00 H new ATOM 0 HB3 ASP A 16 12.162 -7.436 -10.807 1.00 0.00 H new ATOM 242 N PRO A 17 11.765 -9.031 -6.845 1.00 0.00 N ATOM 243 CA PRO A 17 12.079 -9.346 -5.418 1.00 0.00 C ATOM 244 C PRO A 17 13.432 -8.824 -4.909 1.00 0.00 C ATOM 245 O PRO A 17 13.649 -8.723 -3.691 1.00 0.00 O ATOM 246 CB PRO A 17 12.026 -10.866 -5.401 1.00 0.00 C ATOM 247 CG PRO A 17 11.006 -11.162 -6.430 1.00 0.00 C ATOM 248 CD PRO A 17 11.351 -10.258 -7.561 1.00 0.00 C ATOM 0 HA PRO A 17 11.379 -8.852 -4.744 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.991 -11.309 -5.647 1.00 0.00 H new ATOM 0 HB3 PRO A 17 11.739 -11.251 -4.423 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.039 -12.209 -6.733 1.00 0.00 H new ATOM 0 HG3 PRO A 17 9.999 -10.969 -6.059 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.153 -10.662 -8.179 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.500 -10.081 -8.219 1.00 0.00 H new ATOM 256 N ALA A 18 14.301 -8.462 -5.834 1.00 0.00 N ATOM 257 CA ALA A 18 15.603 -7.888 -5.547 1.00 0.00 C ATOM 258 C ALA A 18 15.473 -6.637 -4.704 1.00 0.00 C ATOM 259 O ALA A 18 16.175 -6.482 -3.701 1.00 0.00 O ATOM 260 CB ALA A 18 16.247 -7.520 -6.832 1.00 0.00 C ATOM 0 H ALA A 18 14.116 -8.562 -6.832 1.00 0.00 H new ATOM 0 HA ALA A 18 16.196 -8.621 -5.000 1.00 0.00 H new ATOM 0 HB1 ALA A 18 17.228 -7.086 -6.636 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.361 -8.411 -7.450 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.626 -6.792 -7.355 1.00 0.00 H new ATOM 266 N MET A 19 14.543 -5.755 -5.087 1.00 0.00 N ATOM 267 CA MET A 19 14.337 -4.518 -4.347 1.00 0.00 C ATOM 268 C MET A 19 13.900 -4.826 -2.950 1.00 0.00 C ATOM 269 O MET A 19 14.349 -4.202 -1.992 1.00 0.00 O ATOM 270 CB MET A 19 13.306 -3.596 -5.008 1.00 0.00 C ATOM 271 CG MET A 19 13.036 -2.335 -4.178 1.00 0.00 C ATOM 272 SD MET A 19 11.851 -1.204 -4.906 1.00 0.00 S ATOM 273 CE MET A 19 11.889 0.130 -3.709 1.00 0.00 C ATOM 0 H MET A 19 13.932 -5.877 -5.894 1.00 0.00 H new ATOM 0 HA MET A 19 15.291 -3.992 -4.341 1.00 0.00 H new ATOM 0 HB2 MET A 19 13.661 -3.308 -5.997 1.00 0.00 H new ATOM 0 HB3 MET A 19 12.373 -4.141 -5.151 1.00 0.00 H new ATOM 0 HG2 MET A 19 12.676 -2.634 -3.193 1.00 0.00 H new ATOM 0 HG3 MET A 19 13.977 -1.807 -4.027 1.00 0.00 H new ATOM 0 HE1 MET A 19 11.202 0.917 -4.019 1.00 0.00 H new ATOM 0 HE2 MET A 19 11.589 -0.249 -2.732 1.00 0.00 H new ATOM 0 HE3 MET A 19 12.899 0.534 -3.647 1.00 0.00 H new ATOM 283 N LYS A 20 13.077 -5.839 -2.837 1.00 0.00 N ATOM 284 CA LYS A 20 12.527 -6.239 -1.577 1.00 0.00 C ATOM 285 C LYS A 20 13.656 -6.735 -0.675 1.00 0.00 C ATOM 286 O LYS A 20 13.649 -6.488 0.515 1.00 0.00 O ATOM 287 CB LYS A 20 11.450 -7.317 -1.802 1.00 0.00 C ATOM 288 CG LYS A 20 10.234 -7.235 -0.869 1.00 0.00 C ATOM 289 CD LYS A 20 10.243 -8.215 0.313 1.00 0.00 C ATOM 290 CE LYS A 20 11.273 -7.959 1.335 1.00 0.00 C ATOM 291 NZ LYS A 20 10.962 -6.745 2.118 1.00 0.00 N ATOM 0 H LYS A 20 12.771 -6.409 -3.625 1.00 0.00 H new ATOM 0 HA LYS A 20 12.047 -5.394 -1.083 1.00 0.00 H new ATOM 0 HB2 LYS A 20 11.102 -7.249 -2.833 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.911 -8.298 -1.685 1.00 0.00 H new ATOM 0 HG2 LYS A 20 10.166 -6.220 -0.477 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.333 -7.410 -1.457 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.264 -8.189 0.793 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.382 -9.224 -0.074 1.00 0.00 H new ATOM 0 HE2 LYS A 20 11.346 -8.817 2.004 1.00 0.00 H new ATOM 0 HE3 LYS A 20 12.245 -7.846 0.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.159 -6.921 3.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 11.550 -5.956 1.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.958 -6.503 1.999 1.00 0.00 H new ATOM 305 N GLN A 21 14.637 -7.377 -1.258 1.00 0.00 N ATOM 306 CA GLN A 21 15.775 -7.876 -0.497 1.00 0.00 C ATOM 307 C GLN A 21 16.609 -6.754 0.124 1.00 0.00 C ATOM 308 O GLN A 21 16.953 -6.823 1.308 1.00 0.00 O ATOM 309 CB GLN A 21 16.653 -8.798 -1.313 1.00 0.00 C ATOM 310 CG GLN A 21 15.949 -10.032 -1.831 1.00 0.00 C ATOM 311 CD GLN A 21 15.199 -10.785 -0.775 1.00 0.00 C ATOM 312 OE1 GLN A 21 15.761 -11.617 -0.066 1.00 0.00 O ATOM 313 NE2 GLN A 21 13.913 -10.573 -0.725 1.00 0.00 N ATOM 0 H GLN A 21 14.679 -7.571 -2.259 1.00 0.00 H new ATOM 0 HA GLN A 21 15.346 -8.456 0.320 1.00 0.00 H new ATOM 0 HB2 GLN A 21 17.056 -8.242 -2.159 1.00 0.00 H new ATOM 0 HB3 GLN A 21 17.501 -9.107 -0.702 1.00 0.00 H new ATOM 0 HG2 GLN A 21 15.255 -9.740 -2.619 1.00 0.00 H new ATOM 0 HG3 GLN A 21 16.685 -10.696 -2.285 1.00 0.00 H new ATOM 0 HE21 GLN A 21 13.488 -9.872 -1.332 1.00 0.00 H new ATOM 0 HE22 GLN A 21 13.333 -11.108 -0.079 1.00 0.00 H new ATOM 322 N PHE A 22 16.925 -5.713 -0.632 1.00 0.00 N ATOM 323 CA PHE A 22 17.632 -4.593 -0.025 1.00 0.00 C ATOM 324 C PHE A 22 16.743 -3.857 0.971 1.00 0.00 C ATOM 325 O PHE A 22 17.196 -3.388 2.003 1.00 0.00 O ATOM 326 CB PHE A 22 18.421 -3.670 -0.997 1.00 0.00 C ATOM 327 CG PHE A 22 17.670 -2.912 -2.060 1.00 0.00 C ATOM 328 CD1 PHE A 22 16.958 -1.762 -1.747 1.00 0.00 C ATOM 329 CD2 PHE A 22 17.731 -3.316 -3.384 1.00 0.00 C ATOM 330 CE1 PHE A 22 16.315 -1.040 -2.730 1.00 0.00 C ATOM 331 CE2 PHE A 22 17.099 -2.590 -4.374 1.00 0.00 C ATOM 332 CZ PHE A 22 16.388 -1.453 -4.046 1.00 0.00 C ATOM 0 H PHE A 22 16.715 -5.618 -1.626 1.00 0.00 H new ATOM 0 HA PHE A 22 18.449 -5.041 0.540 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.960 -2.941 -0.392 1.00 0.00 H new ATOM 0 HB3 PHE A 22 19.169 -4.284 -1.498 1.00 0.00 H new ATOM 0 HD1 PHE A 22 16.907 -1.429 -0.721 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.279 -4.209 -3.645 1.00 0.00 H new ATOM 0 HE1 PHE A 22 15.755 -0.153 -2.471 1.00 0.00 H new ATOM 0 HE2 PHE A 22 17.161 -2.911 -5.403 1.00 0.00 H new ATOM 0 HZ PHE A 22 15.889 -0.887 -4.818 1.00 0.00 H new ATOM 342 N LEU A 23 15.466 -3.821 0.657 1.00 0.00 N ATOM 343 CA LEU A 23 14.442 -3.230 1.468 1.00 0.00 C ATOM 344 C LEU A 23 14.391 -3.917 2.847 1.00 0.00 C ATOM 345 O LEU A 23 14.377 -3.241 3.867 1.00 0.00 O ATOM 346 CB LEU A 23 13.130 -3.410 0.677 1.00 0.00 C ATOM 347 CG LEU A 23 11.871 -2.682 1.102 1.00 0.00 C ATOM 348 CD1 LEU A 23 11.367 -3.148 2.426 1.00 0.00 C ATOM 349 CD2 LEU A 23 12.053 -1.172 1.051 1.00 0.00 C ATOM 0 H LEU A 23 15.105 -4.222 -0.209 1.00 0.00 H new ATOM 0 HA LEU A 23 14.626 -2.174 1.667 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.334 -3.124 -0.355 1.00 0.00 H new ATOM 0 HB3 LEU A 23 12.900 -4.475 0.673 1.00 0.00 H new ATOM 0 HG LEU A 23 11.097 -2.934 0.377 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.464 -2.596 2.686 1.00 0.00 H new ATOM 0 HD12 LEU A 23 11.140 -4.213 2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.129 -2.976 3.186 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.130 -0.684 1.362 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.862 -0.880 1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 23 12.298 -0.869 0.033 1.00 0.00 H new ATOM 361 N LEU A 24 14.394 -5.241 2.875 1.00 0.00 N ATOM 362 CA LEU A 24 14.351 -5.965 4.139 1.00 0.00 C ATOM 363 C LEU A 24 15.642 -5.755 4.944 1.00 0.00 C ATOM 364 O LEU A 24 15.623 -5.710 6.178 1.00 0.00 O ATOM 365 CB LEU A 24 14.016 -7.454 3.930 1.00 0.00 C ATOM 366 CG LEU A 24 14.914 -8.268 3.007 1.00 0.00 C ATOM 367 CD1 LEU A 24 16.146 -8.781 3.683 1.00 0.00 C ATOM 368 CD2 LEU A 24 14.152 -9.374 2.384 1.00 0.00 C ATOM 0 H LEU A 24 14.425 -5.833 2.045 1.00 0.00 H new ATOM 0 HA LEU A 24 13.538 -5.550 4.735 1.00 0.00 H new ATOM 0 HB2 LEU A 24 14.017 -7.937 4.907 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.998 -7.516 3.545 1.00 0.00 H new ATOM 0 HG LEU A 24 15.257 -7.588 2.227 1.00 0.00 H new ATOM 0 HD11 LEU A 24 16.741 -9.352 2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 24 16.733 -7.941 4.056 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.863 -9.424 4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.809 -9.945 1.728 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.759 -10.028 3.162 1.00 0.00 H new ATOM 0 HD23 LEU A 24 13.326 -8.964 1.803 1.00 0.00 H new ATOM 380 N TYR A 25 16.753 -5.598 4.220 1.00 0.00 N ATOM 381 CA TYR A 25 18.053 -5.334 4.819 1.00 0.00 C ATOM 382 C TYR A 25 18.061 -3.946 5.447 1.00 0.00 C ATOM 383 O TYR A 25 18.603 -3.733 6.541 1.00 0.00 O ATOM 384 CB TYR A 25 19.166 -5.474 3.769 1.00 0.00 C ATOM 385 CG TYR A 25 20.525 -5.009 4.244 1.00 0.00 C ATOM 386 CD1 TYR A 25 21.214 -5.688 5.239 1.00 0.00 C ATOM 387 CD2 TYR A 25 21.106 -3.868 3.705 1.00 0.00 C ATOM 388 CE1 TYR A 25 22.442 -5.243 5.677 1.00 0.00 C ATOM 389 CE2 TYR A 25 22.329 -3.419 4.139 1.00 0.00 C ATOM 390 CZ TYR A 25 22.993 -4.106 5.124 1.00 0.00 C ATOM 391 OH TYR A 25 24.218 -3.658 5.552 1.00 0.00 O ATOM 0 H TYR A 25 16.771 -5.651 3.202 1.00 0.00 H new ATOM 0 HA TYR A 25 18.241 -6.067 5.603 1.00 0.00 H new ATOM 0 HB2 TYR A 25 19.237 -6.519 3.467 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.888 -4.904 2.882 1.00 0.00 H new ATOM 0 HD1 TYR A 25 20.782 -6.576 5.675 1.00 0.00 H new ATOM 0 HD2 TYR A 25 20.586 -3.324 2.930 1.00 0.00 H new ATOM 0 HE1 TYR A 25 22.971 -5.782 6.450 1.00 0.00 H new ATOM 0 HE2 TYR A 25 22.766 -2.530 3.708 1.00 0.00 H new ATOM 0 HH TYR A 25 24.460 -2.847 5.059 1.00 0.00 H new ATOM 401 N LEU A 26 17.472 -3.012 4.755 1.00 0.00 N ATOM 402 CA LEU A 26 17.307 -1.683 5.270 1.00 0.00 C ATOM 403 C LEU A 26 16.353 -1.662 6.431 1.00 0.00 C ATOM 404 O LEU A 26 16.500 -0.863 7.314 1.00 0.00 O ATOM 405 CB LEU A 26 16.930 -0.663 4.185 1.00 0.00 C ATOM 406 CG LEU A 26 18.092 0.115 3.557 1.00 0.00 C ATOM 407 CD1 LEU A 26 18.761 0.982 4.616 1.00 0.00 C ATOM 408 CD2 LEU A 26 19.104 -0.825 2.923 1.00 0.00 C ATOM 0 H LEU A 26 17.093 -3.151 3.818 1.00 0.00 H new ATOM 0 HA LEU A 26 18.281 -1.367 5.643 1.00 0.00 H new ATOM 0 HB2 LEU A 26 16.400 -1.188 3.390 1.00 0.00 H new ATOM 0 HB3 LEU A 26 16.231 0.054 4.616 1.00 0.00 H new ATOM 0 HG LEU A 26 17.694 0.754 2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 26 19.587 1.534 4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 26 18.034 1.685 5.023 1.00 0.00 H new ATOM 0 HD13 LEU A 26 19.142 0.349 5.417 1.00 0.00 H new ATOM 0 HD21 LEU A 26 19.916 -0.244 2.486 1.00 0.00 H new ATOM 0 HD22 LEU A 26 19.505 -1.494 3.684 1.00 0.00 H new ATOM 0 HD23 LEU A 26 18.617 -1.412 2.144 1.00 0.00 H new ATOM 420 N ASP A 27 15.369 -2.527 6.410 1.00 0.00 N ATOM 421 CA ASP A 27 14.421 -2.646 7.520 1.00 0.00 C ATOM 422 C ASP A 27 15.119 -3.070 8.809 1.00 0.00 C ATOM 423 O ASP A 27 14.894 -2.475 9.882 1.00 0.00 O ATOM 424 CB ASP A 27 13.304 -3.632 7.177 1.00 0.00 C ATOM 425 CG ASP A 27 12.399 -3.924 8.355 1.00 0.00 C ATOM 426 OD1 ASP A 27 11.737 -3.004 8.863 1.00 0.00 O ATOM 427 OD2 ASP A 27 12.361 -5.081 8.812 1.00 0.00 O ATOM 0 H ASP A 27 15.193 -3.168 5.637 1.00 0.00 H new ATOM 0 HA ASP A 27 13.983 -1.661 7.681 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.708 -3.229 6.358 1.00 0.00 H new ATOM 0 HB3 ASP A 27 13.744 -4.564 6.823 1.00 0.00 H new ATOM 432 N GLU A 28 15.981 -4.069 8.703 1.00 0.00 N ATOM 433 CA GLU A 28 16.705 -4.573 9.858 1.00 0.00 C ATOM 434 C GLU A 28 17.812 -3.611 10.312 1.00 0.00 C ATOM 435 O GLU A 28 17.955 -3.353 11.499 1.00 0.00 O ATOM 436 CB GLU A 28 17.259 -5.990 9.611 1.00 0.00 C ATOM 437 CG GLU A 28 18.139 -6.122 8.386 1.00 0.00 C ATOM 438 CD GLU A 28 18.717 -7.496 8.219 1.00 0.00 C ATOM 439 OE1 GLU A 28 18.067 -8.371 7.622 1.00 0.00 O ATOM 440 OE2 GLU A 28 19.842 -7.738 8.690 1.00 0.00 O ATOM 0 H GLU A 28 16.196 -4.547 7.828 1.00 0.00 H new ATOM 0 HA GLU A 28 15.985 -4.640 10.673 1.00 0.00 H new ATOM 0 HB2 GLU A 28 17.830 -6.300 10.486 1.00 0.00 H new ATOM 0 HB3 GLU A 28 16.421 -6.681 9.516 1.00 0.00 H new ATOM 0 HG2 GLU A 28 17.557 -5.869 7.500 1.00 0.00 H new ATOM 0 HG3 GLU A 28 18.952 -5.398 8.451 1.00 0.00 H new ATOM 447 N SER A 29 18.552 -3.061 9.374 1.00 0.00 N ATOM 448 CA SER A 29 19.648 -2.161 9.704 1.00 0.00 C ATOM 449 C SER A 29 19.104 -0.776 10.112 1.00 0.00 C ATOM 450 O SER A 29 19.539 -0.176 11.102 1.00 0.00 O ATOM 451 CB SER A 29 20.581 -2.068 8.499 1.00 0.00 C ATOM 452 OG SER A 29 20.962 -3.382 8.076 1.00 0.00 O ATOM 0 H SER A 29 18.419 -3.218 8.375 1.00 0.00 H new ATOM 0 HA SER A 29 20.208 -2.547 10.556 1.00 0.00 H new ATOM 0 HB2 SER A 29 20.084 -1.543 7.683 1.00 0.00 H new ATOM 0 HB3 SER A 29 21.467 -1.488 8.758 1.00 0.00 H new ATOM 0 HG SER A 29 20.259 -3.759 7.507 1.00 0.00 H new ATOM 458 N ASN A 30 18.126 -0.336 9.355 1.00 0.00 N ATOM 459 CA ASN A 30 17.385 0.918 9.511 1.00 0.00 C ATOM 460 C ASN A 30 18.280 2.151 9.621 1.00 0.00 C ATOM 461 O ASN A 30 18.615 2.606 10.720 1.00 0.00 O ATOM 462 CB ASN A 30 16.386 0.863 10.659 1.00 0.00 C ATOM 463 CG ASN A 30 15.216 1.788 10.414 1.00 0.00 C ATOM 464 OD1 ASN A 30 15.322 2.782 9.687 1.00 0.00 O ATOM 465 ND2 ASN A 30 14.111 1.509 11.042 1.00 0.00 N ATOM 0 H ASN A 30 17.795 -0.875 8.554 1.00 0.00 H new ATOM 0 HA ASN A 30 16.823 1.028 8.583 1.00 0.00 H new ATOM 0 HB2 ASN A 30 16.025 -0.158 10.781 1.00 0.00 H new ATOM 0 HB3 ASN A 30 16.882 1.139 11.589 1.00 0.00 H new ATOM 0 HD21 ASN A 30 13.299 2.119 10.942 1.00 0.00 H new ATOM 0 HD22 ASN A 30 14.056 0.681 11.635 1.00 0.00 H new ATOM 472 N ALA A 31 18.664 2.679 8.479 1.00 0.00 N ATOM 473 CA ALA A 31 19.536 3.848 8.415 1.00 0.00 C ATOM 474 C ALA A 31 18.845 5.123 8.906 1.00 0.00 C ATOM 475 O ALA A 31 19.475 5.979 9.520 1.00 0.00 O ATOM 476 CB ALA A 31 20.061 4.040 6.997 1.00 0.00 C ATOM 0 H ALA A 31 18.385 2.317 7.567 1.00 0.00 H new ATOM 0 HA ALA A 31 20.373 3.660 9.087 1.00 0.00 H new ATOM 0 HB1 ALA A 31 20.710 4.915 6.965 1.00 0.00 H new ATOM 0 HB2 ALA A 31 20.626 3.158 6.696 1.00 0.00 H new ATOM 0 HB3 ALA A 31 19.223 4.184 6.315 1.00 0.00 H new ATOM 482 N LEU A 32 17.550 5.232 8.658 1.00 0.00 N ATOM 483 CA LEU A 32 16.813 6.455 8.994 1.00 0.00 C ATOM 484 C LEU A 32 16.174 6.382 10.371 1.00 0.00 C ATOM 485 O LEU A 32 15.766 7.400 10.937 1.00 0.00 O ATOM 486 CB LEU A 32 15.699 6.750 7.973 1.00 0.00 C ATOM 487 CG LEU A 32 16.078 7.039 6.514 1.00 0.00 C ATOM 488 CD1 LEU A 32 17.169 8.081 6.393 1.00 0.00 C ATOM 489 CD2 LEU A 32 16.388 5.783 5.723 1.00 0.00 C ATOM 0 H LEU A 32 16.985 4.499 8.229 1.00 0.00 H new ATOM 0 HA LEU A 32 17.555 7.253 8.978 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.020 5.897 7.973 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.135 7.607 8.341 1.00 0.00 H new ATOM 0 HG LEU A 32 15.188 7.470 6.056 1.00 0.00 H new ATOM 0 HD11 LEU A 32 17.398 8.247 5.340 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.832 9.015 6.843 1.00 0.00 H new ATOM 0 HD13 LEU A 32 18.064 7.732 6.909 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.649 6.053 4.700 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.225 5.259 6.185 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.513 5.133 5.715 1.00 0.00 H new ATOM 501 N GLY A 33 16.052 5.189 10.881 1.00 0.00 N ATOM 502 CA GLY A 33 15.368 4.990 12.137 1.00 0.00 C ATOM 503 C GLY A 33 13.882 5.177 11.939 1.00 0.00 C ATOM 504 O GLY A 33 13.187 5.742 12.786 1.00 0.00 O ATOM 0 H GLY A 33 16.415 4.338 10.451 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.571 3.990 12.519 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.738 5.696 12.880 1.00 0.00 H new ATOM 508 N LYS A 34 13.409 4.738 10.787 1.00 0.00 N ATOM 509 CA LYS A 34 12.026 4.870 10.395 1.00 0.00 C ATOM 510 C LYS A 34 11.566 3.546 9.857 1.00 0.00 C ATOM 511 O LYS A 34 12.336 2.840 9.211 1.00 0.00 O ATOM 512 CB LYS A 34 11.865 5.879 9.250 1.00 0.00 C ATOM 513 CG LYS A 34 12.391 7.283 9.497 1.00 0.00 C ATOM 514 CD LYS A 34 12.301 8.111 8.220 1.00 0.00 C ATOM 515 CE LYS A 34 12.975 9.477 8.349 1.00 0.00 C ATOM 516 NZ LYS A 34 12.302 10.365 9.306 1.00 0.00 N ATOM 0 H LYS A 34 13.989 4.272 10.089 1.00 0.00 H new ATOM 0 HA LYS A 34 11.456 5.199 11.264 1.00 0.00 H new ATOM 0 HB2 LYS A 34 12.367 5.478 8.370 1.00 0.00 H new ATOM 0 HB3 LYS A 34 10.805 5.951 9.007 1.00 0.00 H new ATOM 0 HG2 LYS A 34 11.816 7.761 10.290 1.00 0.00 H new ATOM 0 HG3 LYS A 34 13.426 7.237 9.837 1.00 0.00 H new ATOM 0 HD2 LYS A 34 12.763 7.559 7.402 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.253 8.252 7.957 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.010 9.336 8.659 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.998 9.958 7.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 12.805 11.274 9.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.321 10.526 9.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 12.302 9.924 10.248 1.00 0.00 H new ATOM 530 N LYS A 35 10.361 3.195 10.116 1.00 0.00 N ATOM 531 CA LYS A 35 9.812 2.016 9.539 1.00 0.00 C ATOM 532 C LYS A 35 9.070 2.356 8.297 1.00 0.00 C ATOM 533 O LYS A 35 7.907 2.761 8.318 1.00 0.00 O ATOM 534 CB LYS A 35 8.986 1.184 10.513 1.00 0.00 C ATOM 535 CG LYS A 35 9.818 0.464 11.568 1.00 0.00 C ATOM 536 CD LYS A 35 10.834 -0.471 10.923 1.00 0.00 C ATOM 537 CE LYS A 35 11.513 -1.362 11.944 1.00 0.00 C ATOM 538 NZ LYS A 35 12.474 -2.293 11.308 1.00 0.00 N ATOM 0 H LYS A 35 9.728 3.709 10.729 1.00 0.00 H new ATOM 0 HA LYS A 35 10.645 1.366 9.273 1.00 0.00 H new ATOM 0 HB2 LYS A 35 8.267 1.834 11.012 1.00 0.00 H new ATOM 0 HB3 LYS A 35 8.413 0.447 9.951 1.00 0.00 H new ATOM 0 HG2 LYS A 35 10.335 1.195 12.189 1.00 0.00 H new ATOM 0 HG3 LYS A 35 9.162 -0.106 12.226 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.335 -1.089 10.177 1.00 0.00 H new ATOM 0 HD3 LYS A 35 11.586 0.118 10.398 1.00 0.00 H new ATOM 0 HE2 LYS A 35 12.035 -0.745 12.676 1.00 0.00 H new ATOM 0 HE3 LYS A 35 10.760 -1.932 12.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 12.817 -2.975 12.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.002 -2.804 10.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 13.279 -1.755 10.927 1.00 0.00 H new ATOM 552 N PHE A 36 9.791 2.248 7.224 1.00 0.00 N ATOM 553 CA PHE A 36 9.289 2.504 5.915 1.00 0.00 C ATOM 554 C PHE A 36 8.428 1.363 5.471 1.00 0.00 C ATOM 555 O PHE A 36 7.304 1.565 5.049 1.00 0.00 O ATOM 556 CB PHE A 36 10.460 2.777 4.932 1.00 0.00 C ATOM 557 CG PHE A 36 11.634 1.832 5.064 1.00 0.00 C ATOM 558 CD1 PHE A 36 12.615 2.086 6.004 1.00 0.00 C ATOM 559 CD2 PHE A 36 11.751 0.695 4.269 1.00 0.00 C ATOM 560 CE1 PHE A 36 13.677 1.240 6.158 1.00 0.00 C ATOM 561 CE2 PHE A 36 12.820 -0.153 4.434 1.00 0.00 C ATOM 562 CZ PHE A 36 13.774 0.124 5.373 1.00 0.00 C ATOM 0 H PHE A 36 10.773 1.971 7.238 1.00 0.00 H new ATOM 0 HA PHE A 36 8.668 3.400 5.928 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.080 2.721 3.912 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.814 3.797 5.085 1.00 0.00 H new ATOM 0 HD1 PHE A 36 12.541 2.966 6.626 1.00 0.00 H new ATOM 0 HD2 PHE A 36 11.001 0.479 3.522 1.00 0.00 H new ATOM 0 HE1 PHE A 36 14.436 1.452 6.896 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.906 -1.038 3.822 1.00 0.00 H new ATOM 0 HZ PHE A 36 14.613 -0.545 5.496 1.00 0.00 H new ATOM 572 N ILE A 37 8.928 0.169 5.634 1.00 0.00 N ATOM 573 CA ILE A 37 8.196 -0.989 5.266 1.00 0.00 C ATOM 574 C ILE A 37 7.274 -1.347 6.403 1.00 0.00 C ATOM 575 O ILE A 37 7.698 -1.785 7.479 1.00 0.00 O ATOM 576 CB ILE A 37 9.149 -2.157 4.790 1.00 0.00 C ATOM 577 CG1 ILE A 37 8.446 -3.437 4.260 1.00 0.00 C ATOM 578 CG2 ILE A 37 10.227 -2.514 5.774 1.00 0.00 C ATOM 579 CD1 ILE A 37 7.700 -4.273 5.284 1.00 0.00 C ATOM 0 H ILE A 37 9.851 -0.018 6.025 1.00 0.00 H new ATOM 0 HA ILE A 37 7.574 -0.793 4.392 1.00 0.00 H new ATOM 0 HB ILE A 37 9.626 -1.702 3.922 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.742 -3.142 3.482 1.00 0.00 H new ATOM 0 HG13 ILE A 37 9.198 -4.068 3.787 1.00 0.00 H new ATOM 0 HG21 ILE A 37 10.835 -3.323 5.370 1.00 0.00 H new ATOM 0 HG22 ILE A 37 10.856 -1.643 5.956 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.772 -2.835 6.711 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.253 -5.137 4.792 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.395 -4.612 6.053 1.00 0.00 H new ATOM 0 HD13 ILE A 37 6.916 -3.671 5.743 1.00 0.00 H new ATOM 591 N ILE A 38 6.032 -1.064 6.181 1.00 0.00 N ATOM 592 CA ILE A 38 5.003 -1.325 7.129 1.00 0.00 C ATOM 593 C ILE A 38 4.592 -2.777 7.047 1.00 0.00 C ATOM 594 O ILE A 38 4.552 -3.489 8.056 1.00 0.00 O ATOM 595 CB ILE A 38 3.793 -0.411 6.876 1.00 0.00 C ATOM 596 CG1 ILE A 38 4.173 1.062 7.138 1.00 0.00 C ATOM 597 CG2 ILE A 38 2.599 -0.853 7.708 1.00 0.00 C ATOM 598 CD1 ILE A 38 3.074 2.059 6.833 1.00 0.00 C ATOM 0 H ILE A 38 5.699 -0.636 5.317 1.00 0.00 H new ATOM 0 HA ILE A 38 5.383 -1.118 8.130 1.00 0.00 H new ATOM 0 HB ILE A 38 3.498 -0.493 5.830 1.00 0.00 H new ATOM 0 HG12 ILE A 38 4.463 1.169 8.183 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.048 1.310 6.538 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.755 -0.192 7.513 1.00 0.00 H new ATOM 0 HG22 ILE A 38 2.329 -1.875 7.442 1.00 0.00 H new ATOM 0 HG23 ILE A 38 2.857 -0.809 8.766 1.00 0.00 H new ATOM 0 HD11 ILE A 38 3.428 3.068 7.046 1.00 0.00 H new ATOM 0 HD12 ILE A 38 2.798 1.986 5.781 1.00 0.00 H new ATOM 0 HD13 ILE A 38 2.204 1.842 7.452 1.00 0.00 H new ATOM 610 N GLN A 39 4.303 -3.229 5.855 1.00 0.00 N ATOM 611 CA GLN A 39 3.921 -4.587 5.685 1.00 0.00 C ATOM 612 C GLN A 39 4.409 -5.155 4.367 1.00 0.00 C ATOM 613 O GLN A 39 4.312 -4.498 3.319 1.00 0.00 O ATOM 614 CB GLN A 39 2.407 -4.815 5.908 1.00 0.00 C ATOM 615 CG GLN A 39 1.487 -4.025 4.995 1.00 0.00 C ATOM 616 CD GLN A 39 0.013 -4.388 5.165 1.00 0.00 C ATOM 617 OE1 GLN A 39 -0.697 -3.755 5.929 1.00 0.00 O ATOM 618 NE2 GLN A 39 -0.420 -5.466 4.521 1.00 0.00 N ATOM 0 H GLN A 39 4.327 -2.674 5.000 1.00 0.00 H new ATOM 0 HA GLN A 39 4.424 -5.150 6.471 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.194 -5.876 5.780 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.168 -4.565 6.941 1.00 0.00 H new ATOM 0 HG2 GLN A 39 1.617 -2.961 5.191 1.00 0.00 H new ATOM 0 HG3 GLN A 39 1.779 -4.196 3.959 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.205 -5.968 3.890 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.377 -5.791 4.657 1.00 0.00 H new ATOM 627 N ASP A 40 5.009 -6.331 4.442 1.00 0.00 N ATOM 628 CA ASP A 40 5.423 -7.063 3.260 1.00 0.00 C ATOM 629 C ASP A 40 4.213 -7.720 2.697 1.00 0.00 C ATOM 630 O ASP A 40 3.663 -8.666 3.270 1.00 0.00 O ATOM 631 CB ASP A 40 6.497 -8.124 3.546 1.00 0.00 C ATOM 632 CG ASP A 40 7.870 -7.548 3.828 1.00 0.00 C ATOM 633 OD1 ASP A 40 8.494 -6.974 2.920 1.00 0.00 O ATOM 634 OD2 ASP A 40 8.371 -7.700 4.957 1.00 0.00 O ATOM 0 H ASP A 40 5.222 -6.803 5.321 1.00 0.00 H new ATOM 0 HA ASP A 40 5.872 -6.358 2.561 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.183 -8.724 4.400 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.565 -8.798 2.692 1.00 0.00 H new ATOM 639 N ILE A 41 3.773 -7.208 1.628 1.00 0.00 N ATOM 640 CA ILE A 41 2.573 -7.646 0.999 1.00 0.00 C ATOM 641 C ILE A 41 2.880 -8.625 -0.148 1.00 0.00 C ATOM 642 O ILE A 41 3.396 -8.274 -1.167 1.00 0.00 O ATOM 643 CB ILE A 41 1.708 -6.426 0.519 1.00 0.00 C ATOM 644 CG1 ILE A 41 2.592 -5.200 0.308 1.00 0.00 C ATOM 645 CG2 ILE A 41 0.561 -6.082 1.487 1.00 0.00 C ATOM 646 CD1 ILE A 41 1.865 -3.975 -0.117 1.00 0.00 C ATOM 0 H ILE A 41 4.241 -6.446 1.137 1.00 0.00 H new ATOM 0 HA ILE A 41 1.979 -8.188 1.735 1.00 0.00 H new ATOM 0 HB ILE A 41 1.251 -6.723 -0.425 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.122 -4.987 1.236 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.346 -5.437 -0.443 1.00 0.00 H new ATOM 0 HG21 ILE A 41 0.001 -5.231 1.100 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.104 -6.941 1.583 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.973 -5.831 2.464 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.574 -3.156 -0.242 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.357 -4.163 -1.063 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.130 -3.706 0.642 1.00 0.00 H new ATOM 658 N ASP A 42 2.619 -9.854 0.109 1.00 0.00 N ATOM 659 CA ASP A 42 2.765 -10.989 -0.839 1.00 0.00 C ATOM 660 C ASP A 42 4.189 -11.158 -1.342 1.00 0.00 C ATOM 661 O ASP A 42 4.440 -11.331 -2.523 1.00 0.00 O ATOM 662 CB ASP A 42 1.802 -10.861 -1.983 1.00 0.00 C ATOM 663 CG ASP A 42 1.710 -12.111 -2.846 1.00 0.00 C ATOM 664 OD1 ASP A 42 1.329 -13.193 -2.324 1.00 0.00 O ATOM 665 OD2 ASP A 42 2.030 -12.048 -4.049 1.00 0.00 O ATOM 0 H ASP A 42 2.278 -10.152 1.023 1.00 0.00 H new ATOM 0 HA ASP A 42 2.523 -11.894 -0.281 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.813 -10.628 -1.590 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.103 -10.020 -2.608 1.00 0.00 H new ATOM 670 N ASP A 43 5.096 -11.002 -0.417 1.00 0.00 N ATOM 671 CA ASP A 43 6.579 -11.268 -0.514 1.00 0.00 C ATOM 672 C ASP A 43 7.326 -10.394 -1.515 1.00 0.00 C ATOM 673 O ASP A 43 8.529 -10.209 -1.404 1.00 0.00 O ATOM 674 CB ASP A 43 6.942 -12.773 -0.743 1.00 0.00 C ATOM 675 CG ASP A 43 6.691 -13.301 -2.153 1.00 0.00 C ATOM 676 OD1 ASP A 43 7.526 -13.057 -3.053 1.00 0.00 O ATOM 677 OD2 ASP A 43 5.658 -13.984 -2.380 1.00 0.00 O ATOM 0 H ASP A 43 4.840 -10.661 0.510 1.00 0.00 H new ATOM 0 HA ASP A 43 6.929 -10.983 0.478 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.996 -12.916 -0.502 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.370 -13.378 -0.040 1.00 0.00 H new ATOM 682 N THR A 44 6.645 -9.906 -2.482 1.00 0.00 N ATOM 683 CA THR A 44 7.249 -9.077 -3.475 1.00 0.00 C ATOM 684 C THR A 44 6.772 -7.636 -3.321 1.00 0.00 C ATOM 685 O THR A 44 7.462 -6.698 -3.728 1.00 0.00 O ATOM 686 CB THR A 44 6.931 -9.602 -4.892 1.00 0.00 C ATOM 687 OG1 THR A 44 7.178 -11.027 -4.929 1.00 0.00 O ATOM 688 CG2 THR A 44 7.826 -8.931 -5.945 1.00 0.00 C ATOM 0 H THR A 44 5.647 -10.066 -2.615 1.00 0.00 H new ATOM 0 HA THR A 44 8.330 -9.104 -3.336 1.00 0.00 H new ATOM 0 HB THR A 44 5.889 -9.376 -5.117 1.00 0.00 H new ATOM 0 HG1 THR A 44 7.380 -11.348 -4.025 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.580 -9.320 -6.933 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.662 -7.853 -5.928 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.872 -9.143 -5.722 1.00 0.00 H new ATOM 696 N HIS A 45 5.619 -7.431 -2.686 1.00 0.00 N ATOM 697 CA HIS A 45 5.150 -6.081 -2.555 1.00 0.00 C ATOM 698 C HIS A 45 5.592 -5.530 -1.244 1.00 0.00 C ATOM 699 O HIS A 45 5.620 -6.233 -0.238 1.00 0.00 O ATOM 700 CB HIS A 45 3.629 -5.930 -2.727 1.00 0.00 C ATOM 701 CG HIS A 45 3.090 -6.337 -4.035 1.00 0.00 C ATOM 702 ND1 HIS A 45 2.750 -5.443 -4.998 1.00 0.00 N ATOM 703 CD2 HIS A 45 2.805 -7.557 -4.535 1.00 0.00 C ATOM 704 CE1 HIS A 45 2.286 -6.087 -6.038 1.00 0.00 C ATOM 705 NE2 HIS A 45 2.305 -7.369 -5.784 1.00 0.00 N ATOM 0 H HIS A 45 5.027 -8.154 -2.277 1.00 0.00 H new ATOM 0 HA HIS A 45 5.591 -5.511 -3.373 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.135 -6.517 -1.953 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.364 -4.887 -2.554 1.00 0.00 H new ATOM 0 HD2 HIS A 45 2.947 -8.504 -4.036 1.00 0.00 H new ATOM 0 HE1 HIS A 45 1.943 -5.633 -6.956 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.996 -8.106 -6.418 1.00 0.00 H new ATOM 714 N VAL A 46 5.937 -4.302 -1.255 1.00 0.00 N ATOM 715 CA VAL A 46 6.370 -3.613 -0.083 1.00 0.00 C ATOM 716 C VAL A 46 5.535 -2.401 0.082 1.00 0.00 C ATOM 717 O VAL A 46 5.243 -1.710 -0.885 1.00 0.00 O ATOM 718 CB VAL A 46 7.889 -3.251 -0.161 1.00 0.00 C ATOM 719 CG1 VAL A 46 8.248 -2.056 0.727 1.00 0.00 C ATOM 720 CG2 VAL A 46 8.696 -4.451 0.274 1.00 0.00 C ATOM 0 H VAL A 46 5.930 -3.724 -2.095 1.00 0.00 H new ATOM 0 HA VAL A 46 6.251 -4.261 0.785 1.00 0.00 H new ATOM 0 HB VAL A 46 8.116 -2.975 -1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.313 -1.844 0.638 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.677 -1.183 0.411 1.00 0.00 H new ATOM 0 HG13 VAL A 46 8.010 -2.289 1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.758 -4.212 0.224 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.431 -4.716 1.298 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.482 -5.292 -0.386 1.00 0.00 H new ATOM 730 N PHE A 47 5.082 -2.186 1.263 1.00 0.00 N ATOM 731 CA PHE A 47 4.318 -1.045 1.520 1.00 0.00 C ATOM 732 C PHE A 47 5.141 -0.072 2.326 1.00 0.00 C ATOM 733 O PHE A 47 5.604 -0.408 3.428 1.00 0.00 O ATOM 734 CB PHE A 47 3.063 -1.396 2.278 1.00 0.00 C ATOM 735 CG PHE A 47 2.110 -0.285 2.234 1.00 0.00 C ATOM 736 CD1 PHE A 47 1.273 -0.142 1.153 1.00 0.00 C ATOM 737 CD2 PHE A 47 2.077 0.636 3.238 1.00 0.00 C ATOM 738 CE1 PHE A 47 0.411 0.911 1.074 1.00 0.00 C ATOM 739 CE2 PHE A 47 1.217 1.690 3.174 1.00 0.00 C ATOM 740 CZ PHE A 47 0.379 1.826 2.085 1.00 0.00 C ATOM 0 H PHE A 47 5.234 -2.797 2.066 1.00 0.00 H new ATOM 0 HA PHE A 47 4.028 -0.595 0.570 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.609 -2.289 1.848 1.00 0.00 H new ATOM 0 HB3 PHE A 47 3.310 -1.630 3.313 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.299 -0.872 0.357 1.00 0.00 H new ATOM 0 HD2 PHE A 47 2.735 0.530 4.088 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -0.240 1.020 0.219 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.191 2.417 3.972 1.00 0.00 H new ATOM 0 HZ PHE A 47 -0.305 2.660 2.034 1.00 0.00 H new ATOM 750 N VAL A 48 5.311 1.102 1.796 1.00 0.00 N ATOM 751 CA VAL A 48 6.045 2.156 2.445 1.00 0.00 C ATOM 752 C VAL A 48 5.259 3.439 2.375 1.00 0.00 C ATOM 753 O VAL A 48 4.801 3.810 1.330 1.00 0.00 O ATOM 754 CB VAL A 48 7.480 2.323 1.843 1.00 0.00 C ATOM 755 CG1 VAL A 48 7.455 2.374 0.321 1.00 0.00 C ATOM 756 CG2 VAL A 48 8.165 3.566 2.388 1.00 0.00 C ATOM 0 H VAL A 48 4.938 1.363 0.883 1.00 0.00 H new ATOM 0 HA VAL A 48 6.182 1.888 3.493 1.00 0.00 H new ATOM 0 HB VAL A 48 8.050 1.444 2.145 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.471 2.491 -0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.028 1.449 -0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.848 3.219 -0.005 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.160 3.654 1.951 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.577 4.447 2.132 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.250 3.489 3.472 1.00 0.00 H new ATOM 766 N ILE A 49 5.095 4.105 3.486 1.00 0.00 N ATOM 767 CA ILE A 49 4.288 5.333 3.501 1.00 0.00 C ATOM 768 C ILE A 49 5.019 6.465 2.764 1.00 0.00 C ATOM 769 O ILE A 49 6.227 6.682 2.957 1.00 0.00 O ATOM 770 CB ILE A 49 3.842 5.754 4.931 1.00 0.00 C ATOM 771 CG1 ILE A 49 2.913 6.986 4.880 1.00 0.00 C ATOM 772 CG2 ILE A 49 5.027 5.971 5.862 1.00 0.00 C ATOM 773 CD1 ILE A 49 2.460 7.505 6.232 1.00 0.00 C ATOM 0 H ILE A 49 5.494 3.839 4.386 1.00 0.00 H new ATOM 0 HA ILE A 49 3.364 5.118 2.964 1.00 0.00 H new ATOM 0 HB ILE A 49 3.270 4.927 5.352 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.429 7.789 4.354 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.031 6.733 4.291 1.00 0.00 H new ATOM 0 HG21 ILE A 49 4.666 6.263 6.848 1.00 0.00 H new ATOM 0 HG22 ILE A 49 5.599 5.047 5.944 1.00 0.00 H new ATOM 0 HG23 ILE A 49 5.665 6.758 5.461 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.812 8.370 6.091 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.912 6.723 6.757 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.330 7.795 6.821 1.00 0.00 H new ATOM 785 N ALA A 50 4.278 7.191 1.935 1.00 0.00 N ATOM 786 CA ALA A 50 4.855 8.165 1.021 1.00 0.00 C ATOM 787 C ALA A 50 5.503 9.343 1.718 1.00 0.00 C ATOM 788 O ALA A 50 6.363 10.010 1.151 1.00 0.00 O ATOM 789 CB ALA A 50 3.840 8.647 -0.001 1.00 0.00 C ATOM 0 H ALA A 50 3.262 7.120 1.879 1.00 0.00 H new ATOM 0 HA ALA A 50 5.652 7.633 0.501 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.309 9.373 -0.665 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.481 7.800 -0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.000 9.115 0.513 1.00 0.00 H new ATOM 795 N GLU A 51 5.101 9.594 2.930 1.00 0.00 N ATOM 796 CA GLU A 51 5.604 10.729 3.677 1.00 0.00 C ATOM 797 C GLU A 51 7.088 10.601 4.005 1.00 0.00 C ATOM 798 O GLU A 51 7.798 11.602 4.102 1.00 0.00 O ATOM 799 CB GLU A 51 4.763 10.959 4.921 1.00 0.00 C ATOM 800 CG GLU A 51 3.295 11.199 4.596 1.00 0.00 C ATOM 801 CD GLU A 51 3.111 12.319 3.596 1.00 0.00 C ATOM 802 OE1 GLU A 51 3.154 13.495 3.993 1.00 0.00 O ATOM 803 OE2 GLU A 51 2.945 12.041 2.386 1.00 0.00 O ATOM 0 H GLU A 51 4.419 9.026 3.433 1.00 0.00 H new ATOM 0 HA GLU A 51 5.515 11.609 3.040 1.00 0.00 H new ATOM 0 HB2 GLU A 51 4.849 10.094 5.579 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.156 11.816 5.468 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.857 10.283 4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.756 11.439 5.512 1.00 0.00 H new ATOM 810 N LEU A 52 7.562 9.382 4.149 1.00 0.00 N ATOM 811 CA LEU A 52 8.961 9.168 4.423 1.00 0.00 C ATOM 812 C LEU A 52 9.654 8.381 3.316 1.00 0.00 C ATOM 813 O LEU A 52 10.812 8.046 3.423 1.00 0.00 O ATOM 814 CB LEU A 52 9.185 8.578 5.840 1.00 0.00 C ATOM 815 CG LEU A 52 8.349 7.352 6.238 1.00 0.00 C ATOM 816 CD1 LEU A 52 8.751 6.098 5.481 1.00 0.00 C ATOM 817 CD2 LEU A 52 8.403 7.121 7.737 1.00 0.00 C ATOM 0 H LEU A 52 7.002 8.532 4.081 1.00 0.00 H new ATOM 0 HA LEU A 52 9.446 10.144 4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.238 8.311 5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.993 9.367 6.567 1.00 0.00 H new ATOM 0 HG LEU A 52 7.319 7.571 5.957 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.128 5.264 5.802 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.617 6.260 4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 52 9.797 5.869 5.685 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.803 6.247 7.992 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.436 6.954 8.042 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.009 7.996 8.254 1.00 0.00 H new ATOM 829 N VAL A 53 8.948 8.116 2.230 1.00 0.00 N ATOM 830 CA VAL A 53 9.548 7.385 1.104 1.00 0.00 C ATOM 831 C VAL A 53 10.597 8.265 0.433 1.00 0.00 C ATOM 832 O VAL A 53 11.551 7.785 -0.165 1.00 0.00 O ATOM 833 CB VAL A 53 8.515 6.816 0.079 1.00 0.00 C ATOM 834 CG1 VAL A 53 7.939 7.893 -0.816 1.00 0.00 C ATOM 835 CG2 VAL A 53 9.117 5.685 -0.746 1.00 0.00 C ATOM 0 H VAL A 53 7.974 8.387 2.095 1.00 0.00 H new ATOM 0 HA VAL A 53 10.025 6.496 1.517 1.00 0.00 H new ATOM 0 HB VAL A 53 7.689 6.409 0.662 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.227 7.447 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.432 8.640 -0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.743 8.368 -1.377 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.373 5.311 -1.449 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.982 6.056 -1.296 1.00 0.00 H new ATOM 0 HG23 VAL A 53 9.428 4.877 -0.084 1.00 0.00 H new ATOM 845 N ASN A 54 10.378 9.556 0.529 1.00 0.00 N ATOM 846 CA ASN A 54 11.299 10.553 0.026 1.00 0.00 C ATOM 847 C ASN A 54 12.728 10.347 0.565 1.00 0.00 C ATOM 848 O ASN A 54 13.701 10.483 -0.190 1.00 0.00 O ATOM 849 CB ASN A 54 10.770 11.987 0.283 1.00 0.00 C ATOM 850 CG ASN A 54 10.317 12.257 1.726 1.00 0.00 C ATOM 851 OD1 ASN A 54 10.844 11.703 2.687 1.00 0.00 O ATOM 852 ND2 ASN A 54 9.309 13.082 1.880 1.00 0.00 N ATOM 0 H ASN A 54 9.544 9.950 0.964 1.00 0.00 H new ATOM 0 HA ASN A 54 11.362 10.424 -1.055 1.00 0.00 H new ATOM 0 HB2 ASN A 54 11.553 12.700 0.023 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.932 12.176 -0.388 1.00 0.00 H new ATOM 0 HD21 ASN A 54 8.946 13.275 2.814 1.00 0.00 H new ATOM 0 HD22 ASN A 54 8.888 13.530 1.066 1.00 0.00 H new ATOM 859 N VAL A 55 12.855 9.956 1.846 1.00 0.00 N ATOM 860 CA VAL A 55 14.175 9.675 2.414 1.00 0.00 C ATOM 861 C VAL A 55 14.736 8.397 1.829 1.00 0.00 C ATOM 862 O VAL A 55 15.918 8.276 1.598 1.00 0.00 O ATOM 863 CB VAL A 55 14.244 9.636 3.981 1.00 0.00 C ATOM 864 CG1 VAL A 55 13.784 10.916 4.603 1.00 0.00 C ATOM 865 CG2 VAL A 55 13.495 8.479 4.584 1.00 0.00 C ATOM 0 H VAL A 55 12.075 9.831 2.491 1.00 0.00 H new ATOM 0 HA VAL A 55 14.789 10.530 2.131 1.00 0.00 H new ATOM 0 HB VAL A 55 15.301 9.497 4.208 1.00 0.00 H new ATOM 0 HG11 VAL A 55 13.851 10.838 5.688 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.415 11.735 4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 55 12.750 11.109 4.316 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.585 8.514 5.670 1.00 0.00 H new ATOM 0 HG22 VAL A 55 12.443 8.541 4.305 1.00 0.00 H new ATOM 0 HG23 VAL A 55 13.914 7.543 4.215 1.00 0.00 H new ATOM 875 N LEU A 56 13.857 7.468 1.569 1.00 0.00 N ATOM 876 CA LEU A 56 14.211 6.200 0.960 1.00 0.00 C ATOM 877 C LEU A 56 14.775 6.408 -0.421 1.00 0.00 C ATOM 878 O LEU A 56 15.798 5.840 -0.752 1.00 0.00 O ATOM 879 CB LEU A 56 13.013 5.232 0.929 1.00 0.00 C ATOM 880 CG LEU A 56 12.773 4.373 2.182 1.00 0.00 C ATOM 881 CD1 LEU A 56 13.855 3.334 2.299 1.00 0.00 C ATOM 882 CD2 LEU A 56 12.757 5.212 3.442 1.00 0.00 C ATOM 0 H LEU A 56 12.862 7.564 1.773 1.00 0.00 H new ATOM 0 HA LEU A 56 14.984 5.742 1.577 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.112 5.815 0.741 1.00 0.00 H new ATOM 0 HB3 LEU A 56 13.142 4.562 0.079 1.00 0.00 H new ATOM 0 HG LEU A 56 11.798 3.897 2.074 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.682 2.727 3.188 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.843 2.696 1.416 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.825 3.826 2.378 1.00 0.00 H new ATOM 0 HD21 LEU A 56 12.585 4.569 4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.715 5.720 3.553 1.00 0.00 H new ATOM 0 HD23 LEU A 56 11.960 5.952 3.376 1.00 0.00 H new ATOM 894 N GLN A 57 14.126 7.253 -1.213 1.00 0.00 N ATOM 895 CA GLN A 57 14.615 7.556 -2.538 1.00 0.00 C ATOM 896 C GLN A 57 15.981 8.116 -2.542 1.00 0.00 C ATOM 897 O GLN A 57 16.844 7.671 -3.317 1.00 0.00 O ATOM 898 CB GLN A 57 13.686 8.437 -3.298 1.00 0.00 C ATOM 899 CG GLN A 57 12.883 7.612 -4.248 1.00 0.00 C ATOM 900 CD GLN A 57 11.952 6.653 -3.559 1.00 0.00 C ATOM 901 OE1 GLN A 57 10.794 6.967 -3.291 1.00 0.00 O ATOM 902 NE2 GLN A 57 12.450 5.501 -3.241 1.00 0.00 N ATOM 0 H GLN A 57 13.265 7.735 -0.956 1.00 0.00 H new ATOM 0 HA GLN A 57 14.662 6.594 -3.049 1.00 0.00 H new ATOM 0 HB2 GLN A 57 13.025 8.966 -2.611 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.250 9.194 -3.844 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.302 8.273 -4.892 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.559 7.051 -4.893 1.00 0.00 H new ATOM 0 HE21 GLN A 57 13.416 5.279 -3.482 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.876 4.815 -2.750 1.00 0.00 H new ATOM 911 N GLU A 58 16.218 9.052 -1.663 1.00 0.00 N ATOM 912 CA GLU A 58 17.510 9.631 -1.597 1.00 0.00 C ATOM 913 C GLU A 58 18.549 8.727 -0.987 1.00 0.00 C ATOM 914 O GLU A 58 19.701 8.772 -1.374 1.00 0.00 O ATOM 915 CB GLU A 58 17.544 11.081 -1.109 1.00 0.00 C ATOM 916 CG GLU A 58 16.757 11.386 0.156 1.00 0.00 C ATOM 917 CD GLU A 58 17.547 11.253 1.433 1.00 0.00 C ATOM 918 OE1 GLU A 58 18.434 10.395 1.524 1.00 0.00 O ATOM 919 OE2 GLU A 58 17.291 12.050 2.367 1.00 0.00 O ATOM 0 H GLU A 58 15.538 9.418 -0.997 1.00 0.00 H new ATOM 0 HA GLU A 58 17.817 9.725 -2.639 1.00 0.00 H new ATOM 0 HB2 GLU A 58 18.584 11.361 -0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 58 17.168 11.720 -1.908 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.367 12.402 0.090 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.898 10.717 0.204 1.00 0.00 H new ATOM 926 N ARG A 59 18.163 7.899 -0.050 1.00 0.00 N ATOM 927 CA ARG A 59 19.117 6.980 0.493 1.00 0.00 C ATOM 928 C ARG A 59 19.499 5.925 -0.540 1.00 0.00 C ATOM 929 O ARG A 59 20.671 5.661 -0.750 1.00 0.00 O ATOM 930 CB ARG A 59 18.659 6.325 1.806 1.00 0.00 C ATOM 931 CG ARG A 59 18.616 7.252 3.016 1.00 0.00 C ATOM 932 CD ARG A 59 19.944 7.967 3.221 1.00 0.00 C ATOM 933 NE ARG A 59 20.059 8.597 4.549 1.00 0.00 N ATOM 934 CZ ARG A 59 19.994 9.919 4.791 1.00 0.00 C ATOM 935 NH1 ARG A 59 19.534 10.750 3.879 1.00 0.00 N ATOM 936 NH2 ARG A 59 20.330 10.391 5.985 1.00 0.00 N ATOM 0 H ARG A 59 17.222 7.845 0.341 1.00 0.00 H new ATOM 0 HA ARG A 59 20.000 7.568 0.743 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.665 5.904 1.656 1.00 0.00 H new ATOM 0 HB3 ARG A 59 19.326 5.493 2.030 1.00 0.00 H new ATOM 0 HG2 ARG A 59 17.823 7.988 2.884 1.00 0.00 H new ATOM 0 HG3 ARG A 59 18.371 6.676 3.908 1.00 0.00 H new ATOM 0 HD2 ARG A 59 20.758 7.254 3.091 1.00 0.00 H new ATOM 0 HD3 ARG A 59 20.063 8.730 2.451 1.00 0.00 H new ATOM 0 HE ARG A 59 20.199 7.981 5.349 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.221 10.394 2.976 1.00 0.00 H new ATOM 0 HH12 ARG A 59 19.490 11.750 4.076 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.637 9.752 6.718 1.00 0.00 H new ATOM 0 HH22 ARG A 59 20.281 11.393 6.170 1.00 0.00 H new ATOM 950 N VAL A 60 18.517 5.398 -1.236 1.00 0.00 N ATOM 951 CA VAL A 60 18.766 4.386 -2.250 1.00 0.00 C ATOM 952 C VAL A 60 19.596 4.972 -3.405 1.00 0.00 C ATOM 953 O VAL A 60 20.506 4.334 -3.913 1.00 0.00 O ATOM 954 CB VAL A 60 17.428 3.749 -2.776 1.00 0.00 C ATOM 955 CG1 VAL A 60 17.682 2.773 -3.915 1.00 0.00 C ATOM 956 CG2 VAL A 60 16.714 3.018 -1.646 1.00 0.00 C ATOM 0 H VAL A 60 17.535 5.651 -1.122 1.00 0.00 H new ATOM 0 HA VAL A 60 19.342 3.585 -1.787 1.00 0.00 H new ATOM 0 HB VAL A 60 16.805 4.562 -3.148 1.00 0.00 H new ATOM 0 HG11 VAL A 60 16.734 2.353 -4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 60 18.162 3.296 -4.742 1.00 0.00 H new ATOM 0 HG13 VAL A 60 18.332 1.970 -3.568 1.00 0.00 H new ATOM 0 HG21 VAL A 60 15.789 2.581 -2.022 1.00 0.00 H new ATOM 0 HG22 VAL A 60 17.358 2.228 -1.260 1.00 0.00 H new ATOM 0 HG23 VAL A 60 16.484 3.721 -0.846 1.00 0.00 H new ATOM 966 N GLY A 61 19.305 6.199 -3.770 1.00 0.00 N ATOM 967 CA GLY A 61 20.007 6.818 -4.864 1.00 0.00 C ATOM 968 C GLY A 61 21.331 7.451 -4.491 1.00 0.00 C ATOM 969 O GLY A 61 22.382 7.121 -5.049 1.00 0.00 O ATOM 0 H GLY A 61 18.594 6.782 -3.329 1.00 0.00 H new ATOM 0 HA2 GLY A 61 20.183 6.068 -5.635 1.00 0.00 H new ATOM 0 HA3 GLY A 61 19.366 7.582 -5.303 1.00 0.00 H new ATOM 973 N GLU A 62 21.301 8.328 -3.538 1.00 0.00 N ATOM 974 CA GLU A 62 22.447 9.153 -3.234 1.00 0.00 C ATOM 975 C GLU A 62 23.438 8.466 -2.322 1.00 0.00 C ATOM 976 O GLU A 62 24.646 8.590 -2.518 1.00 0.00 O ATOM 977 CB GLU A 62 22.009 10.489 -2.635 1.00 0.00 C ATOM 978 CG GLU A 62 20.946 11.221 -3.444 1.00 0.00 C ATOM 979 CD GLU A 62 21.358 11.462 -4.868 1.00 0.00 C ATOM 980 OE1 GLU A 62 22.130 12.403 -5.117 1.00 0.00 O ATOM 981 OE2 GLU A 62 20.902 10.724 -5.767 1.00 0.00 O ATOM 0 H GLU A 62 20.489 8.499 -2.945 1.00 0.00 H new ATOM 0 HA GLU A 62 22.958 9.335 -4.179 1.00 0.00 H new ATOM 0 HB2 GLU A 62 21.627 10.315 -1.629 1.00 0.00 H new ATOM 0 HB3 GLU A 62 22.882 11.134 -2.537 1.00 0.00 H new ATOM 0 HG2 GLU A 62 20.023 10.641 -3.431 1.00 0.00 H new ATOM 0 HG3 GLU A 62 20.728 12.177 -2.967 1.00 0.00 H new ATOM 988 N LEU A 63 22.941 7.686 -1.374 1.00 0.00 N ATOM 989 CA LEU A 63 23.801 7.046 -0.358 1.00 0.00 C ATOM 990 C LEU A 63 24.785 6.033 -0.952 1.00 0.00 C ATOM 991 O LEU A 63 25.753 5.631 -0.303 1.00 0.00 O ATOM 992 CB LEU A 63 22.962 6.502 0.840 1.00 0.00 C ATOM 993 CG LEU A 63 23.616 5.502 1.807 1.00 0.00 C ATOM 994 CD1 LEU A 63 23.011 5.649 3.193 1.00 0.00 C ATOM 995 CD2 LEU A 63 23.374 4.067 1.328 1.00 0.00 C ATOM 0 H LEU A 63 21.948 7.474 -1.277 1.00 0.00 H new ATOM 0 HA LEU A 63 24.444 7.822 0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 63 22.629 7.359 1.426 1.00 0.00 H new ATOM 0 HB3 LEU A 63 22.069 6.030 0.430 1.00 0.00 H new ATOM 0 HG LEU A 63 24.686 5.708 1.839 1.00 0.00 H new ATOM 0 HD11 LEU A 63 23.480 4.937 3.872 1.00 0.00 H new ATOM 0 HD12 LEU A 63 23.179 6.662 3.558 1.00 0.00 H new ATOM 0 HD13 LEU A 63 21.940 5.453 3.145 1.00 0.00 H new ATOM 0 HD21 LEU A 63 23.842 3.368 2.021 1.00 0.00 H new ATOM 0 HD22 LEU A 63 22.302 3.873 1.286 1.00 0.00 H new ATOM 0 HD23 LEU A 63 23.805 3.937 0.335 1.00 0.00 H new ATOM 1007 N MET A 64 24.562 5.661 -2.192 1.00 0.00 N ATOM 1008 CA MET A 64 25.471 4.767 -2.884 1.00 0.00 C ATOM 1009 C MET A 64 26.825 5.438 -3.041 1.00 0.00 C ATOM 1010 O MET A 64 27.864 4.833 -2.796 1.00 0.00 O ATOM 1011 CB MET A 64 24.930 4.378 -4.250 1.00 0.00 C ATOM 1012 CG MET A 64 23.575 3.718 -4.197 1.00 0.00 C ATOM 1013 SD MET A 64 23.011 3.099 -5.803 1.00 0.00 S ATOM 1014 CE MET A 64 23.026 4.579 -6.811 1.00 0.00 C ATOM 0 H MET A 64 23.759 5.962 -2.745 1.00 0.00 H new ATOM 0 HA MET A 64 25.574 3.859 -2.290 1.00 0.00 H new ATOM 0 HB2 MET A 64 24.866 5.270 -4.874 1.00 0.00 H new ATOM 0 HB3 MET A 64 25.636 3.701 -4.732 1.00 0.00 H new ATOM 0 HG2 MET A 64 23.610 2.890 -3.489 1.00 0.00 H new ATOM 0 HG3 MET A 64 22.846 4.433 -3.815 1.00 0.00 H new ATOM 0 HE1 MET A 64 22.909 4.306 -7.860 1.00 0.00 H new ATOM 0 HE2 MET A 64 22.205 5.231 -6.512 1.00 0.00 H new ATOM 0 HE3 MET A 64 23.973 5.102 -6.675 1.00 0.00 H new ATOM 1024 N ASP A 65 26.806 6.699 -3.421 1.00 0.00 N ATOM 1025 CA ASP A 65 28.042 7.446 -3.583 1.00 0.00 C ATOM 1026 C ASP A 65 28.385 8.178 -2.304 1.00 0.00 C ATOM 1027 O ASP A 65 29.498 8.045 -1.781 1.00 0.00 O ATOM 1028 CB ASP A 65 27.902 8.466 -4.707 1.00 0.00 C ATOM 1029 CG ASP A 65 29.173 9.253 -4.933 1.00 0.00 C ATOM 1030 OD1 ASP A 65 30.129 8.700 -5.498 1.00 0.00 O ATOM 1031 OD2 ASP A 65 29.235 10.437 -4.561 1.00 0.00 O ATOM 0 H ASP A 65 25.957 7.227 -3.623 1.00 0.00 H new ATOM 0 HA ASP A 65 28.835 6.738 -3.826 1.00 0.00 H new ATOM 0 HB2 ASP A 65 27.628 7.952 -5.628 1.00 0.00 H new ATOM 0 HB3 ASP A 65 27.089 9.153 -4.471 1.00 0.00 H new ATOM 1036 N GLN A 66 27.380 8.875 -1.778 1.00 0.00 N ATOM 1037 CA GLN A 66 27.461 9.715 -0.586 1.00 0.00 C ATOM 1038 C GLN A 66 26.182 10.537 -0.607 1.00 0.00 C ATOM 1039 O GLN A 66 25.967 11.306 -1.545 1.00 0.00 O ATOM 1040 CB GLN A 66 28.696 10.663 -0.681 1.00 0.00 C ATOM 1041 CG GLN A 66 29.142 11.373 0.609 1.00 0.00 C ATOM 1042 CD GLN A 66 28.169 12.409 1.148 1.00 0.00 C ATOM 1043 OE1 GLN A 66 28.213 13.573 0.758 1.00 0.00 O ATOM 1044 NE2 GLN A 66 27.350 12.026 2.087 1.00 0.00 N ATOM 0 H GLN A 66 26.447 8.869 -2.189 1.00 0.00 H new ATOM 0 HA GLN A 66 27.568 9.128 0.326 1.00 0.00 H new ATOM 0 HB2 GLN A 66 29.539 10.082 -1.055 1.00 0.00 H new ATOM 0 HB3 GLN A 66 28.479 11.426 -1.428 1.00 0.00 H new ATOM 0 HG2 GLN A 66 29.310 10.620 1.379 1.00 0.00 H new ATOM 0 HG3 GLN A 66 30.100 11.859 0.424 1.00 0.00 H new ATOM 0 HE21 GLN A 66 27.339 11.051 2.388 1.00 0.00 H new ATOM 0 HE22 GLN A 66 26.720 12.701 2.521 1.00 0.00 H new ATOM 1053 N ASN A 67 25.313 10.352 0.362 1.00 0.00 N ATOM 1054 CA ASN A 67 24.060 11.095 0.362 1.00 0.00 C ATOM 1055 C ASN A 67 24.287 12.542 0.756 1.00 0.00 C ATOM 1056 O ASN A 67 24.581 12.855 1.901 1.00 0.00 O ATOM 1057 CB ASN A 67 22.932 10.419 1.207 1.00 0.00 C ATOM 1058 CG ASN A 67 23.224 10.261 2.701 1.00 0.00 C ATOM 1059 OD1 ASN A 67 23.815 9.262 3.131 1.00 0.00 O ATOM 1060 ND2 ASN A 67 22.790 11.207 3.493 1.00 0.00 N ATOM 0 H ASN A 67 25.440 9.711 1.145 1.00 0.00 H new ATOM 0 HA ASN A 67 23.691 11.080 -0.663 1.00 0.00 H new ATOM 0 HB2 ASN A 67 22.019 11.004 1.094 1.00 0.00 H new ATOM 0 HB3 ASN A 67 22.732 9.433 0.789 1.00 0.00 H new ATOM 0 HD21 ASN A 67 22.935 11.135 4.500 1.00 0.00 H new ATOM 0 HD22 ASN A 67 22.307 12.016 3.104 1.00 0.00 H new ATOM 1067 N ALA A 68 24.229 13.416 -0.214 1.00 0.00 N ATOM 1068 CA ALA A 68 24.389 14.816 0.047 1.00 0.00 C ATOM 1069 C ALA A 68 23.038 15.479 0.066 1.00 0.00 C ATOM 1070 O ALA A 68 22.616 16.123 -0.908 1.00 0.00 O ATOM 1071 CB ALA A 68 25.323 15.477 -0.961 1.00 0.00 C ATOM 0 H ALA A 68 24.072 13.179 -1.194 1.00 0.00 H new ATOM 0 HA ALA A 68 24.856 14.937 1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 68 25.418 16.538 -0.728 1.00 0.00 H new ATOM 0 HB2 ALA A 68 26.305 15.006 -0.911 1.00 0.00 H new ATOM 0 HB3 ALA A 68 24.915 15.361 -1.965 1.00 0.00 H new ATOM 1077 N PHE A 69 22.320 15.263 1.136 1.00 0.00 N ATOM 1078 CA PHE A 69 21.024 15.833 1.273 1.00 0.00 C ATOM 1079 C PHE A 69 21.166 17.189 1.911 1.00 0.00 C ATOM 1080 O PHE A 69 21.315 17.324 3.130 1.00 0.00 O ATOM 1081 CB PHE A 69 20.084 14.926 2.081 1.00 0.00 C ATOM 1082 CG PHE A 69 18.658 15.397 2.105 1.00 0.00 C ATOM 1083 CD1 PHE A 69 17.906 15.407 0.946 1.00 0.00 C ATOM 1084 CD2 PHE A 69 18.072 15.820 3.284 1.00 0.00 C ATOM 1085 CE1 PHE A 69 16.597 15.832 0.957 1.00 0.00 C ATOM 1086 CE2 PHE A 69 16.760 16.246 3.304 1.00 0.00 C ATOM 1087 CZ PHE A 69 16.022 16.253 2.137 1.00 0.00 C ATOM 0 H PHE A 69 22.621 14.691 1.925 1.00 0.00 H new ATOM 0 HA PHE A 69 20.570 15.937 0.288 1.00 0.00 H new ATOM 0 HB2 PHE A 69 20.117 13.920 1.663 1.00 0.00 H new ATOM 0 HB3 PHE A 69 20.451 14.858 3.105 1.00 0.00 H new ATOM 0 HD1 PHE A 69 18.351 15.077 0.019 1.00 0.00 H new ATOM 0 HD2 PHE A 69 18.647 15.817 4.198 1.00 0.00 H new ATOM 0 HE1 PHE A 69 16.022 15.836 0.043 1.00 0.00 H new ATOM 0 HE2 PHE A 69 16.311 16.573 4.230 1.00 0.00 H new ATOM 0 HZ PHE A 69 14.995 16.588 2.149 1.00 0.00 H new ATOM 1097 N SER A 70 21.223 18.172 1.089 1.00 0.00 N ATOM 1098 CA SER A 70 21.339 19.513 1.523 1.00 0.00 C ATOM 1099 C SER A 70 20.272 20.306 0.818 1.00 0.00 C ATOM 1100 O SER A 70 20.179 20.274 -0.424 1.00 0.00 O ATOM 1101 CB SER A 70 22.743 20.048 1.194 1.00 0.00 C ATOM 1102 OG SER A 70 22.931 21.372 1.672 1.00 0.00 O ATOM 0 H SER A 70 21.190 18.063 0.075 1.00 0.00 H new ATOM 0 HA SER A 70 21.206 19.593 2.602 1.00 0.00 H new ATOM 0 HB2 SER A 70 23.494 19.393 1.636 1.00 0.00 H new ATOM 0 HB3 SER A 70 22.896 20.026 0.115 1.00 0.00 H new ATOM 0 HG SER A 70 23.835 21.676 1.446 1.00 0.00 H new ATOM 1108 N LEU A 71 19.454 20.996 1.574 1.00 0.00 N ATOM 1109 CA LEU A 71 18.370 21.770 1.008 1.00 0.00 C ATOM 1110 C LEU A 71 18.876 23.107 0.494 1.00 0.00 C ATOM 1111 O LEU A 71 18.512 24.170 0.979 1.00 0.00 O ATOM 1112 CB LEU A 71 17.177 21.941 1.988 1.00 0.00 C ATOM 1113 CG LEU A 71 16.420 20.658 2.420 1.00 0.00 C ATOM 1114 CD1 LEU A 71 15.984 19.839 1.215 1.00 0.00 C ATOM 1115 CD2 LEU A 71 17.240 19.813 3.388 1.00 0.00 C ATOM 0 H LEU A 71 19.517 21.039 2.591 1.00 0.00 H new ATOM 0 HA LEU A 71 17.981 21.206 0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 71 17.548 22.433 2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 71 16.457 22.618 1.528 1.00 0.00 H new ATOM 0 HG LEU A 71 15.523 20.980 2.949 1.00 0.00 H new ATOM 0 HD11 LEU A 71 15.457 18.947 1.553 1.00 0.00 H new ATOM 0 HD12 LEU A 71 15.322 20.437 0.589 1.00 0.00 H new ATOM 0 HD13 LEU A 71 16.861 19.545 0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 71 16.673 18.924 3.665 1.00 0.00 H new ATOM 0 HD22 LEU A 71 18.173 19.514 2.910 1.00 0.00 H new ATOM 0 HD23 LEU A 71 17.461 20.396 4.282 1.00 0.00 H new ATOM 1127 N THR A 72 19.792 23.016 -0.422 1.00 0.00 N ATOM 1128 CA THR A 72 20.345 24.148 -1.088 1.00 0.00 C ATOM 1129 C THR A 72 20.256 23.894 -2.596 1.00 0.00 C ATOM 1130 O THR A 72 20.596 24.739 -3.417 1.00 0.00 O ATOM 1131 CB THR A 72 21.822 24.384 -0.637 1.00 0.00 C ATOM 1132 OG1 THR A 72 22.318 25.650 -1.123 1.00 0.00 O ATOM 1133 CG2 THR A 72 22.745 23.265 -1.125 1.00 0.00 C ATOM 0 H THR A 72 20.183 22.127 -0.733 1.00 0.00 H new ATOM 0 HA THR A 72 19.788 25.050 -0.833 1.00 0.00 H new ATOM 0 HB THR A 72 21.821 24.390 0.453 1.00 0.00 H new ATOM 0 HG1 THR A 72 22.050 25.769 -2.058 1.00 0.00 H new ATOM 0 HG21 THR A 72 23.764 23.463 -0.793 1.00 0.00 H new ATOM 0 HG22 THR A 72 22.409 22.312 -0.717 1.00 0.00 H new ATOM 0 HG23 THR A 72 22.721 23.222 -2.214 1.00 0.00 H new ATOM 1141 N GLN A 73 19.784 22.706 -2.942 1.00 0.00 N ATOM 1142 CA GLN A 73 19.612 22.315 -4.325 1.00 0.00 C ATOM 1143 C GLN A 73 18.158 21.933 -4.570 1.00 0.00 C ATOM 1144 O GLN A 73 17.757 21.616 -5.687 1.00 0.00 O ATOM 1145 CB GLN A 73 20.537 21.147 -4.676 1.00 0.00 C ATOM 1146 CG GLN A 73 20.356 19.920 -3.793 1.00 0.00 C ATOM 1147 CD GLN A 73 21.218 18.753 -4.221 1.00 0.00 C ATOM 1148 OE1 GLN A 73 21.529 18.585 -5.406 1.00 0.00 O ATOM 1149 NE2 GLN A 73 21.625 17.949 -3.271 1.00 0.00 N ATOM 0 H GLN A 73 19.511 21.989 -2.270 1.00 0.00 H new ATOM 0 HA GLN A 73 19.874 23.157 -4.965 1.00 0.00 H new ATOM 0 HB2 GLN A 73 20.366 20.862 -5.714 1.00 0.00 H new ATOM 0 HB3 GLN A 73 21.571 21.483 -4.604 1.00 0.00 H new ATOM 0 HG2 GLN A 73 20.595 20.182 -2.762 1.00 0.00 H new ATOM 0 HG3 GLN A 73 19.309 19.617 -3.811 1.00 0.00 H new ATOM 0 HE21 GLN A 73 21.348 18.120 -2.304 1.00 0.00 H new ATOM 0 HE22 GLN A 73 22.219 17.152 -3.498 1.00 0.00 H new ATOM 1158 N LYS A 74 17.377 22.014 -3.526 1.00 0.00 N ATOM 1159 CA LYS A 74 16.002 21.632 -3.547 1.00 0.00 C ATOM 1160 C LYS A 74 15.263 22.593 -2.660 1.00 0.00 C ATOM 1161 O LYS A 74 15.381 22.480 -1.435 1.00 0.00 O ATOM 1162 CB LYS A 74 15.826 20.180 -3.043 1.00 0.00 C ATOM 1163 CG LYS A 74 14.372 19.681 -3.025 1.00 0.00 C ATOM 1164 CD LYS A 74 13.753 19.625 -4.423 1.00 0.00 C ATOM 1165 CE LYS A 74 14.370 18.529 -5.287 1.00 0.00 C ATOM 1166 NZ LYS A 74 14.062 17.170 -4.772 1.00 0.00 N ATOM 1167 OXT LYS A 74 14.590 23.496 -3.178 1.00 0.00 O ATOM 0 H LYS A 74 17.693 22.356 -2.619 1.00 0.00 H new ATOM 0 HA LYS A 74 15.611 21.666 -4.564 1.00 0.00 H new ATOM 0 HB2 LYS A 74 16.416 19.516 -3.674 1.00 0.00 H new ATOM 0 HB3 LYS A 74 16.234 20.107 -2.035 1.00 0.00 H new ATOM 0 HG2 LYS A 74 14.338 18.688 -2.576 1.00 0.00 H new ATOM 0 HG3 LYS A 74 13.774 20.337 -2.393 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.680 19.455 -4.336 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.884 20.589 -4.915 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.000 18.622 -6.308 1.00 0.00 H new ATOM 0 HE3 LYS A 74 15.451 18.665 -5.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.321 16.461 -5.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.604 16.998 -3.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.045 17.099 -4.566 1.00 0.00 H new TER 1181 LYS A 74 ATOM 1182 N GLY B 1 1.982 -14.943 -15.568 1.00 0.00 N ATOM 1183 CA GLY B 1 2.270 -15.276 -14.186 1.00 0.00 C ATOM 1184 C GLY B 1 1.153 -14.823 -13.291 1.00 0.00 C ATOM 1185 O GLY B 1 0.055 -14.512 -13.775 1.00 0.00 O ATOM 0 H1 GLY B 1 2.021 -15.805 -16.148 1.00 0.00 H new ATOM 0 H2 GLY B 1 1.032 -14.524 -15.634 1.00 0.00 H new ATOM 0 H3 GLY B 1 2.686 -14.260 -15.915 1.00 0.00 H new ATOM 0 HA2 GLY B 1 2.409 -16.353 -14.087 1.00 0.00 H new ATOM 0 HA3 GLY B 1 3.204 -14.804 -13.879 1.00 0.00 H new ATOM 1191 N SER B 2 1.403 -14.780 -12.007 1.00 0.00 N ATOM 1192 CA SER B 2 0.405 -14.380 -11.056 1.00 0.00 C ATOM 1193 C SER B 2 0.493 -12.882 -10.779 1.00 0.00 C ATOM 1194 O SER B 2 -0.515 -12.236 -10.468 1.00 0.00 O ATOM 1195 CB SER B 2 0.583 -15.168 -9.768 1.00 0.00 C ATOM 1196 OG SER B 2 0.553 -16.570 -10.018 1.00 0.00 O ATOM 0 H SER B 2 2.304 -15.022 -11.595 1.00 0.00 H new ATOM 0 HA SER B 2 -0.581 -14.589 -11.471 1.00 0.00 H new ATOM 0 HB2 SER B 2 1.530 -14.899 -9.301 1.00 0.00 H new ATOM 0 HB3 SER B 2 -0.206 -14.904 -9.064 1.00 0.00 H new ATOM 0 HG SER B 2 0.671 -17.055 -9.175 1.00 0.00 H new ATOM 1202 N HIS B 3 1.679 -12.315 -10.922 1.00 0.00 N ATOM 1203 CA HIS B 3 1.868 -10.902 -10.647 1.00 0.00 C ATOM 1204 C HIS B 3 2.938 -10.309 -11.540 1.00 0.00 C ATOM 1205 O HIS B 3 3.811 -11.024 -12.036 1.00 0.00 O ATOM 1206 CB HIS B 3 2.147 -10.630 -9.148 1.00 0.00 C ATOM 1207 CG HIS B 3 3.392 -11.254 -8.579 1.00 0.00 C ATOM 1208 ND1 HIS B 3 4.433 -10.515 -8.125 1.00 0.00 N ATOM 1209 CD2 HIS B 3 3.722 -12.543 -8.344 1.00 0.00 C ATOM 1210 CE1 HIS B 3 5.357 -11.300 -7.642 1.00 0.00 C ATOM 1211 NE2 HIS B 3 4.953 -12.541 -7.758 1.00 0.00 N ATOM 0 H HIS B 3 2.519 -12.808 -11.225 1.00 0.00 H new ATOM 0 HA HIS B 3 0.930 -10.398 -10.881 1.00 0.00 H new ATOM 0 HB2 HIS B 3 2.207 -9.552 -9.001 1.00 0.00 H new ATOM 0 HB3 HIS B 3 1.292 -10.984 -8.571 1.00 0.00 H new ATOM 0 HD1 HIS B 3 4.487 -9.497 -8.156 1.00 0.00 H new ATOM 0 HD2 HIS B 3 3.123 -13.411 -8.577 1.00 0.00 H new ATOM 0 HE1 HIS B 3 6.297 -10.980 -7.218 1.00 0.00 H new ATOM 1220 N MET B 4 2.856 -9.021 -11.742 1.00 0.00 N ATOM 1221 CA MET B 4 3.737 -8.298 -12.640 1.00 0.00 C ATOM 1222 C MET B 4 4.702 -7.437 -11.829 1.00 0.00 C ATOM 1223 O MET B 4 5.342 -7.929 -10.906 1.00 0.00 O ATOM 1224 CB MET B 4 2.873 -7.437 -13.578 1.00 0.00 C ATOM 1225 CG MET B 4 1.877 -8.243 -14.391 1.00 0.00 C ATOM 1226 SD MET B 4 0.763 -7.221 -15.380 1.00 0.00 S ATOM 1227 CE MET B 4 -0.126 -6.337 -14.090 1.00 0.00 C ATOM 0 H MET B 4 2.165 -8.428 -11.282 1.00 0.00 H new ATOM 0 HA MET B 4 4.330 -8.990 -13.238 1.00 0.00 H new ATOM 0 HB2 MET B 4 2.333 -6.698 -12.986 1.00 0.00 H new ATOM 0 HB3 MET B 4 3.525 -6.887 -14.257 1.00 0.00 H new ATOM 0 HG2 MET B 4 2.421 -8.918 -15.051 1.00 0.00 H new ATOM 0 HG3 MET B 4 1.286 -8.863 -13.717 1.00 0.00 H new ATOM 0 HE1 MET B 4 -1.070 -5.964 -14.488 1.00 0.00 H new ATOM 0 HE2 MET B 4 -0.325 -7.012 -13.257 1.00 0.00 H new ATOM 0 HE3 MET B 4 0.477 -5.499 -13.741 1.00 0.00 H new ATOM 1237 N VAL B 5 4.847 -6.193 -12.215 1.00 0.00 N ATOM 1238 CA VAL B 5 5.642 -5.221 -11.509 1.00 0.00 C ATOM 1239 C VAL B 5 4.817 -3.972 -11.372 1.00 0.00 C ATOM 1240 O VAL B 5 4.420 -3.378 -12.396 1.00 0.00 O ATOM 1241 CB VAL B 5 6.958 -4.884 -12.264 1.00 0.00 C ATOM 1242 CG1 VAL B 5 7.506 -3.553 -11.785 1.00 0.00 C ATOM 1243 CG2 VAL B 5 7.996 -5.980 -12.043 1.00 0.00 C ATOM 0 H VAL B 5 4.402 -5.819 -13.053 1.00 0.00 H new ATOM 0 HA VAL B 5 5.921 -5.630 -10.538 1.00 0.00 H new ATOM 0 HB VAL B 5 6.739 -4.819 -13.330 1.00 0.00 H new ATOM 0 HG11 VAL B 5 8.428 -3.326 -12.320 1.00 0.00 H new ATOM 0 HG12 VAL B 5 6.773 -2.768 -11.975 1.00 0.00 H new ATOM 0 HG13 VAL B 5 7.711 -3.607 -10.716 1.00 0.00 H new ATOM 0 HG21 VAL B 5 8.911 -5.728 -12.579 1.00 0.00 H new ATOM 0 HG22 VAL B 5 8.211 -6.068 -10.978 1.00 0.00 H new ATOM 0 HG23 VAL B 5 7.608 -6.929 -12.414 1.00 0.00 H new ATOM 1253 N ASN B 6 4.498 -3.582 -10.161 1.00 0.00 N ATOM 1254 CA ASN B 6 3.697 -2.424 -10.003 1.00 0.00 C ATOM 1255 C ASN B 6 3.968 -1.667 -8.728 1.00 0.00 C ATOM 1256 O ASN B 6 3.610 -2.104 -7.628 1.00 0.00 O ATOM 1257 CB ASN B 6 2.236 -2.723 -10.168 1.00 0.00 C ATOM 1258 CG ASN B 6 1.592 -1.633 -10.970 1.00 0.00 C ATOM 1259 OD1 ASN B 6 2.006 -0.470 -10.927 1.00 0.00 O ATOM 1260 ND2 ASN B 6 0.611 -1.978 -11.715 1.00 0.00 N ATOM 0 H ASN B 6 4.780 -4.046 -9.298 1.00 0.00 H new ATOM 0 HA ASN B 6 3.993 -1.757 -10.813 1.00 0.00 H new ATOM 0 HB2 ASN B 6 2.104 -3.683 -10.667 1.00 0.00 H new ATOM 0 HB3 ASN B 6 1.757 -2.803 -9.192 1.00 0.00 H new ATOM 0 HD21 ASN B 6 0.145 -1.283 -12.298 1.00 0.00 H new ATOM 0 HD22 ASN B 6 0.295 -2.948 -11.726 1.00 0.00 H new ATOM 1267 N VAL B 7 4.609 -0.568 -8.867 1.00 0.00 N ATOM 1268 CA VAL B 7 4.851 0.334 -7.783 1.00 0.00 C ATOM 1269 C VAL B 7 4.106 1.650 -8.081 1.00 0.00 C ATOM 1270 O VAL B 7 4.227 2.197 -9.190 1.00 0.00 O ATOM 1271 CB VAL B 7 6.391 0.585 -7.576 1.00 0.00 C ATOM 1272 CG1 VAL B 7 7.107 0.763 -8.900 1.00 0.00 C ATOM 1273 CG2 VAL B 7 6.626 1.818 -6.727 1.00 0.00 C ATOM 0 H VAL B 7 4.994 -0.254 -9.758 1.00 0.00 H new ATOM 0 HA VAL B 7 4.481 -0.100 -6.854 1.00 0.00 H new ATOM 0 HB VAL B 7 6.791 -0.294 -7.070 1.00 0.00 H new ATOM 0 HG11 VAL B 7 8.168 0.934 -8.720 1.00 0.00 H new ATOM 0 HG12 VAL B 7 6.982 -0.135 -9.505 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.686 1.618 -9.429 1.00 0.00 H new ATOM 0 HG21 VAL B 7 7.697 1.972 -6.597 1.00 0.00 H new ATOM 0 HG22 VAL B 7 6.192 2.688 -7.220 1.00 0.00 H new ATOM 0 HG23 VAL B 7 6.158 1.683 -5.752 1.00 0.00 H new ATOM 1283 N LEU B 8 3.323 2.130 -7.128 1.00 0.00 N ATOM 1284 CA LEU B 8 2.522 3.338 -7.303 1.00 0.00 C ATOM 1285 C LEU B 8 2.038 3.882 -5.952 1.00 0.00 C ATOM 1286 O LEU B 8 2.175 3.218 -4.923 1.00 0.00 O ATOM 1287 CB LEU B 8 1.331 3.129 -8.292 1.00 0.00 C ATOM 1288 CG LEU B 8 0.222 2.139 -7.929 1.00 0.00 C ATOM 1289 CD1 LEU B 8 -0.840 2.177 -8.997 1.00 0.00 C ATOM 1290 CD2 LEU B 8 0.719 0.713 -7.773 1.00 0.00 C ATOM 0 H LEU B 8 3.223 1.696 -6.211 1.00 0.00 H new ATOM 0 HA LEU B 8 3.174 4.085 -7.755 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.864 4.101 -8.452 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.750 2.816 -9.248 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.176 2.445 -6.962 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.634 1.474 -8.746 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -1.254 3.183 -9.063 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.402 1.901 -9.956 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -0.117 0.062 -7.516 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.164 0.378 -8.710 1.00 0.00 H new ATOM 0 HD23 LEU B 8 1.467 0.673 -6.981 1.00 0.00 H new ATOM 1302 N LYS B 9 1.456 5.064 -5.975 1.00 0.00 N ATOM 1303 CA LYS B 9 1.070 5.789 -4.769 1.00 0.00 C ATOM 1304 C LYS B 9 -0.454 5.859 -4.647 1.00 0.00 C ATOM 1305 O LYS B 9 -1.156 5.995 -5.655 1.00 0.00 O ATOM 1306 CB LYS B 9 1.723 7.186 -4.854 1.00 0.00 C ATOM 1307 CG LYS B 9 1.614 8.125 -3.629 1.00 0.00 C ATOM 1308 CD LYS B 9 0.241 8.775 -3.484 1.00 0.00 C ATOM 1309 CE LYS B 9 0.198 9.752 -2.318 1.00 0.00 C ATOM 1310 NZ LYS B 9 1.138 10.887 -2.499 1.00 0.00 N ATOM 0 H LYS B 9 1.233 5.559 -6.839 1.00 0.00 H new ATOM 0 HA LYS B 9 1.416 5.280 -3.869 1.00 0.00 H new ATOM 0 HB2 LYS B 9 2.782 7.045 -5.071 1.00 0.00 H new ATOM 0 HB3 LYS B 9 1.289 7.704 -5.709 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.837 7.558 -2.725 1.00 0.00 H new ATOM 0 HG3 LYS B 9 2.371 8.905 -3.710 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -0.013 9.298 -4.406 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -0.513 8.002 -3.338 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -0.816 10.137 -2.207 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.442 9.225 -1.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 0.912 11.638 -1.816 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 2.112 10.559 -2.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 1.049 11.260 -3.466 1.00 0.00 H new ATOM 1324 N GLY B 10 -0.957 5.737 -3.421 1.00 0.00 N ATOM 1325 CA GLY B 10 -2.372 5.785 -3.178 1.00 0.00 C ATOM 1326 C GLY B 10 -2.716 5.221 -1.814 1.00 0.00 C ATOM 1327 O GLY B 10 -2.062 5.551 -0.814 1.00 0.00 O ATOM 0 H GLY B 10 -0.390 5.604 -2.584 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.720 6.816 -3.246 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -2.895 5.220 -3.950 1.00 0.00 H new ATOM 1331 N VAL B 11 -3.723 4.391 -1.762 1.00 0.00 N ATOM 1332 CA VAL B 11 -4.147 3.775 -0.536 1.00 0.00 C ATOM 1333 C VAL B 11 -4.413 2.277 -0.808 1.00 0.00 C ATOM 1334 O VAL B 11 -4.906 1.902 -1.883 1.00 0.00 O ATOM 1335 CB VAL B 11 -5.401 4.518 0.035 1.00 0.00 C ATOM 1336 CG1 VAL B 11 -6.639 4.296 -0.779 1.00 0.00 C ATOM 1337 CG2 VAL B 11 -5.655 4.243 1.489 1.00 0.00 C ATOM 0 H VAL B 11 -4.276 4.122 -2.576 1.00 0.00 H new ATOM 0 HA VAL B 11 -3.371 3.850 0.225 1.00 0.00 H new ATOM 0 HB VAL B 11 -5.146 5.575 -0.044 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -7.472 4.838 -0.330 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -6.476 4.657 -1.794 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -6.871 3.231 -0.805 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -6.539 4.792 1.814 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -5.817 3.175 1.634 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -4.794 4.563 2.076 1.00 0.00 H new ATOM 1347 N LEU B 12 -4.061 1.440 0.125 1.00 0.00 N ATOM 1348 CA LEU B 12 -4.126 0.011 -0.082 1.00 0.00 C ATOM 1349 C LEU B 12 -5.060 -0.644 0.945 1.00 0.00 C ATOM 1350 O LEU B 12 -4.837 -0.531 2.149 1.00 0.00 O ATOM 1351 CB LEU B 12 -2.706 -0.559 0.043 1.00 0.00 C ATOM 1352 CG LEU B 12 -2.553 -2.042 -0.211 1.00 0.00 C ATOM 1353 CD1 LEU B 12 -2.745 -2.401 -1.668 1.00 0.00 C ATOM 1354 CD2 LEU B 12 -1.245 -2.571 0.302 1.00 0.00 C ATOM 0 H LEU B 12 -3.723 1.720 1.046 1.00 0.00 H new ATOM 0 HA LEU B 12 -4.527 -0.200 -1.073 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -2.061 -0.024 -0.654 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.339 -0.344 1.047 1.00 0.00 H new ATOM 0 HG LEU B 12 -3.351 -2.527 0.351 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -2.625 -3.477 -1.797 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.745 -2.107 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.004 -1.878 -2.272 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -1.179 -3.640 0.098 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.424 -2.055 -0.195 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -1.181 -2.403 1.377 1.00 0.00 H new ATOM 1366 N ILE B 13 -6.088 -1.338 0.469 1.00 0.00 N ATOM 1367 CA ILE B 13 -7.076 -1.968 1.358 1.00 0.00 C ATOM 1368 C ILE B 13 -7.018 -3.508 1.344 1.00 0.00 C ATOM 1369 O ILE B 13 -7.001 -4.126 0.270 1.00 0.00 O ATOM 1370 CB ILE B 13 -8.531 -1.429 1.097 1.00 0.00 C ATOM 1371 CG1 ILE B 13 -9.579 -2.219 1.890 1.00 0.00 C ATOM 1372 CG2 ILE B 13 -8.861 -1.434 -0.378 1.00 0.00 C ATOM 1373 CD1 ILE B 13 -10.939 -1.571 1.947 1.00 0.00 C ATOM 0 H ILE B 13 -6.265 -1.482 -0.525 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.797 -1.672 2.369 1.00 0.00 H new ATOM 0 HB ILE B 13 -8.558 -0.397 1.448 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -9.681 -3.210 1.447 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -9.215 -2.361 2.908 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -9.873 -1.056 -0.526 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -8.155 -0.798 -0.911 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -8.794 -2.452 -0.762 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -11.617 -2.198 2.527 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -10.856 -0.592 2.419 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -11.329 -1.454 0.936 1.00 0.00 H new ATOM 1385 N GLU B 14 -6.876 -4.106 2.551 1.00 0.00 N ATOM 1386 CA GLU B 14 -6.857 -5.569 2.760 1.00 0.00 C ATOM 1387 C GLU B 14 -8.061 -5.963 3.575 1.00 0.00 C ATOM 1388 O GLU B 14 -8.233 -5.499 4.715 1.00 0.00 O ATOM 1389 CB GLU B 14 -5.624 -5.945 3.562 1.00 0.00 C ATOM 1390 CG GLU B 14 -5.372 -7.404 3.862 1.00 0.00 C ATOM 1391 CD GLU B 14 -4.136 -7.554 4.743 1.00 0.00 C ATOM 1392 OE1 GLU B 14 -3.056 -7.051 4.361 1.00 0.00 O ATOM 1393 OE2 GLU B 14 -4.234 -8.128 5.843 1.00 0.00 O ATOM 0 H GLU B 14 -6.770 -3.577 3.416 1.00 0.00 H new ATOM 0 HA GLU B 14 -6.857 -6.070 1.792 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -4.754 -5.562 3.030 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -5.674 -5.416 4.513 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -6.239 -7.835 4.363 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -5.234 -7.956 2.932 1.00 0.00 H new ATOM 1400 N CYS B 15 -8.841 -6.812 3.018 1.00 0.00 N ATOM 1401 CA CYS B 15 -10.060 -7.332 3.622 1.00 0.00 C ATOM 1402 C CYS B 15 -10.323 -8.640 2.961 1.00 0.00 C ATOM 1403 O CYS B 15 -9.422 -9.187 2.362 1.00 0.00 O ATOM 1404 CB CYS B 15 -11.250 -6.377 3.399 1.00 0.00 C ATOM 1405 SG CYS B 15 -11.105 -4.802 4.249 1.00 0.00 S ATOM 0 H CYS B 15 -8.661 -7.194 2.090 1.00 0.00 H new ATOM 0 HA CYS B 15 -9.940 -7.437 4.700 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -11.356 -6.191 2.330 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -12.164 -6.871 3.729 1.00 0.00 H new ATOM 0 HG CYS B 15 -9.899 -4.670 4.715 1.00 0.00 H new ATOM 1411 N ASP B 16 -11.496 -9.168 3.095 1.00 0.00 N ATOM 1412 CA ASP B 16 -11.838 -10.389 2.388 1.00 0.00 C ATOM 1413 C ASP B 16 -11.878 -10.124 0.900 1.00 0.00 C ATOM 1414 O ASP B 16 -12.457 -9.126 0.473 1.00 0.00 O ATOM 1415 CB ASP B 16 -13.170 -10.997 2.863 1.00 0.00 C ATOM 1416 CG ASP B 16 -13.045 -11.704 4.183 1.00 0.00 C ATOM 1417 OD1 ASP B 16 -12.660 -12.885 4.205 1.00 0.00 O ATOM 1418 OD2 ASP B 16 -13.281 -11.095 5.230 1.00 0.00 O ATOM 0 H ASP B 16 -12.239 -8.787 3.680 1.00 0.00 H new ATOM 0 HA ASP B 16 -11.063 -11.123 2.611 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -13.916 -10.207 2.948 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -13.533 -11.699 2.112 1.00 0.00 H new ATOM 1423 N PRO B 17 -11.236 -10.995 0.084 1.00 0.00 N ATOM 1424 CA PRO B 17 -11.194 -10.885 -1.405 1.00 0.00 C ATOM 1425 C PRO B 17 -12.577 -10.715 -2.053 1.00 0.00 C ATOM 1426 O PRO B 17 -12.694 -10.313 -3.204 1.00 0.00 O ATOM 1427 CB PRO B 17 -10.566 -12.206 -1.821 1.00 0.00 C ATOM 1428 CG PRO B 17 -9.677 -12.538 -0.686 1.00 0.00 C ATOM 1429 CD PRO B 17 -10.436 -12.153 0.543 1.00 0.00 C ATOM 0 HA PRO B 17 -10.646 -9.999 -1.726 1.00 0.00 H new ATOM 0 HB2 PRO B 17 -11.320 -12.977 -1.979 1.00 0.00 H new ATOM 0 HB3 PRO B 17 -10.009 -12.110 -2.753 1.00 0.00 H new ATOM 0 HG2 PRO B 17 -9.431 -13.600 -0.678 1.00 0.00 H new ATOM 0 HG3 PRO B 17 -8.736 -11.993 -0.753 1.00 0.00 H new ATOM 0 HD2 PRO B 17 -11.069 -12.966 0.899 1.00 0.00 H new ATOM 0 HD3 PRO B 17 -9.770 -11.885 1.363 1.00 0.00 H new ATOM 1437 N ALA B 18 -13.602 -11.027 -1.302 1.00 0.00 N ATOM 1438 CA ALA B 18 -14.986 -10.802 -1.674 1.00 0.00 C ATOM 1439 C ALA B 18 -15.217 -9.314 -2.016 1.00 0.00 C ATOM 1440 O ALA B 18 -15.963 -8.973 -2.974 1.00 0.00 O ATOM 1441 CB ALA B 18 -15.833 -11.179 -0.493 1.00 0.00 C ATOM 0 H ALA B 18 -13.499 -11.459 -0.384 1.00 0.00 H new ATOM 0 HA ALA B 18 -15.242 -11.397 -2.551 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -16.884 -11.023 -0.735 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -15.669 -12.228 -0.248 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -15.562 -10.560 0.362 1.00 0.00 H new ATOM 1447 N MET B 19 -14.522 -8.430 -1.271 1.00 0.00 N ATOM 1448 CA MET B 19 -14.646 -6.989 -1.459 1.00 0.00 C ATOM 1449 C MET B 19 -14.201 -6.640 -2.851 1.00 0.00 C ATOM 1450 O MET B 19 -14.802 -5.826 -3.509 1.00 0.00 O ATOM 1451 CB MET B 19 -13.792 -6.178 -0.449 1.00 0.00 C ATOM 1452 CG MET B 19 -12.291 -6.225 -0.727 1.00 0.00 C ATOM 1453 SD MET B 19 -11.316 -5.206 0.361 1.00 0.00 S ATOM 1454 CE MET B 19 -9.694 -5.585 -0.252 1.00 0.00 C ATOM 0 H MET B 19 -13.870 -8.700 -0.534 1.00 0.00 H new ATOM 0 HA MET B 19 -15.691 -6.728 -1.295 1.00 0.00 H new ATOM 0 HB2 MET B 19 -14.121 -5.139 -0.462 1.00 0.00 H new ATOM 0 HB3 MET B 19 -13.977 -6.558 0.556 1.00 0.00 H new ATOM 0 HG2 MET B 19 -11.949 -7.257 -0.644 1.00 0.00 H new ATOM 0 HG3 MET B 19 -12.113 -5.912 -1.756 1.00 0.00 H new ATOM 0 HE1 MET B 19 -9.005 -5.696 0.586 1.00 0.00 H new ATOM 0 HE2 MET B 19 -9.728 -6.515 -0.820 1.00 0.00 H new ATOM 0 HE3 MET B 19 -9.352 -4.777 -0.899 1.00 0.00 H new ATOM 1464 N LYS B 20 -13.183 -7.352 -3.311 1.00 0.00 N ATOM 1465 CA LYS B 20 -12.581 -7.145 -4.585 1.00 0.00 C ATOM 1466 C LYS B 20 -13.592 -7.298 -5.672 1.00 0.00 C ATOM 1467 O LYS B 20 -13.630 -6.494 -6.594 1.00 0.00 O ATOM 1468 CB LYS B 20 -11.346 -8.087 -4.728 1.00 0.00 C ATOM 1469 CG LYS B 20 -10.956 -8.604 -6.136 1.00 0.00 C ATOM 1470 CD LYS B 20 -10.779 -7.520 -7.207 1.00 0.00 C ATOM 1471 CE LYS B 20 -9.994 -6.343 -6.713 1.00 0.00 C ATOM 1472 NZ LYS B 20 -8.665 -6.723 -6.235 1.00 0.00 N ATOM 0 H LYS B 20 -12.753 -8.108 -2.779 1.00 0.00 H new ATOM 0 HA LYS B 20 -12.211 -6.124 -4.674 1.00 0.00 H new ATOM 0 HB2 LYS B 20 -10.483 -7.562 -4.319 1.00 0.00 H new ATOM 0 HB3 LYS B 20 -11.520 -8.957 -4.094 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -10.025 -9.166 -6.054 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -11.721 -9.303 -6.473 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -10.276 -7.949 -8.073 1.00 0.00 H new ATOM 0 HD3 LYS B 20 -11.760 -7.183 -7.543 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -9.894 -5.613 -7.516 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -10.542 -5.856 -5.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -7.961 -6.045 -6.590 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -8.656 -6.719 -5.195 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -8.432 -7.676 -6.579 1.00 0.00 H new ATOM 1486 N GLN B 21 -14.458 -8.242 -5.513 1.00 0.00 N ATOM 1487 CA GLN B 21 -15.421 -8.508 -6.514 1.00 0.00 C ATOM 1488 C GLN B 21 -16.468 -7.420 -6.565 1.00 0.00 C ATOM 1489 O GLN B 21 -16.869 -6.999 -7.654 1.00 0.00 O ATOM 1490 CB GLN B 21 -15.985 -9.886 -6.356 1.00 0.00 C ATOM 1491 CG GLN B 21 -14.874 -10.912 -6.277 1.00 0.00 C ATOM 1492 CD GLN B 21 -15.356 -12.323 -6.398 1.00 0.00 C ATOM 1493 OE1 GLN B 21 -16.474 -12.649 -6.039 1.00 0.00 O ATOM 1494 NE2 GLN B 21 -14.511 -13.175 -6.904 1.00 0.00 N ATOM 0 H GLN B 21 -14.514 -8.843 -4.691 1.00 0.00 H new ATOM 0 HA GLN B 21 -14.935 -8.493 -7.489 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -16.596 -9.933 -5.454 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -16.640 -10.115 -7.197 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -14.151 -10.714 -7.068 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -14.349 -10.796 -5.329 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -13.584 -12.863 -7.193 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -14.776 -14.154 -7.011 1.00 0.00 H new ATOM 1503 N PHE B 22 -16.886 -6.919 -5.407 1.00 0.00 N ATOM 1504 CA PHE B 22 -17.790 -5.781 -5.441 1.00 0.00 C ATOM 1505 C PHE B 22 -17.115 -4.489 -5.937 1.00 0.00 C ATOM 1506 O PHE B 22 -17.751 -3.656 -6.575 1.00 0.00 O ATOM 1507 CB PHE B 22 -18.773 -5.600 -4.254 1.00 0.00 C ATOM 1508 CG PHE B 22 -18.205 -5.230 -2.911 1.00 0.00 C ATOM 1509 CD1 PHE B 22 -17.836 -3.920 -2.632 1.00 0.00 C ATOM 1510 CD2 PHE B 22 -18.090 -6.178 -1.911 1.00 0.00 C ATOM 1511 CE1 PHE B 22 -17.353 -3.571 -1.386 1.00 0.00 C ATOM 1512 CE2 PHE B 22 -17.615 -5.832 -0.660 1.00 0.00 C ATOM 1513 CZ PHE B 22 -17.244 -4.527 -0.398 1.00 0.00 C ATOM 0 H PHE B 22 -16.630 -7.262 -4.481 1.00 0.00 H new ATOM 0 HA PHE B 22 -18.500 -6.069 -6.217 1.00 0.00 H new ATOM 0 HB2 PHE B 22 -19.495 -4.832 -4.533 1.00 0.00 H new ATOM 0 HB3 PHE B 22 -19.328 -6.531 -4.136 1.00 0.00 H new ATOM 0 HD1 PHE B 22 -17.928 -3.165 -3.399 1.00 0.00 H new ATOM 0 HD2 PHE B 22 -18.375 -7.201 -2.110 1.00 0.00 H new ATOM 0 HE1 PHE B 22 -17.061 -2.551 -1.186 1.00 0.00 H new ATOM 0 HE2 PHE B 22 -17.534 -6.582 0.113 1.00 0.00 H new ATOM 0 HZ PHE B 22 -16.870 -4.256 0.578 1.00 0.00 H new ATOM 1523 N LEU B 23 -15.825 -4.329 -5.616 1.00 0.00 N ATOM 1524 CA LEU B 23 -15.020 -3.207 -6.124 1.00 0.00 C ATOM 1525 C LEU B 23 -14.999 -3.255 -7.639 1.00 0.00 C ATOM 1526 O LEU B 23 -15.063 -2.238 -8.280 1.00 0.00 O ATOM 1527 CB LEU B 23 -13.562 -3.271 -5.578 1.00 0.00 C ATOM 1528 CG LEU B 23 -13.229 -2.516 -4.253 1.00 0.00 C ATOM 1529 CD1 LEU B 23 -13.324 -1.024 -4.435 1.00 0.00 C ATOM 1530 CD2 LEU B 23 -14.111 -2.942 -3.103 1.00 0.00 C ATOM 0 H LEU B 23 -15.313 -4.965 -5.004 1.00 0.00 H new ATOM 0 HA LEU B 23 -15.470 -2.274 -5.785 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -13.308 -4.321 -5.434 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -12.900 -2.886 -6.354 1.00 0.00 H new ATOM 0 HG LEU B 23 -12.202 -2.784 -4.004 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -13.086 -0.527 -3.494 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -12.618 -0.705 -5.202 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -14.336 -0.758 -4.740 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -13.835 -2.385 -2.207 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -15.153 -2.740 -3.350 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -13.982 -4.009 -2.921 1.00 0.00 H new ATOM 1542 N LEU B 24 -14.937 -4.452 -8.196 1.00 0.00 N ATOM 1543 CA LEU B 24 -15.006 -4.640 -9.644 1.00 0.00 C ATOM 1544 C LEU B 24 -16.377 -4.284 -10.164 1.00 0.00 C ATOM 1545 O LEU B 24 -16.498 -3.642 -11.188 1.00 0.00 O ATOM 1546 CB LEU B 24 -14.714 -6.063 -9.998 1.00 0.00 C ATOM 1547 CG LEU B 24 -13.375 -6.572 -9.574 1.00 0.00 C ATOM 1548 CD1 LEU B 24 -13.372 -8.053 -9.709 1.00 0.00 C ATOM 1549 CD2 LEU B 24 -12.264 -5.952 -10.408 1.00 0.00 C ATOM 0 H LEU B 24 -14.838 -5.318 -7.666 1.00 0.00 H new ATOM 0 HA LEU B 24 -14.263 -3.985 -10.100 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -15.481 -6.695 -9.550 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -14.800 -6.175 -11.079 1.00 0.00 H new ATOM 0 HG LEU B 24 -13.191 -6.294 -8.536 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -12.401 -8.444 -9.404 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -14.150 -8.478 -9.075 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -13.562 -8.324 -10.747 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -11.301 -6.341 -10.077 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -12.415 -6.202 -11.458 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -12.279 -4.869 -10.287 1.00 0.00 H new ATOM 1561 N TYR B 25 -17.406 -4.735 -9.459 1.00 0.00 N ATOM 1562 CA TYR B 25 -18.789 -4.425 -9.806 1.00 0.00 C ATOM 1563 C TYR B 25 -19.003 -2.928 -9.857 1.00 0.00 C ATOM 1564 O TYR B 25 -19.603 -2.397 -10.797 1.00 0.00 O ATOM 1565 CB TYR B 25 -19.752 -5.068 -8.796 1.00 0.00 C ATOM 1566 CG TYR B 25 -21.201 -4.596 -8.891 1.00 0.00 C ATOM 1567 CD1 TYR B 25 -21.947 -4.760 -10.053 1.00 0.00 C ATOM 1568 CD2 TYR B 25 -21.815 -3.982 -7.804 1.00 0.00 C ATOM 1569 CE1 TYR B 25 -23.258 -4.327 -10.125 1.00 0.00 C ATOM 1570 CE2 TYR B 25 -23.125 -3.553 -7.869 1.00 0.00 C ATOM 1571 CZ TYR B 25 -23.842 -3.729 -9.029 1.00 0.00 C ATOM 1572 OH TYR B 25 -25.157 -3.298 -9.096 1.00 0.00 O ATOM 0 H TYR B 25 -17.307 -5.325 -8.632 1.00 0.00 H new ATOM 0 HA TYR B 25 -18.995 -4.836 -10.794 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -19.729 -6.149 -8.933 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -19.386 -4.866 -7.789 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -21.495 -5.233 -10.912 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -21.255 -3.838 -6.891 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -23.822 -4.457 -11.037 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -23.585 -3.081 -7.013 1.00 0.00 H new ATOM 0 HH TYR B 25 -25.415 -2.900 -8.238 1.00 0.00 H new ATOM 1582 N LEU B 26 -18.515 -2.254 -8.867 1.00 0.00 N ATOM 1583 CA LEU B 26 -18.661 -0.841 -8.798 1.00 0.00 C ATOM 1584 C LEU B 26 -17.737 -0.174 -9.847 1.00 0.00 C ATOM 1585 O LEU B 26 -18.089 0.837 -10.425 1.00 0.00 O ATOM 1586 CB LEU B 26 -18.427 -0.353 -7.346 1.00 0.00 C ATOM 1587 CG LEU B 26 -19.148 0.946 -6.902 1.00 0.00 C ATOM 1588 CD1 LEU B 26 -18.712 2.164 -7.690 1.00 0.00 C ATOM 1589 CD2 LEU B 26 -20.658 0.767 -6.974 1.00 0.00 C ATOM 0 H LEU B 26 -18.006 -2.668 -8.086 1.00 0.00 H new ATOM 0 HA LEU B 26 -19.679 -0.544 -9.051 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -18.728 -1.153 -6.670 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -17.356 -0.207 -7.209 1.00 0.00 H new ATOM 0 HG LEU B 26 -18.858 1.129 -5.867 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -19.252 3.041 -7.333 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -17.641 2.319 -7.558 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -18.929 2.010 -8.747 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -21.149 1.688 -6.659 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -20.948 0.533 -7.998 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -20.960 -0.048 -6.316 1.00 0.00 H new ATOM 1601 N ASP B 27 -16.576 -0.776 -10.096 1.00 0.00 N ATOM 1602 CA ASP B 27 -15.621 -0.275 -11.103 1.00 0.00 C ATOM 1603 C ASP B 27 -16.219 -0.327 -12.497 1.00 0.00 C ATOM 1604 O ASP B 27 -16.083 0.615 -13.282 1.00 0.00 O ATOM 1605 CB ASP B 27 -14.334 -1.101 -11.106 1.00 0.00 C ATOM 1606 CG ASP B 27 -13.315 -0.577 -12.101 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -12.563 0.339 -11.772 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -13.253 -1.092 -13.248 1.00 0.00 O ATOM 0 H ASP B 27 -16.265 -1.619 -9.614 1.00 0.00 H new ATOM 0 HA ASP B 27 -15.396 0.757 -10.834 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -13.899 -1.095 -10.107 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.571 -2.138 -11.344 1.00 0.00 H new ATOM 1613 N GLU B 28 -16.879 -1.435 -12.802 1.00 0.00 N ATOM 1614 CA GLU B 28 -17.458 -1.644 -14.109 1.00 0.00 C ATOM 1615 C GLU B 28 -18.697 -0.783 -14.332 1.00 0.00 C ATOM 1616 O GLU B 28 -18.896 -0.261 -15.431 1.00 0.00 O ATOM 1617 CB GLU B 28 -17.770 -3.123 -14.378 1.00 0.00 C ATOM 1618 CG GLU B 28 -18.838 -3.725 -13.487 1.00 0.00 C ATOM 1619 CD GLU B 28 -19.272 -5.090 -13.928 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -20.103 -5.176 -14.849 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -18.822 -6.107 -13.338 1.00 0.00 O ATOM 0 H GLU B 28 -17.024 -2.206 -12.151 1.00 0.00 H new ATOM 0 HA GLU B 28 -16.701 -1.331 -14.828 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -18.082 -3.230 -15.417 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -16.852 -3.700 -14.260 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -18.461 -3.783 -12.466 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -19.704 -3.063 -13.470 1.00 0.00 H new ATOM 1628 N SER B 29 -19.522 -0.637 -13.305 1.00 0.00 N ATOM 1629 CA SER B 29 -20.711 0.181 -13.406 1.00 0.00 C ATOM 1630 C SER B 29 -20.313 1.660 -13.387 1.00 0.00 C ATOM 1631 O SER B 29 -20.880 2.490 -14.104 1.00 0.00 O ATOM 1632 CB SER B 29 -21.683 -0.167 -12.268 1.00 0.00 C ATOM 1633 OG SER B 29 -21.025 -0.150 -11.008 1.00 0.00 O ATOM 0 H SER B 29 -19.386 -1.076 -12.395 1.00 0.00 H new ATOM 0 HA SER B 29 -21.224 -0.018 -14.347 1.00 0.00 H new ATOM 0 HB2 SER B 29 -22.508 0.545 -12.260 1.00 0.00 H new ATOM 0 HB3 SER B 29 -22.114 -1.153 -12.443 1.00 0.00 H new ATOM 0 HG SER B 29 -20.696 -1.049 -10.799 1.00 0.00 H new ATOM 1639 N ASN B 30 -19.310 1.935 -12.567 1.00 0.00 N ATOM 1640 CA ASN B 30 -18.673 3.230 -12.380 1.00 0.00 C ATOM 1641 C ASN B 30 -19.682 4.297 -11.979 1.00 0.00 C ATOM 1642 O ASN B 30 -20.029 5.195 -12.751 1.00 0.00 O ATOM 1643 CB ASN B 30 -17.850 3.659 -13.600 1.00 0.00 C ATOM 1644 CG ASN B 30 -16.854 4.766 -13.294 1.00 0.00 C ATOM 1645 OD1 ASN B 30 -17.029 5.545 -12.366 1.00 0.00 O ATOM 1646 ND2 ASN B 30 -15.815 4.853 -14.087 1.00 0.00 N ATOM 0 H ASN B 30 -18.893 1.215 -11.977 1.00 0.00 H new ATOM 0 HA ASN B 30 -17.970 3.117 -11.555 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -17.313 2.794 -13.990 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -18.526 3.995 -14.386 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -15.121 5.586 -13.940 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -15.699 4.187 -14.851 1.00 0.00 H new ATOM 1653 N ALA B 31 -20.199 4.132 -10.795 1.00 0.00 N ATOM 1654 CA ALA B 31 -21.152 5.054 -10.214 1.00 0.00 C ATOM 1655 C ALA B 31 -20.521 6.400 -9.841 1.00 0.00 C ATOM 1656 O ALA B 31 -21.211 7.411 -9.740 1.00 0.00 O ATOM 1657 CB ALA B 31 -21.831 4.425 -9.010 1.00 0.00 C ATOM 0 H ALA B 31 -19.971 3.342 -10.191 1.00 0.00 H new ATOM 0 HA ALA B 31 -21.901 5.262 -10.978 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -22.544 5.131 -8.585 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -22.355 3.521 -9.319 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -21.081 4.171 -8.261 1.00 0.00 H new ATOM 1663 N LEU B 32 -19.220 6.392 -9.636 1.00 0.00 N ATOM 1664 CA LEU B 32 -18.519 7.538 -9.061 1.00 0.00 C ATOM 1665 C LEU B 32 -17.896 8.455 -10.111 1.00 0.00 C ATOM 1666 O LEU B 32 -17.479 9.569 -9.800 1.00 0.00 O ATOM 1667 CB LEU B 32 -17.453 7.014 -8.111 1.00 0.00 C ATOM 1668 CG LEU B 32 -17.964 5.993 -7.094 1.00 0.00 C ATOM 1669 CD1 LEU B 32 -16.840 5.459 -6.251 1.00 0.00 C ATOM 1670 CD2 LEU B 32 -19.051 6.586 -6.219 1.00 0.00 C ATOM 0 H LEU B 32 -18.616 5.601 -9.859 1.00 0.00 H new ATOM 0 HA LEU B 32 -19.249 8.151 -8.531 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -16.654 6.558 -8.696 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -17.015 7.856 -7.575 1.00 0.00 H new ATOM 0 HG LEU B 32 -18.395 5.162 -7.652 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -17.233 4.735 -5.537 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -16.104 4.974 -6.892 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -16.367 6.280 -5.712 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -19.394 5.836 -5.506 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -18.655 7.446 -5.679 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -19.887 6.903 -6.842 1.00 0.00 H new ATOM 1682 N GLY B 33 -17.791 7.972 -11.322 1.00 0.00 N ATOM 1683 CA GLY B 33 -17.248 8.763 -12.408 1.00 0.00 C ATOM 1684 C GLY B 33 -15.741 8.632 -12.532 1.00 0.00 C ATOM 1685 O GLY B 33 -15.129 9.244 -13.408 1.00 0.00 O ATOM 0 H GLY B 33 -18.075 7.029 -11.587 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.714 8.455 -13.344 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -17.506 9.811 -12.253 1.00 0.00 H new ATOM 1689 N LYS B 34 -15.146 7.809 -11.685 1.00 0.00 N ATOM 1690 CA LYS B 34 -13.705 7.571 -11.687 1.00 0.00 C ATOM 1691 C LYS B 34 -13.463 6.097 -11.445 1.00 0.00 C ATOM 1692 O LYS B 34 -14.243 5.454 -10.735 1.00 0.00 O ATOM 1693 CB LYS B 34 -12.943 8.338 -10.558 1.00 0.00 C ATOM 1694 CG LYS B 34 -13.013 9.874 -10.535 1.00 0.00 C ATOM 1695 CD LYS B 34 -14.347 10.388 -10.026 1.00 0.00 C ATOM 1696 CE LYS B 34 -14.361 11.897 -9.903 1.00 0.00 C ATOM 1697 NZ LYS B 34 -15.689 12.392 -9.491 1.00 0.00 N ATOM 0 H LYS B 34 -15.649 7.282 -10.971 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.335 7.921 -12.651 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -13.317 7.975 -9.601 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -11.892 8.055 -10.617 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -12.213 10.261 -9.904 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -12.839 10.257 -11.540 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -15.140 10.072 -10.703 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -14.561 9.943 -9.054 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -13.612 12.211 -9.176 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -14.085 12.344 -10.858 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -15.995 13.145 -10.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -16.375 11.611 -9.520 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -15.634 12.769 -8.523 1.00 0.00 H new ATOM 1711 N LYS B 35 -12.412 5.556 -12.019 1.00 0.00 N ATOM 1712 CA LYS B 35 -12.030 4.196 -11.720 1.00 0.00 C ATOM 1713 C LYS B 35 -11.065 4.182 -10.570 1.00 0.00 C ATOM 1714 O LYS B 35 -9.893 4.540 -10.695 1.00 0.00 O ATOM 1715 CB LYS B 35 -11.491 3.425 -12.923 1.00 0.00 C ATOM 1716 CG LYS B 35 -12.552 3.009 -13.928 1.00 0.00 C ATOM 1717 CD LYS B 35 -11.954 2.093 -14.982 1.00 0.00 C ATOM 1718 CE LYS B 35 -13.013 1.493 -15.890 1.00 0.00 C ATOM 1719 NZ LYS B 35 -14.017 0.698 -15.138 1.00 0.00 N ATOM 0 H LYS B 35 -11.811 6.033 -12.691 1.00 0.00 H new ATOM 0 HA LYS B 35 -12.938 3.665 -11.436 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -10.748 4.041 -13.431 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -10.976 2.533 -12.566 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -13.368 2.500 -13.415 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -12.977 3.893 -14.404 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -11.238 2.653 -15.583 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -11.401 1.291 -14.492 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -13.518 2.292 -16.432 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -12.533 0.857 -16.634 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -14.525 0.071 -15.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -13.536 0.126 -14.415 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -14.694 1.340 -14.678 1.00 0.00 H new ATOM 1733 N PHE B 36 -11.594 3.799 -9.457 1.00 0.00 N ATOM 1734 CA PHE B 36 -10.906 3.777 -8.189 1.00 0.00 C ATOM 1735 C PHE B 36 -9.926 2.608 -8.073 1.00 0.00 C ATOM 1736 O PHE B 36 -8.775 2.816 -7.710 1.00 0.00 O ATOM 1737 CB PHE B 36 -11.949 3.774 -7.047 1.00 0.00 C ATOM 1738 CG PHE B 36 -13.101 2.854 -7.322 1.00 0.00 C ATOM 1739 CD1 PHE B 36 -13.038 1.518 -6.992 1.00 0.00 C ATOM 1740 CD2 PHE B 36 -14.223 3.327 -7.969 1.00 0.00 C ATOM 1741 CE1 PHE B 36 -14.071 0.669 -7.307 1.00 0.00 C ATOM 1742 CE2 PHE B 36 -15.254 2.493 -8.273 1.00 0.00 C ATOM 1743 CZ PHE B 36 -15.175 1.163 -7.945 1.00 0.00 C ATOM 0 H PHE B 36 -12.560 3.477 -9.392 1.00 0.00 H new ATOM 0 HA PHE B 36 -10.295 4.676 -8.112 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -11.464 3.476 -6.118 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -12.324 4.787 -6.900 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -12.168 1.134 -6.480 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -14.284 4.371 -8.237 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -14.012 -0.379 -7.053 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -16.132 2.877 -8.771 1.00 0.00 H new ATOM 0 HZ PHE B 36 -15.991 0.501 -8.193 1.00 0.00 H new ATOM 1753 N ILE B 37 -10.363 1.397 -8.400 1.00 0.00 N ATOM 1754 CA ILE B 37 -9.486 0.261 -8.301 1.00 0.00 C ATOM 1755 C ILE B 37 -8.516 0.275 -9.474 1.00 0.00 C ATOM 1756 O ILE B 37 -8.882 0.056 -10.630 1.00 0.00 O ATOM 1757 CB ILE B 37 -10.255 -1.139 -8.018 1.00 0.00 C ATOM 1758 CG1 ILE B 37 -9.372 -2.402 -8.014 1.00 0.00 C ATOM 1759 CG2 ILE B 37 -11.433 -1.386 -8.903 1.00 0.00 C ATOM 1760 CD1 ILE B 37 -8.960 -2.905 -9.393 1.00 0.00 C ATOM 0 H ILE B 37 -11.306 1.189 -8.730 1.00 0.00 H new ATOM 0 HA ILE B 37 -8.880 0.348 -7.399 1.00 0.00 H new ATOM 0 HB ILE B 37 -10.600 -0.976 -6.997 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -8.472 -2.196 -7.435 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -9.907 -3.199 -7.498 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -11.887 -2.343 -8.646 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -12.164 -0.589 -8.767 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -11.109 -1.407 -9.943 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -8.342 -3.796 -9.285 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -9.850 -3.149 -9.972 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -8.393 -2.130 -9.909 1.00 0.00 H new ATOM 1772 N ILE B 38 -7.301 0.642 -9.160 1.00 0.00 N ATOM 1773 CA ILE B 38 -6.244 0.776 -10.121 1.00 0.00 C ATOM 1774 C ILE B 38 -5.716 -0.583 -10.483 1.00 0.00 C ATOM 1775 O ILE B 38 -5.655 -0.952 -11.661 1.00 0.00 O ATOM 1776 CB ILE B 38 -5.101 1.654 -9.558 1.00 0.00 C ATOM 1777 CG1 ILE B 38 -5.609 3.083 -9.275 1.00 0.00 C ATOM 1778 CG2 ILE B 38 -3.909 1.663 -10.510 1.00 0.00 C ATOM 1779 CD1 ILE B 38 -4.592 3.991 -8.613 1.00 0.00 C ATOM 0 H ILE B 38 -7.015 0.861 -8.206 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.642 1.260 -11.013 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.765 1.226 -8.614 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.924 3.536 -10.215 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -6.492 3.022 -8.639 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -3.117 2.286 -10.095 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.540 0.646 -10.640 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -4.218 2.064 -11.476 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -5.033 4.975 -8.451 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -4.293 3.565 -7.655 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -3.717 4.087 -9.256 1.00 0.00 H new ATOM 1791 N GLN B 39 -5.352 -1.331 -9.485 1.00 0.00 N ATOM 1792 CA GLN B 39 -4.884 -2.646 -9.711 1.00 0.00 C ATOM 1793 C GLN B 39 -5.230 -3.548 -8.573 1.00 0.00 C ATOM 1794 O GLN B 39 -5.557 -3.087 -7.462 1.00 0.00 O ATOM 1795 CB GLN B 39 -3.393 -2.760 -10.070 1.00 0.00 C ATOM 1796 CG GLN B 39 -2.400 -2.399 -8.983 1.00 0.00 C ATOM 1797 CD GLN B 39 -1.199 -3.348 -9.023 1.00 0.00 C ATOM 1798 OE1 GLN B 39 -0.841 -3.878 -10.073 1.00 0.00 O ATOM 1799 NE2 GLN B 39 -0.582 -3.575 -7.897 1.00 0.00 N ATOM 0 H GLN B 39 -5.374 -1.043 -8.507 1.00 0.00 H new ATOM 0 HA GLN B 39 -5.413 -2.973 -10.606 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -3.196 -3.785 -10.383 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -3.201 -2.121 -10.932 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -2.064 -1.371 -9.115 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -2.883 -2.454 -8.007 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -0.900 -3.122 -7.041 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.219 -4.206 -7.873 1.00 0.00 H new ATOM 1808 N ASP B 40 -5.248 -4.801 -8.877 1.00 0.00 N ATOM 1809 CA ASP B 40 -5.483 -5.866 -7.937 1.00 0.00 C ATOM 1810 C ASP B 40 -4.113 -6.214 -7.356 1.00 0.00 C ATOM 1811 O ASP B 40 -3.112 -6.167 -8.083 1.00 0.00 O ATOM 1812 CB ASP B 40 -5.969 -7.070 -8.718 1.00 0.00 C ATOM 1813 CG ASP B 40 -6.544 -8.159 -7.875 1.00 0.00 C ATOM 1814 OD1 ASP B 40 -5.872 -8.697 -7.004 1.00 0.00 O ATOM 1815 OD2 ASP B 40 -7.740 -8.430 -8.034 1.00 0.00 O ATOM 0 H ASP B 40 -5.093 -5.135 -9.828 1.00 0.00 H new ATOM 0 HA ASP B 40 -6.204 -5.590 -7.168 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -6.724 -6.744 -9.433 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -5.137 -7.474 -9.295 1.00 0.00 H new ATOM 1820 N ILE B 41 -4.030 -6.520 -6.091 1.00 0.00 N ATOM 1821 CA ILE B 41 -2.740 -6.784 -5.499 1.00 0.00 C ATOM 1822 C ILE B 41 -2.865 -8.006 -4.633 1.00 0.00 C ATOM 1823 O ILE B 41 -3.890 -8.231 -4.024 1.00 0.00 O ATOM 1824 CB ILE B 41 -2.134 -5.574 -4.646 1.00 0.00 C ATOM 1825 CG1 ILE B 41 -2.498 -4.231 -5.220 1.00 0.00 C ATOM 1826 CG2 ILE B 41 -0.621 -5.636 -4.549 1.00 0.00 C ATOM 1827 CD1 ILE B 41 -3.878 -3.830 -4.887 1.00 0.00 C ATOM 0 H ILE B 41 -4.824 -6.593 -5.455 1.00 0.00 H new ATOM 0 HA ILE B 41 -2.038 -6.932 -6.320 1.00 0.00 H new ATOM 0 HB ILE B 41 -2.573 -5.685 -3.654 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -1.804 -3.479 -4.845 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -2.383 -4.259 -6.304 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -0.259 -4.793 -3.960 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -0.325 -6.568 -4.068 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -0.190 -5.591 -5.549 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -4.089 -2.854 -5.325 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -4.577 -4.566 -5.285 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -3.989 -3.773 -3.804 1.00 0.00 H new ATOM 1839 N ASP B 42 -1.832 -8.775 -4.648 1.00 0.00 N ATOM 1840 CA ASP B 42 -1.626 -10.042 -3.952 1.00 0.00 C ATOM 1841 C ASP B 42 -2.598 -11.148 -4.308 1.00 0.00 C ATOM 1842 O ASP B 42 -2.190 -12.167 -4.881 1.00 0.00 O ATOM 1843 CB ASP B 42 -1.344 -9.942 -2.431 1.00 0.00 C ATOM 1844 CG ASP B 42 -2.496 -9.580 -1.567 1.00 0.00 C ATOM 1845 OD1 ASP B 42 -3.200 -10.484 -1.116 1.00 0.00 O ATOM 1846 OD2 ASP B 42 -2.709 -8.402 -1.314 1.00 0.00 O ATOM 0 H ASP B 42 -1.012 -8.524 -5.201 1.00 0.00 H new ATOM 0 HA ASP B 42 -0.675 -10.362 -4.379 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -0.952 -10.901 -2.093 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -0.557 -9.204 -2.278 1.00 0.00 H new ATOM 1851 N ASP B 43 -3.842 -10.907 -4.048 1.00 0.00 N ATOM 1852 CA ASP B 43 -4.952 -11.853 -4.179 1.00 0.00 C ATOM 1853 C ASP B 43 -6.060 -11.266 -3.370 1.00 0.00 C ATOM 1854 O ASP B 43 -7.251 -11.413 -3.672 1.00 0.00 O ATOM 1855 CB ASP B 43 -4.599 -13.235 -3.561 1.00 0.00 C ATOM 1856 CG ASP B 43 -5.697 -14.276 -3.705 1.00 0.00 C ATOM 1857 OD1 ASP B 43 -5.743 -14.961 -4.759 1.00 0.00 O ATOM 1858 OD2 ASP B 43 -6.492 -14.471 -2.762 1.00 0.00 O ATOM 0 H ASP B 43 -4.151 -9.993 -3.716 1.00 0.00 H new ATOM 0 HA ASP B 43 -5.200 -12.006 -5.229 1.00 0.00 H new ATOM 0 HB2 ASP B 43 -3.692 -13.611 -4.033 1.00 0.00 H new ATOM 0 HB3 ASP B 43 -4.376 -13.102 -2.502 1.00 0.00 H new ATOM 1863 N THR B 44 -5.640 -10.519 -2.376 1.00 0.00 N ATOM 1864 CA THR B 44 -6.524 -9.983 -1.398 1.00 0.00 C ATOM 1865 C THR B 44 -6.677 -8.460 -1.515 1.00 0.00 C ATOM 1866 O THR B 44 -7.742 -7.923 -1.204 1.00 0.00 O ATOM 1867 CB THR B 44 -5.954 -10.301 -0.011 1.00 0.00 C ATOM 1868 OG1 THR B 44 -5.343 -11.601 -0.050 1.00 0.00 O ATOM 1869 CG2 THR B 44 -7.032 -10.312 1.032 1.00 0.00 C ATOM 0 H THR B 44 -4.661 -10.270 -2.232 1.00 0.00 H new ATOM 0 HA THR B 44 -7.505 -10.431 -1.553 1.00 0.00 H new ATOM 0 HB THR B 44 -5.227 -9.531 0.248 1.00 0.00 H new ATOM 0 HG1 THR B 44 -4.438 -11.526 -0.419 1.00 0.00 H new ATOM 0 HG21 THR B 44 -6.595 -10.541 2.004 1.00 0.00 H new ATOM 0 HG22 THR B 44 -7.511 -9.334 1.070 1.00 0.00 H new ATOM 0 HG23 THR B 44 -7.774 -11.070 0.780 1.00 0.00 H new ATOM 1877 N HIS B 45 -5.648 -7.750 -1.968 1.00 0.00 N ATOM 1878 CA HIS B 45 -5.731 -6.289 -1.905 1.00 0.00 C ATOM 1879 C HIS B 45 -6.355 -5.620 -3.137 1.00 0.00 C ATOM 1880 O HIS B 45 -6.396 -6.165 -4.255 1.00 0.00 O ATOM 1881 CB HIS B 45 -4.374 -5.655 -1.637 1.00 0.00 C ATOM 1882 CG HIS B 45 -3.928 -5.594 -0.208 1.00 0.00 C ATOM 1883 ND1 HIS B 45 -3.145 -6.521 0.352 1.00 0.00 N ATOM 1884 CD2 HIS B 45 -4.082 -4.650 0.719 1.00 0.00 C ATOM 1885 CE1 HIS B 45 -2.817 -6.171 1.569 1.00 0.00 C ATOM 1886 NE2 HIS B 45 -3.369 -5.020 1.813 1.00 0.00 N ATOM 0 H HIS B 45 -4.789 -8.133 -2.363 1.00 0.00 H new ATOM 0 HA HIS B 45 -6.407 -6.108 -1.069 1.00 0.00 H new ATOM 0 HB2 HIS B 45 -3.624 -6.206 -2.204 1.00 0.00 H new ATOM 0 HB3 HIS B 45 -4.390 -4.639 -2.032 1.00 0.00 H new ATOM 0 HD1 HIS B 45 -2.845 -7.382 -0.106 1.00 0.00 H new ATOM 0 HD2 HIS B 45 -4.670 -3.750 0.618 1.00 0.00 H new ATOM 0 HE1 HIS B 45 -2.198 -6.737 2.249 1.00 0.00 H new ATOM 1895 N VAL B 46 -6.817 -4.414 -2.905 1.00 0.00 N ATOM 1896 CA VAL B 46 -7.336 -3.502 -3.914 1.00 0.00 C ATOM 1897 C VAL B 46 -6.547 -2.209 -3.746 1.00 0.00 C ATOM 1898 O VAL B 46 -6.311 -1.782 -2.600 1.00 0.00 O ATOM 1899 CB VAL B 46 -8.847 -3.184 -3.657 1.00 0.00 C ATOM 1900 CG1 VAL B 46 -9.336 -2.023 -4.509 1.00 0.00 C ATOM 1901 CG2 VAL B 46 -9.702 -4.389 -3.930 1.00 0.00 C ATOM 0 H VAL B 46 -6.845 -4.017 -1.966 1.00 0.00 H new ATOM 0 HA VAL B 46 -7.242 -3.939 -4.908 1.00 0.00 H new ATOM 0 HB VAL B 46 -8.934 -2.904 -2.607 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -10.389 -1.836 -4.299 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -8.755 -1.130 -4.275 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -9.214 -2.269 -5.564 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -10.747 -4.143 -3.744 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -9.580 -4.694 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -9.400 -5.206 -3.275 1.00 0.00 H new ATOM 1911 N PHE B 47 -6.082 -1.636 -4.834 1.00 0.00 N ATOM 1912 CA PHE B 47 -5.365 -0.400 -4.750 1.00 0.00 C ATOM 1913 C PHE B 47 -6.192 0.667 -5.373 1.00 0.00 C ATOM 1914 O PHE B 47 -6.629 0.539 -6.520 1.00 0.00 O ATOM 1915 CB PHE B 47 -3.991 -0.472 -5.434 1.00 0.00 C ATOM 1916 CG PHE B 47 -3.109 0.663 -5.095 1.00 0.00 C ATOM 1917 CD1 PHE B 47 -2.519 0.712 -3.849 1.00 0.00 C ATOM 1918 CD2 PHE B 47 -2.856 1.674 -5.994 1.00 0.00 C ATOM 1919 CE1 PHE B 47 -1.698 1.741 -3.499 1.00 0.00 C ATOM 1920 CE2 PHE B 47 -2.032 2.712 -5.643 1.00 0.00 C ATOM 1921 CZ PHE B 47 -1.456 2.741 -4.394 1.00 0.00 C ATOM 0 H PHE B 47 -6.190 -2.009 -5.777 1.00 0.00 H new ATOM 0 HA PHE B 47 -5.179 -0.180 -3.699 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.500 -1.402 -5.149 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -4.132 -0.503 -6.514 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.711 -0.079 -3.139 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.306 1.650 -6.975 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -1.242 1.765 -2.520 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -1.835 3.507 -6.347 1.00 0.00 H new ATOM 0 HZ PHE B 47 -0.808 3.561 -4.121 1.00 0.00 H new ATOM 1931 N VAL B 48 -6.419 1.674 -4.631 1.00 0.00 N ATOM 1932 CA VAL B 48 -7.181 2.799 -5.043 1.00 0.00 C ATOM 1933 C VAL B 48 -6.389 4.024 -4.637 1.00 0.00 C ATOM 1934 O VAL B 48 -5.553 3.927 -3.765 1.00 0.00 O ATOM 1935 CB VAL B 48 -8.631 2.750 -4.407 1.00 0.00 C ATOM 1936 CG1 VAL B 48 -8.595 2.416 -2.924 1.00 0.00 C ATOM 1937 CG2 VAL B 48 -9.379 4.049 -4.622 1.00 0.00 C ATOM 0 H VAL B 48 -6.068 1.749 -3.676 1.00 0.00 H new ATOM 0 HA VAL B 48 -7.343 2.815 -6.121 1.00 0.00 H new ATOM 0 HB VAL B 48 -9.163 1.951 -4.923 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -9.612 2.394 -2.531 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -8.129 1.441 -2.782 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -8.018 3.174 -2.394 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -10.369 3.977 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -8.828 4.867 -4.158 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -9.479 4.239 -5.691 1.00 0.00 H new ATOM 1947 N ILE B 49 -6.565 5.135 -5.290 1.00 0.00 N ATOM 1948 CA ILE B 49 -5.800 6.299 -4.908 1.00 0.00 C ATOM 1949 C ILE B 49 -6.411 6.925 -3.648 1.00 0.00 C ATOM 1950 O ILE B 49 -7.641 6.995 -3.508 1.00 0.00 O ATOM 1951 CB ILE B 49 -5.639 7.312 -6.064 1.00 0.00 C ATOM 1952 CG1 ILE B 49 -4.641 8.419 -5.703 1.00 0.00 C ATOM 1953 CG2 ILE B 49 -6.974 7.886 -6.501 1.00 0.00 C ATOM 1954 CD1 ILE B 49 -4.451 9.459 -6.794 1.00 0.00 C ATOM 0 H ILE B 49 -7.211 5.266 -6.069 1.00 0.00 H new ATOM 0 HA ILE B 49 -4.784 5.981 -4.672 1.00 0.00 H new ATOM 0 HB ILE B 49 -5.231 6.768 -6.916 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -4.980 8.918 -4.795 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -3.676 7.965 -5.476 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.817 8.593 -7.315 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -7.623 7.079 -6.842 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.442 8.398 -5.661 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -3.731 10.207 -6.462 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -4.081 8.975 -7.698 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.405 9.942 -7.006 1.00 0.00 H new ATOM 1966 N ALA B 50 -5.554 7.375 -2.752 1.00 0.00 N ATOM 1967 CA ALA B 50 -5.961 7.800 -1.427 1.00 0.00 C ATOM 1968 C ALA B 50 -6.893 9.002 -1.439 1.00 0.00 C ATOM 1969 O ALA B 50 -7.842 9.061 -0.672 1.00 0.00 O ATOM 1970 CB ALA B 50 -4.750 8.088 -0.562 1.00 0.00 C ATOM 0 H ALA B 50 -4.552 7.456 -2.924 1.00 0.00 H new ATOM 0 HA ALA B 50 -6.525 6.970 -1.003 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -5.077 8.405 0.428 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -4.144 7.186 -0.472 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -4.156 8.880 -1.019 1.00 0.00 H new ATOM 1976 N GLU B 51 -6.636 9.936 -2.324 1.00 0.00 N ATOM 1977 CA GLU B 51 -7.402 11.169 -2.387 1.00 0.00 C ATOM 1978 C GLU B 51 -8.909 10.936 -2.632 1.00 0.00 C ATOM 1979 O GLU B 51 -9.755 11.627 -2.048 1.00 0.00 O ATOM 1980 CB GLU B 51 -6.802 12.114 -3.419 1.00 0.00 C ATOM 1981 CG GLU B 51 -7.482 13.462 -3.488 1.00 0.00 C ATOM 1982 CD GLU B 51 -6.756 14.413 -4.376 1.00 0.00 C ATOM 1983 OE1 GLU B 51 -6.989 14.400 -5.588 1.00 0.00 O ATOM 1984 OE2 GLU B 51 -5.929 15.205 -3.870 1.00 0.00 O ATOM 0 H GLU B 51 -5.894 9.868 -3.020 1.00 0.00 H new ATOM 0 HA GLU B 51 -7.335 11.638 -1.405 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -5.747 12.262 -3.190 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.852 11.643 -4.401 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -8.502 13.335 -3.851 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.551 13.884 -2.485 1.00 0.00 H new ATOM 1991 N LEU B 52 -9.255 9.954 -3.443 1.00 0.00 N ATOM 1992 CA LEU B 52 -10.662 9.715 -3.694 1.00 0.00 C ATOM 1993 C LEU B 52 -11.211 8.525 -2.922 1.00 0.00 C ATOM 1994 O LEU B 52 -12.351 8.148 -3.100 1.00 0.00 O ATOM 1995 CB LEU B 52 -11.041 9.708 -5.210 1.00 0.00 C ATOM 1996 CG LEU B 52 -10.320 8.739 -6.166 1.00 0.00 C ATOM 1997 CD1 LEU B 52 -10.636 7.280 -5.874 1.00 0.00 C ATOM 1998 CD2 LEU B 52 -10.666 9.069 -7.602 1.00 0.00 C ATOM 0 H LEU B 52 -8.607 9.329 -3.924 1.00 0.00 H new ATOM 0 HA LEU B 52 -11.177 10.586 -3.289 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -12.109 9.501 -5.279 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -10.887 10.718 -5.590 1.00 0.00 H new ATOM 0 HG LEU B 52 -9.250 8.872 -6.005 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -10.100 6.644 -6.579 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -10.326 7.037 -4.858 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -11.708 7.112 -5.976 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -10.151 8.378 -8.269 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -11.743 8.978 -7.747 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -10.354 10.089 -7.826 1.00 0.00 H new ATOM 2010 N VAL B 53 -10.425 7.972 -2.008 1.00 0.00 N ATOM 2011 CA VAL B 53 -10.915 6.864 -1.174 1.00 0.00 C ATOM 2012 C VAL B 53 -12.054 7.371 -0.290 1.00 0.00 C ATOM 2013 O VAL B 53 -12.921 6.623 0.128 1.00 0.00 O ATOM 2014 CB VAL B 53 -9.825 6.111 -0.348 1.00 0.00 C ATOM 2015 CG1 VAL B 53 -9.372 6.889 0.868 1.00 0.00 C ATOM 2016 CG2 VAL B 53 -10.301 4.717 0.040 1.00 0.00 C ATOM 0 H VAL B 53 -9.464 8.259 -1.821 1.00 0.00 H new ATOM 0 HA VAL B 53 -11.278 6.099 -1.860 1.00 0.00 H new ATOM 0 HB VAL B 53 -8.954 6.011 -0.996 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -8.614 6.318 1.404 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -8.951 7.844 0.553 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.224 7.067 1.524 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -9.523 4.214 0.615 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -11.205 4.796 0.644 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -10.516 4.142 -0.861 1.00 0.00 H new ATOM 2026 N ASN B 54 -12.003 8.663 0.001 1.00 0.00 N ATOM 2027 CA ASN B 54 -13.042 9.354 0.754 1.00 0.00 C ATOM 2028 C ASN B 54 -14.434 9.096 0.137 1.00 0.00 C ATOM 2029 O ASN B 54 -15.408 8.896 0.866 1.00 0.00 O ATOM 2030 CB ASN B 54 -12.768 10.861 0.756 1.00 0.00 C ATOM 2031 CG ASN B 54 -13.824 11.651 1.508 1.00 0.00 C ATOM 2032 OD1 ASN B 54 -14.393 11.181 2.483 1.00 0.00 O ATOM 2033 ND2 ASN B 54 -14.115 12.831 1.052 1.00 0.00 N ATOM 0 H ASN B 54 -11.232 9.268 -0.281 1.00 0.00 H new ATOM 0 HA ASN B 54 -13.031 8.972 1.775 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -11.793 11.048 1.206 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -12.718 11.218 -0.273 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -14.835 13.391 1.509 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -13.624 13.198 0.237 1.00 0.00 H new ATOM 2040 N VAL B 55 -14.522 9.038 -1.208 1.00 0.00 N ATOM 2041 CA VAL B 55 -15.811 8.771 -1.832 1.00 0.00 C ATOM 2042 C VAL B 55 -16.204 7.331 -1.611 1.00 0.00 C ATOM 2043 O VAL B 55 -17.353 7.011 -1.424 1.00 0.00 O ATOM 2044 CB VAL B 55 -15.931 9.171 -3.335 1.00 0.00 C ATOM 2045 CG1 VAL B 55 -15.607 10.626 -3.531 1.00 0.00 C ATOM 2046 CG2 VAL B 55 -15.101 8.311 -4.265 1.00 0.00 C ATOM 0 H VAL B 55 -13.742 9.168 -1.852 1.00 0.00 H new ATOM 0 HA VAL B 55 -16.516 9.434 -1.331 1.00 0.00 H new ATOM 0 HB VAL B 55 -16.972 8.993 -3.606 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -15.698 10.880 -4.587 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -16.300 11.235 -2.950 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -14.587 10.820 -3.198 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -15.237 8.650 -5.292 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -14.049 8.391 -3.992 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -15.419 7.272 -4.181 1.00 0.00 H new ATOM 2056 N LEU B 56 -15.226 6.479 -1.599 1.00 0.00 N ATOM 2057 CA LEU B 56 -15.433 5.084 -1.287 1.00 0.00 C ATOM 2058 C LEU B 56 -15.963 4.932 0.123 1.00 0.00 C ATOM 2059 O LEU B 56 -16.894 4.195 0.337 1.00 0.00 O ATOM 2060 CB LEU B 56 -14.155 4.248 -1.506 1.00 0.00 C ATOM 2061 CG LEU B 56 -13.885 3.748 -2.940 1.00 0.00 C ATOM 2062 CD1 LEU B 56 -14.892 2.694 -3.308 1.00 0.00 C ATOM 2063 CD2 LEU B 56 -13.980 4.871 -3.945 1.00 0.00 C ATOM 0 H LEU B 56 -14.257 6.724 -1.804 1.00 0.00 H new ATOM 0 HA LEU B 56 -16.181 4.695 -1.977 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -13.300 4.845 -1.189 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -14.200 3.381 -0.847 1.00 0.00 H new ATOM 0 HG LEU B 56 -12.875 3.340 -2.962 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -14.698 2.343 -4.322 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -14.814 1.858 -2.613 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -15.896 3.116 -3.256 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -13.784 4.482 -4.944 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -14.980 5.304 -3.914 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -13.245 5.639 -3.704 1.00 0.00 H new ATOM 2075 N GLN B 57 -15.408 5.684 1.064 1.00 0.00 N ATOM 2076 CA GLN B 57 -15.867 5.638 2.445 1.00 0.00 C ATOM 2077 C GLN B 57 -17.313 5.959 2.614 1.00 0.00 C ATOM 2078 O GLN B 57 -18.055 5.220 3.292 1.00 0.00 O ATOM 2079 CB GLN B 57 -15.061 6.519 3.320 1.00 0.00 C ATOM 2080 CG GLN B 57 -14.184 5.700 4.196 1.00 0.00 C ATOM 2081 CD GLN B 57 -13.147 4.933 3.435 1.00 0.00 C ATOM 2082 OE1 GLN B 57 -12.026 5.407 3.225 1.00 0.00 O ATOM 2083 NE2 GLN B 57 -13.522 3.777 2.982 1.00 0.00 N ATOM 0 H GLN B 57 -14.639 6.333 0.896 1.00 0.00 H new ATOM 0 HA GLN B 57 -15.731 4.599 2.746 1.00 0.00 H new ATOM 0 HB2 GLN B 57 -14.456 7.193 2.713 1.00 0.00 H new ATOM 0 HB3 GLN B 57 -15.718 7.141 3.928 1.00 0.00 H new ATOM 0 HG2 GLN B 57 -13.690 6.351 4.917 1.00 0.00 H new ATOM 0 HG3 GLN B 57 -14.798 5.003 4.766 1.00 0.00 H new ATOM 0 HE21 GLN B 57 -14.460 3.430 3.184 1.00 0.00 H new ATOM 0 HE22 GLN B 57 -12.879 3.215 2.424 1.00 0.00 H new ATOM 2092 N GLU B 58 -17.743 7.000 1.968 1.00 0.00 N ATOM 2093 CA GLU B 58 -19.113 7.404 2.078 1.00 0.00 C ATOM 2094 C GLU B 58 -20.034 6.439 1.362 1.00 0.00 C ATOM 2095 O GLU B 58 -21.117 6.158 1.835 1.00 0.00 O ATOM 2096 CB GLU B 58 -19.344 8.832 1.592 1.00 0.00 C ATOM 2097 CG GLU B 58 -18.653 9.113 0.279 1.00 0.00 C ATOM 2098 CD GLU B 58 -18.992 10.420 -0.349 1.00 0.00 C ATOM 2099 OE1 GLU B 58 -18.783 11.479 0.286 1.00 0.00 O ATOM 2100 OE2 GLU B 58 -19.459 10.410 -1.496 1.00 0.00 O ATOM 0 H GLU B 58 -17.168 7.584 1.361 1.00 0.00 H new ATOM 0 HA GLU B 58 -19.354 7.384 3.141 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -20.414 9.006 1.481 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -18.984 9.532 2.346 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -17.575 9.073 0.438 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -18.901 8.316 -0.422 1.00 0.00 H new ATOM 2107 N ARG B 59 -19.601 5.923 0.236 1.00 0.00 N ATOM 2108 CA ARG B 59 -20.427 5.007 -0.513 1.00 0.00 C ATOM 2109 C ARG B 59 -20.528 3.659 0.195 1.00 0.00 C ATOM 2110 O ARG B 59 -21.593 3.081 0.288 1.00 0.00 O ATOM 2111 CB ARG B 59 -19.964 4.879 -1.971 1.00 0.00 C ATOM 2112 CG ARG B 59 -19.893 6.221 -2.691 1.00 0.00 C ATOM 2113 CD ARG B 59 -21.186 7.023 -2.644 1.00 0.00 C ATOM 2114 NE ARG B 59 -20.940 8.438 -2.959 1.00 0.00 N ATOM 2115 CZ ARG B 59 -21.380 9.107 -4.024 1.00 0.00 C ATOM 2116 NH1 ARG B 59 -22.066 8.494 -4.981 1.00 0.00 N ATOM 2117 NH2 ARG B 59 -21.116 10.393 -4.128 1.00 0.00 N ATOM 0 H ARG B 59 -18.690 6.120 -0.178 1.00 0.00 H new ATOM 0 HA ARG B 59 -21.434 5.421 -0.554 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -18.982 4.407 -1.995 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -20.647 4.220 -2.507 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -19.093 6.816 -2.249 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -19.623 6.048 -3.733 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -21.902 6.608 -3.354 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -21.634 6.940 -1.654 1.00 0.00 H new ATOM 0 HE ARG B 59 -20.373 8.962 -2.292 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -22.264 7.496 -4.908 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -22.396 9.021 -5.790 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -20.581 10.864 -3.399 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -21.447 10.918 -4.938 1.00 0.00 H new ATOM 2131 N VAL B 60 -19.439 3.198 0.744 1.00 0.00 N ATOM 2132 CA VAL B 60 -19.437 1.953 1.482 1.00 0.00 C ATOM 2133 C VAL B 60 -20.363 2.049 2.709 1.00 0.00 C ATOM 2134 O VAL B 60 -21.134 1.135 2.989 1.00 0.00 O ATOM 2135 CB VAL B 60 -17.985 1.524 1.884 1.00 0.00 C ATOM 2136 CG1 VAL B 60 -18.000 0.317 2.802 1.00 0.00 C ATOM 2137 CG2 VAL B 60 -17.186 1.185 0.632 1.00 0.00 C ATOM 0 H VAL B 60 -18.533 3.665 0.697 1.00 0.00 H new ATOM 0 HA VAL B 60 -19.827 1.173 0.828 1.00 0.00 H new ATOM 0 HB VAL B 60 -17.523 2.357 2.414 1.00 0.00 H new ATOM 0 HG11 VAL B 60 -16.977 0.045 3.062 1.00 0.00 H new ATOM 0 HG12 VAL B 60 -18.554 0.557 3.710 1.00 0.00 H new ATOM 0 HG13 VAL B 60 -18.480 -0.520 2.295 1.00 0.00 H new ATOM 0 HG21 VAL B 60 -16.176 0.887 0.914 1.00 0.00 H new ATOM 0 HG22 VAL B 60 -17.671 0.366 0.101 1.00 0.00 H new ATOM 0 HG23 VAL B 60 -17.138 2.060 -0.017 1.00 0.00 H new ATOM 2147 N GLY B 61 -20.338 3.171 3.378 1.00 0.00 N ATOM 2148 CA GLY B 61 -21.158 3.324 4.552 1.00 0.00 C ATOM 2149 C GLY B 61 -22.608 3.736 4.279 1.00 0.00 C ATOM 2150 O GLY B 61 -23.540 3.059 4.706 1.00 0.00 O ATOM 0 H GLY B 61 -19.768 3.982 3.136 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -21.161 2.382 5.100 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -20.700 4.070 5.202 1.00 0.00 H new ATOM 2154 N GLU B 62 -22.788 4.830 3.574 1.00 0.00 N ATOM 2155 CA GLU B 62 -24.103 5.460 3.425 1.00 0.00 C ATOM 2156 C GLU B 62 -24.948 4.995 2.225 1.00 0.00 C ATOM 2157 O GLU B 62 -26.166 5.153 2.258 1.00 0.00 O ATOM 2158 CB GLU B 62 -23.950 6.980 3.351 1.00 0.00 C ATOM 2159 CG GLU B 62 -23.194 7.614 4.513 1.00 0.00 C ATOM 2160 CD GLU B 62 -23.810 7.307 5.850 1.00 0.00 C ATOM 2161 OE1 GLU B 62 -25.001 7.612 6.054 1.00 0.00 O ATOM 2162 OE2 GLU B 62 -23.108 6.768 6.729 1.00 0.00 O ATOM 0 H GLU B 62 -22.036 5.316 3.085 1.00 0.00 H new ATOM 0 HA GLU B 62 -24.650 5.140 4.312 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -23.436 7.233 2.423 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -24.943 7.427 3.297 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -22.163 7.261 4.504 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -23.162 8.694 4.373 1.00 0.00 H new ATOM 2169 N LEU B 63 -24.325 4.406 1.201 1.00 0.00 N ATOM 2170 CA LEU B 63 -25.004 4.173 -0.127 1.00 0.00 C ATOM 2171 C LEU B 63 -26.290 3.339 -0.032 1.00 0.00 C ATOM 2172 O LEU B 63 -27.142 3.412 -0.917 1.00 0.00 O ATOM 2173 CB LEU B 63 -24.049 3.494 -1.114 1.00 0.00 C ATOM 2174 CG LEU B 63 -24.457 3.454 -2.588 1.00 0.00 C ATOM 2175 CD1 LEU B 63 -24.401 4.847 -3.191 1.00 0.00 C ATOM 2176 CD2 LEU B 63 -23.559 2.502 -3.363 1.00 0.00 C ATOM 0 H LEU B 63 -23.361 4.076 1.240 1.00 0.00 H new ATOM 0 HA LEU B 63 -25.285 5.165 -0.481 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -23.084 3.997 -1.047 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -23.897 2.467 -0.781 1.00 0.00 H new ATOM 0 HG LEU B 63 -25.482 3.090 -2.653 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -24.694 4.801 -4.240 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -25.083 5.505 -2.652 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -23.386 5.236 -3.115 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -23.863 2.486 -4.410 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -22.525 2.838 -3.291 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -23.645 1.499 -2.945 1.00 0.00 H new ATOM 2188 N MET B 64 -26.430 2.582 1.036 1.00 0.00 N ATOM 2189 CA MET B 64 -27.584 1.715 1.221 1.00 0.00 C ATOM 2190 C MET B 64 -28.847 2.546 1.400 1.00 0.00 C ATOM 2191 O MET B 64 -29.884 2.279 0.782 1.00 0.00 O ATOM 2192 CB MET B 64 -27.415 0.835 2.461 1.00 0.00 C ATOM 2193 CG MET B 64 -26.142 0.025 2.511 1.00 0.00 C ATOM 2194 SD MET B 64 -26.046 -0.971 4.013 1.00 0.00 S ATOM 2195 CE MET B 64 -24.479 -1.805 3.763 1.00 0.00 C ATOM 0 H MET B 64 -25.754 2.547 1.799 1.00 0.00 H new ATOM 0 HA MET B 64 -27.666 1.087 0.334 1.00 0.00 H new ATOM 0 HB2 MET B 64 -27.456 1.471 3.345 1.00 0.00 H new ATOM 0 HB3 MET B 64 -28.263 0.152 2.520 1.00 0.00 H new ATOM 0 HG2 MET B 64 -26.090 -0.626 1.638 1.00 0.00 H new ATOM 0 HG3 MET B 64 -25.283 0.694 2.462 1.00 0.00 H new ATOM 0 HE1 MET B 64 -24.276 -2.460 4.610 1.00 0.00 H new ATOM 0 HE2 MET B 64 -24.524 -2.397 2.849 1.00 0.00 H new ATOM 0 HE3 MET B 64 -23.683 -1.066 3.678 1.00 0.00 H new ATOM 2205 N ASP B 65 -28.758 3.548 2.245 1.00 0.00 N ATOM 2206 CA ASP B 65 -29.913 4.361 2.568 1.00 0.00 C ATOM 2207 C ASP B 65 -30.033 5.596 1.675 1.00 0.00 C ATOM 2208 O ASP B 65 -31.141 5.998 1.311 1.00 0.00 O ATOM 2209 CB ASP B 65 -29.919 4.741 4.044 1.00 0.00 C ATOM 2210 CG ASP B 65 -31.175 5.466 4.445 1.00 0.00 C ATOM 2211 OD1 ASP B 65 -32.268 4.894 4.330 1.00 0.00 O ATOM 2212 OD2 ASP B 65 -31.094 6.610 4.901 1.00 0.00 O ATOM 0 H ASP B 65 -27.899 3.821 2.722 1.00 0.00 H new ATOM 0 HA ASP B 65 -30.793 3.750 2.369 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -29.814 3.840 4.649 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -29.055 5.371 4.258 1.00 0.00 H new ATOM 2217 N GLN B 66 -28.907 6.191 1.313 1.00 0.00 N ATOM 2218 CA GLN B 66 -28.888 7.364 0.443 1.00 0.00 C ATOM 2219 C GLN B 66 -27.477 7.582 -0.030 1.00 0.00 C ATOM 2220 O GLN B 66 -26.534 7.315 0.712 1.00 0.00 O ATOM 2221 CB GLN B 66 -29.403 8.665 1.149 1.00 0.00 C ATOM 2222 CG GLN B 66 -28.485 9.291 2.228 1.00 0.00 C ATOM 2223 CD GLN B 66 -28.326 8.470 3.495 1.00 0.00 C ATOM 2224 OE1 GLN B 66 -29.081 8.628 4.445 1.00 0.00 O ATOM 2225 NE2 GLN B 66 -27.345 7.607 3.519 1.00 0.00 N ATOM 0 H GLN B 66 -27.983 5.879 1.611 1.00 0.00 H new ATOM 0 HA GLN B 66 -29.566 7.169 -0.388 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -29.585 9.417 0.381 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -30.365 8.442 1.611 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -27.499 9.454 1.793 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -28.881 10.270 2.496 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -26.736 7.504 2.707 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -27.188 7.036 4.350 1.00 0.00 H new ATOM 2234 N ASN B 67 -27.296 8.036 -1.231 1.00 0.00 N ATOM 2235 CA ASN B 67 -25.953 8.290 -1.668 1.00 0.00 C ATOM 2236 C ASN B 67 -25.486 9.610 -1.095 1.00 0.00 C ATOM 2237 O ASN B 67 -26.113 10.652 -1.285 1.00 0.00 O ATOM 2238 CB ASN B 67 -25.780 8.216 -3.202 1.00 0.00 C ATOM 2239 CG ASN B 67 -26.312 9.409 -3.993 1.00 0.00 C ATOM 2240 OD1 ASN B 67 -27.487 9.463 -4.344 1.00 0.00 O ATOM 2241 ND2 ASN B 67 -25.443 10.335 -4.327 1.00 0.00 N ATOM 0 H ASN B 67 -28.032 8.234 -1.909 1.00 0.00 H new ATOM 0 HA ASN B 67 -25.317 7.491 -1.286 1.00 0.00 H new ATOM 0 HB2 ASN B 67 -24.719 8.103 -3.423 1.00 0.00 H new ATOM 0 HB3 ASN B 67 -26.278 7.316 -3.561 1.00 0.00 H new ATOM 0 HD21 ASN B 67 -25.737 11.130 -4.895 1.00 0.00 H new ATOM 0 HD22 ASN B 67 -24.474 10.260 -4.019 1.00 0.00 H new ATOM 2248 N ALA B 68 -24.457 9.537 -0.315 1.00 0.00 N ATOM 2249 CA ALA B 68 -23.884 10.695 0.293 1.00 0.00 C ATOM 2250 C ALA B 68 -22.923 11.311 -0.678 1.00 0.00 C ATOM 2251 O ALA B 68 -22.239 10.595 -1.368 1.00 0.00 O ATOM 2252 CB ALA B 68 -23.173 10.301 1.569 1.00 0.00 C ATOM 0 H ALA B 68 -23.985 8.664 -0.079 1.00 0.00 H new ATOM 0 HA ALA B 68 -24.661 11.417 0.545 1.00 0.00 H new ATOM 0 HB1 ALA B 68 -22.737 11.187 2.031 1.00 0.00 H new ATOM 0 HB2 ALA B 68 -23.886 9.847 2.257 1.00 0.00 H new ATOM 0 HB3 ALA B 68 -22.384 9.585 1.340 1.00 0.00 H new ATOM 2258 N PHE B 69 -22.928 12.608 -0.774 1.00 0.00 N ATOM 2259 CA PHE B 69 -22.028 13.326 -1.665 1.00 0.00 C ATOM 2260 C PHE B 69 -21.748 14.707 -1.100 1.00 0.00 C ATOM 2261 O PHE B 69 -21.235 15.593 -1.792 1.00 0.00 O ATOM 2262 CB PHE B 69 -22.641 13.431 -3.088 1.00 0.00 C ATOM 2263 CG PHE B 69 -24.004 14.093 -3.157 1.00 0.00 C ATOM 2264 CD1 PHE B 69 -25.158 13.341 -3.035 1.00 0.00 C ATOM 2265 CD2 PHE B 69 -24.125 15.462 -3.352 1.00 0.00 C ATOM 2266 CE1 PHE B 69 -26.400 13.932 -3.104 1.00 0.00 C ATOM 2267 CE2 PHE B 69 -25.364 16.059 -3.421 1.00 0.00 C ATOM 2268 CZ PHE B 69 -26.504 15.293 -3.297 1.00 0.00 C ATOM 0 H PHE B 69 -23.554 13.211 -0.240 1.00 0.00 H new ATOM 0 HA PHE B 69 -21.089 12.777 -1.742 1.00 0.00 H new ATOM 0 HB2 PHE B 69 -21.952 13.988 -3.723 1.00 0.00 H new ATOM 0 HB3 PHE B 69 -22.720 12.428 -3.507 1.00 0.00 H new ATOM 0 HD1 PHE B 69 -25.084 12.274 -2.883 1.00 0.00 H new ATOM 0 HD2 PHE B 69 -23.236 16.067 -3.451 1.00 0.00 H new ATOM 0 HE1 PHE B 69 -27.291 13.330 -3.007 1.00 0.00 H new ATOM 0 HE2 PHE B 69 -25.443 17.125 -3.572 1.00 0.00 H new ATOM 0 HZ PHE B 69 -27.477 15.759 -3.351 1.00 0.00 H new ATOM 2278 N SER B 70 -22.024 14.861 0.167 1.00 0.00 N ATOM 2279 CA SER B 70 -21.942 16.132 0.811 1.00 0.00 C ATOM 2280 C SER B 70 -20.511 16.461 1.204 1.00 0.00 C ATOM 2281 O SER B 70 -19.783 15.625 1.760 1.00 0.00 O ATOM 2282 CB SER B 70 -22.859 16.166 2.040 1.00 0.00 C ATOM 2283 OG SER B 70 -22.845 17.438 2.664 1.00 0.00 O ATOM 0 H SER B 70 -22.313 14.099 0.780 1.00 0.00 H new ATOM 0 HA SER B 70 -22.275 16.891 0.103 1.00 0.00 H new ATOM 0 HB2 SER B 70 -23.878 15.917 1.742 1.00 0.00 H new ATOM 0 HB3 SER B 70 -22.541 15.406 2.754 1.00 0.00 H new ATOM 0 HG SER B 70 -22.033 17.528 3.206 1.00 0.00 H new ATOM 2289 N LEU B 71 -20.104 17.656 0.882 1.00 0.00 N ATOM 2290 CA LEU B 71 -18.814 18.161 1.265 1.00 0.00 C ATOM 2291 C LEU B 71 -18.974 19.579 1.769 1.00 0.00 C ATOM 2292 O LEU B 71 -18.039 20.363 1.777 1.00 0.00 O ATOM 2293 CB LEU B 71 -17.751 18.058 0.122 1.00 0.00 C ATOM 2294 CG LEU B 71 -17.986 18.823 -1.201 1.00 0.00 C ATOM 2295 CD1 LEU B 71 -16.716 18.798 -2.026 1.00 0.00 C ATOM 2296 CD2 LEU B 71 -19.096 18.195 -2.022 1.00 0.00 C ATOM 0 H LEU B 71 -20.664 18.315 0.340 1.00 0.00 H new ATOM 0 HA LEU B 71 -18.423 17.534 2.066 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -16.798 18.394 0.530 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -17.637 17.003 -0.126 1.00 0.00 H new ATOM 0 HG LEU B 71 -18.271 19.844 -0.947 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -16.878 19.337 -2.960 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -15.910 19.274 -1.468 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -16.445 17.765 -2.245 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -19.231 18.761 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -18.832 17.165 -2.263 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -20.023 18.207 -1.449 1.00 0.00 H new ATOM 2308 N THR B 72 -20.168 19.873 2.260 1.00 0.00 N ATOM 2309 CA THR B 72 -20.472 21.181 2.803 1.00 0.00 C ATOM 2310 C THR B 72 -19.897 21.287 4.227 1.00 0.00 C ATOM 2311 O THR B 72 -19.561 22.376 4.699 1.00 0.00 O ATOM 2312 CB THR B 72 -22.022 21.469 2.788 1.00 0.00 C ATOM 2313 OG1 THR B 72 -22.315 22.803 3.230 1.00 0.00 O ATOM 2314 CG2 THR B 72 -22.795 20.483 3.660 1.00 0.00 C ATOM 0 H THR B 72 -20.946 19.214 2.292 1.00 0.00 H new ATOM 0 HA THR B 72 -20.007 21.939 2.174 1.00 0.00 H new ATOM 0 HB THR B 72 -22.340 21.352 1.752 1.00 0.00 H new ATOM 0 HG1 THR B 72 -23.284 22.950 3.207 1.00 0.00 H new ATOM 0 HG21 THR B 72 -23.859 20.718 3.620 1.00 0.00 H new ATOM 0 HG22 THR B 72 -22.634 19.469 3.293 1.00 0.00 H new ATOM 0 HG23 THR B 72 -22.445 20.556 4.690 1.00 0.00 H new ATOM 2322 N GLN B 73 -19.736 20.137 4.875 1.00 0.00 N ATOM 2323 CA GLN B 73 -19.191 20.068 6.212 1.00 0.00 C ATOM 2324 C GLN B 73 -17.670 19.962 6.144 1.00 0.00 C ATOM 2325 O GLN B 73 -16.977 19.982 7.166 1.00 0.00 O ATOM 2326 CB GLN B 73 -19.779 18.879 7.026 1.00 0.00 C ATOM 2327 CG GLN B 73 -19.298 17.451 6.652 1.00 0.00 C ATOM 2328 CD GLN B 73 -19.818 16.877 5.330 1.00 0.00 C ATOM 2329 OE1 GLN B 73 -20.074 17.584 4.361 1.00 0.00 O ATOM 2330 NE2 GLN B 73 -19.989 15.583 5.297 1.00 0.00 N ATOM 0 H GLN B 73 -19.983 19.229 4.480 1.00 0.00 H new ATOM 0 HA GLN B 73 -19.473 20.983 6.732 1.00 0.00 H new ATOM 0 HB2 GLN B 73 -19.552 19.046 8.079 1.00 0.00 H new ATOM 0 HB3 GLN B 73 -20.864 18.906 6.926 1.00 0.00 H new ATOM 0 HG2 GLN B 73 -18.209 17.457 6.616 1.00 0.00 H new ATOM 0 HG3 GLN B 73 -19.587 16.773 7.455 1.00 0.00 H new ATOM 0 HE21 GLN B 73 -19.768 15.018 6.117 1.00 0.00 H new ATOM 0 HE22 GLN B 73 -20.343 15.137 4.451 1.00 0.00 H new ATOM 2339 N LYS B 74 -17.166 19.847 4.942 1.00 0.00 N ATOM 2340 CA LYS B 74 -15.756 19.771 4.715 1.00 0.00 C ATOM 2341 C LYS B 74 -15.294 21.182 4.386 1.00 0.00 C ATOM 2342 O LYS B 74 -15.393 21.598 3.231 1.00 0.00 O ATOM 2343 CB LYS B 74 -15.473 18.757 3.569 1.00 0.00 C ATOM 2344 CG LYS B 74 -14.006 18.331 3.368 1.00 0.00 C ATOM 2345 CD LYS B 74 -13.173 19.366 2.625 1.00 0.00 C ATOM 2346 CE LYS B 74 -11.733 18.907 2.456 1.00 0.00 C ATOM 2347 NZ LYS B 74 -11.000 18.864 3.742 1.00 0.00 N ATOM 2348 OXT LYS B 74 -14.914 21.919 5.312 1.00 0.00 O ATOM 0 H LYS B 74 -17.730 19.804 4.093 1.00 0.00 H new ATOM 0 HA LYS B 74 -15.208 19.410 5.585 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -16.065 17.861 3.754 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -15.833 19.190 2.635 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -13.554 18.142 4.341 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -13.980 17.391 2.817 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -13.613 19.554 1.646 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -13.193 20.310 3.170 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -11.721 17.917 2.001 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -11.218 19.579 1.770 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -9.993 18.678 3.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -11.102 19.777 4.230 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -11.390 18.107 4.339 1.00 0.00 H new TER 2362 LYS B 74