USER MOD reduce.3.24.130724 H: found=0, std=0, add=1410, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1410 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 71 GLN : amide:sc= -0.253 K(o=-0.25,f=0.37) USER MOD Set 1.2: B 78 SER OG : rot 140:sc= 0.00806 USER MOD Set 2.1: B 57 MET CE :methyl -163:sc= -1.95 (180deg=-0.27) USER MOD Set 2.2: B 68 CYS SG : rot -22:sc= -2.11 USER MOD Set 3.1: B 33 LYS NZ :NH3+ -161:sc= 0.27 (180deg=-0.0274) USER MOD Set 3.2: B 37 ASN : amide:sc= -0.0751 K(o=0.19,f=-0.86) USER MOD Set 4.1: B 15 HIS : no HD1:sc= -0.0149 X(o=-0.015,f=-0.3) USER MOD Set 4.2: B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 78 SER OG : rot 140:sc= 0.0094 USER MOD Set 5.2: B 71 GLN : amide:sc= -0.291 K(o=-0.28,f=0.35) USER MOD Set 6.1: A 57 MET CE :methyl -161:sc= -2.22 (180deg=-0.271) USER MOD Set 6.2: A 68 CYS SG : rot -24:sc= -2.31 USER MOD Set 7.1: A 33 LYS NZ :NH3+ -162:sc= 0.288 (180deg=-0.0441) USER MOD Set 7.2: A 37 ASN : amide:sc= -0.0727 K(o=0.22,f=-0.86) USER MOD Set 8.1: A 15 HIS : no HE2:sc=-0.00692 X(o=-0.0069,f=-0.33) USER MOD Set 8.2: A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER N :NH3+ 167:sc= 0 (180deg=-0.218) USER MOD Single : A 1 SER OG : rot 180:sc=0.000682 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -142:sc= -0.145 (180deg=-1.44) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 17 TYR OH : rot 0:sc= -3.42! USER MOD Single : A 18 SER OG : rot 150:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -1.26 K(o=-1.3,f=-0.75) USER MOD Single : A 26 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.197) USER MOD Single : A 28 LYS NZ :NH3+ 152:sc= -0.129 (180deg=-0.79) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 38 ASN : amide:sc= -0.787 K(o=-0.79,f=-2.1!) USER MOD Single : A 41 SER OG : rot 180:sc= -0.0348 USER MOD Single : A 42 HIS : no HD1:sc= -8.78! C(o=-8.8!,f=-5.3!) USER MOD Single : A 48 LYS NZ :NH3+ 164:sc= -0.0307 (180deg=-0.329) USER MOD Single : A 50 GLN : amide:sc=-0.00128 X(o=-0.0013,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 104:sc= 1.22 USER MOD Single : A 74 MET CE :methyl -131:sc= -0.124 (180deg=-0.908) USER MOD Single : A 79 MET CE :methyl 156:sc= -0.216 (180deg=-1.15) USER MOD Single : A 81 THR OG1 : rot -19:sc= -0.734 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.214 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= -1.96 K(o=0.14,f=-10!) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=-0.2) USER MOD Single : B 1 SER N :NH3+ 167:sc= 0 (180deg=-0.234) USER MOD Single : B 1 SER OG : rot 180:sc= 0.00699 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl -140:sc= -0.103 (180deg=-1.3) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 17 TYR OH : rot 180:sc= -3.38! USER MOD Single : B 18 SER OG : rot 150:sc= 0.00149 USER MOD Single : B 25 HIS : no HD1:sc= -1.29 X(o=-1.3,f=-0.83) USER MOD Single : B 26 LYS NZ :NH3+ -165:sc=-0.00526 (180deg=-0.191) USER MOD Single : B 28 LYS NZ :NH3+ 153:sc= -0.155 (180deg=-0.945) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 38 ASN : amide:sc= -0.793 K(o=-0.79,f=-2.2!) USER MOD Single : B 41 SER OG : rot 180:sc= -0.0382 USER MOD Single : B 42 HIS : no HD1:sc= -8.78! C(o=-8.8!,f=-5.4!) USER MOD Single : B 48 LYS NZ :NH3+ 163:sc= -0.0169 (180deg=-0.307) USER MOD Single : B 50 GLN : amide:sc=-0.00527 X(o=-0.0053,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 82:sc= 1.33 USER MOD Single : B 74 MET CE :methyl -154:sc= -0.166 (180deg=-0.984) USER MOD Single : B 79 MET CE :methyl 153:sc= -0.194 (180deg=-1.08) USER MOD Single : B 81 THR OG1 : rot -21:sc= -0.954 USER MOD Single : B 82 THR OG1 : rot 180:sc= -0.219 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 85 HIS : no HD1:sc= -1.99 K(o=0.018,f=-10!) USER MOD Single : B 90 HIS : no HD1:sc= 0 X(o=0,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 69.026 12.246 -9.762 1.00 0.00 N ATOM 2 CA SER A 1 68.124 11.919 -10.903 1.00 0.00 C ATOM 3 C SER A 1 67.555 10.509 -10.715 1.00 0.00 C ATOM 4 O SER A 1 66.925 10.211 -9.720 1.00 0.00 O ATOM 5 CB SER A 1 68.916 11.984 -12.211 1.00 0.00 C ATOM 6 OG SER A 1 68.015 11.962 -13.309 1.00 0.00 O ATOM 0 H1 SER A 1 69.579 13.097 -9.990 1.00 0.00 H new ATOM 0 H2 SER A 1 68.457 12.421 -8.909 1.00 0.00 H new ATOM 0 H3 SER A 1 69.671 11.449 -9.590 1.00 0.00 H new ATOM 0 HA SER A 1 67.305 12.637 -10.939 1.00 0.00 H new ATOM 0 HB2 SER A 1 69.519 12.892 -12.239 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.605 11.142 -12.274 1.00 0.00 H new ATOM 0 HG SER A 1 68.520 12.005 -14.148 1.00 0.00 H new ATOM 14 N GLU A 2 67.762 9.646 -11.671 1.00 0.00 N ATOM 15 CA GLU A 2 67.227 8.257 -11.571 1.00 0.00 C ATOM 16 C GLU A 2 67.803 7.556 -10.338 1.00 0.00 C ATOM 17 O GLU A 2 67.119 6.809 -9.667 1.00 0.00 O ATOM 18 CB GLU A 2 67.622 7.482 -12.833 1.00 0.00 C ATOM 19 CG GLU A 2 66.957 6.097 -12.836 1.00 0.00 C ATOM 20 CD GLU A 2 67.732 5.133 -11.930 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.883 5.414 -11.635 1.00 0.00 O ATOM 22 OE2 GLU A 2 67.160 4.124 -11.552 1.00 0.00 O ATOM 0 H GLU A 2 68.283 9.845 -12.525 1.00 0.00 H new ATOM 0 HA GLU A 2 66.142 8.293 -11.478 1.00 0.00 H new ATOM 0 HB2 GLU A 2 67.321 8.040 -13.720 1.00 0.00 H new ATOM 0 HB3 GLU A 2 68.706 7.373 -12.877 1.00 0.00 H new ATOM 0 HG2 GLU A 2 65.926 6.180 -12.492 1.00 0.00 H new ATOM 0 HG3 GLU A 2 66.924 5.704 -13.852 1.00 0.00 H new ATOM 29 N LEU A 3 69.048 7.791 -10.025 1.00 0.00 N ATOM 30 CA LEU A 3 69.658 7.143 -8.831 1.00 0.00 C ATOM 31 C LEU A 3 69.053 7.736 -7.552 1.00 0.00 C ATOM 32 O LEU A 3 68.862 7.048 -6.569 1.00 0.00 O ATOM 33 CB LEU A 3 71.170 7.399 -8.850 1.00 0.00 C ATOM 34 CG LEU A 3 71.849 6.734 -7.642 1.00 0.00 C ATOM 35 CD1 LEU A 3 71.703 5.206 -7.728 1.00 0.00 C ATOM 36 CD2 LEU A 3 73.335 7.110 -7.644 1.00 0.00 C ATOM 0 H LEU A 3 69.671 8.407 -10.548 1.00 0.00 H new ATOM 0 HA LEU A 3 69.461 6.071 -8.852 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.598 7.010 -9.774 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.362 8.472 -8.837 1.00 0.00 H new ATOM 0 HG LEU A 3 71.377 7.079 -6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 3 72.188 4.745 -6.867 1.00 0.00 H new ATOM 0 HD12 LEU A 3 70.646 4.941 -7.734 1.00 0.00 H new ATOM 0 HD13 LEU A 3 72.172 4.847 -8.644 1.00 0.00 H new ATOM 0 HD21 LEU A 3 73.829 6.644 -6.791 1.00 0.00 H new ATOM 0 HD22 LEU A 3 73.798 6.760 -8.567 1.00 0.00 H new ATOM 0 HD23 LEU A 3 73.436 8.193 -7.575 1.00 0.00 H new ATOM 48 N GLU A 4 68.755 9.009 -7.556 1.00 0.00 N ATOM 49 CA GLU A 4 68.172 9.642 -6.339 1.00 0.00 C ATOM 50 C GLU A 4 66.777 9.068 -6.076 1.00 0.00 C ATOM 51 O GLU A 4 66.406 8.812 -4.948 1.00 0.00 O ATOM 52 CB GLU A 4 68.081 11.156 -6.555 1.00 0.00 C ATOM 53 CG GLU A 4 67.622 11.847 -5.267 1.00 0.00 C ATOM 54 CD GLU A 4 68.696 11.693 -4.188 1.00 0.00 C ATOM 55 OE1 GLU A 4 69.832 11.422 -4.546 1.00 0.00 O ATOM 56 OE2 GLU A 4 68.367 11.852 -3.025 1.00 0.00 O ATOM 0 H GLU A 4 68.890 9.636 -8.349 1.00 0.00 H new ATOM 0 HA GLU A 4 68.807 9.435 -5.478 1.00 0.00 H new ATOM 0 HB2 GLU A 4 69.052 11.546 -6.860 1.00 0.00 H new ATOM 0 HB3 GLU A 4 67.382 11.374 -7.362 1.00 0.00 H new ATOM 0 HG2 GLU A 4 67.433 12.903 -5.457 1.00 0.00 H new ATOM 0 HG3 GLU A 4 66.683 11.412 -4.924 1.00 0.00 H new ATOM 63 N LYS A 5 66.000 8.860 -7.103 1.00 0.00 N ATOM 64 CA LYS A 5 64.632 8.297 -6.897 1.00 0.00 C ATOM 65 C LYS A 5 64.726 6.894 -6.292 1.00 0.00 C ATOM 66 O LYS A 5 63.953 6.527 -5.429 1.00 0.00 O ATOM 67 CB LYS A 5 63.884 8.233 -8.234 1.00 0.00 C ATOM 68 CG LYS A 5 63.541 9.650 -8.706 1.00 0.00 C ATOM 69 CD LYS A 5 62.794 9.582 -10.042 1.00 0.00 C ATOM 70 CE LYS A 5 62.442 10.998 -10.504 1.00 0.00 C ATOM 71 NZ LYS A 5 61.930 10.958 -11.903 1.00 0.00 N ATOM 0 H LYS A 5 66.250 9.054 -8.073 1.00 0.00 H new ATOM 0 HA LYS A 5 64.086 8.945 -6.212 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.498 7.730 -8.981 1.00 0.00 H new ATOM 0 HB3 LYS A 5 62.972 7.646 -8.123 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.926 10.154 -7.960 1.00 0.00 H new ATOM 0 HG3 LYS A 5 64.452 10.237 -8.817 1.00 0.00 H new ATOM 0 HD2 LYS A 5 63.412 9.087 -10.791 1.00 0.00 H new ATOM 0 HD3 LYS A 5 61.887 8.988 -9.933 1.00 0.00 H new ATOM 0 HE2 LYS A 5 61.690 11.430 -9.844 1.00 0.00 H new ATOM 0 HE3 LYS A 5 63.322 11.639 -10.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 61.692 11.922 -12.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 62.661 10.563 -12.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 61.079 10.361 -11.944 1.00 0.00 H new ATOM 85 N ALA A 6 65.662 6.105 -6.738 1.00 0.00 N ATOM 86 CA ALA A 6 65.798 4.725 -6.186 1.00 0.00 C ATOM 87 C ALA A 6 66.097 4.798 -4.683 1.00 0.00 C ATOM 88 O ALA A 6 65.498 4.102 -3.887 1.00 0.00 O ATOM 89 CB ALA A 6 66.938 3.996 -6.904 1.00 0.00 C ATOM 0 H ALA A 6 66.339 6.353 -7.460 1.00 0.00 H new ATOM 0 HA ALA A 6 64.867 4.180 -6.341 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.037 2.988 -6.500 1.00 0.00 H new ATOM 0 HB2 ALA A 6 66.719 3.940 -7.970 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.870 4.540 -6.753 1.00 0.00 H new ATOM 95 N MET A 7 67.020 5.636 -4.293 1.00 0.00 N ATOM 96 CA MET A 7 67.360 5.757 -2.846 1.00 0.00 C ATOM 97 C MET A 7 66.112 6.190 -2.072 1.00 0.00 C ATOM 98 O MET A 7 65.754 5.616 -1.061 1.00 0.00 O ATOM 99 CB MET A 7 68.447 6.823 -2.683 1.00 0.00 C ATOM 100 CG MET A 7 68.992 6.797 -1.256 1.00 0.00 C ATOM 101 SD MET A 7 70.052 8.243 -0.994 1.00 0.00 S ATOM 102 CE MET A 7 71.352 7.819 -2.181 1.00 0.00 C ATOM 0 H MET A 7 67.554 6.243 -4.915 1.00 0.00 H new ATOM 0 HA MET A 7 67.715 4.800 -2.464 1.00 0.00 H new ATOM 0 HB2 MET A 7 69.254 6.643 -3.393 1.00 0.00 H new ATOM 0 HB3 MET A 7 68.039 7.808 -2.908 1.00 0.00 H new ATOM 0 HG2 MET A 7 68.170 6.800 -0.540 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.558 5.881 -1.087 1.00 0.00 H new ATOM 0 HE1 MET A 7 72.323 8.101 -1.774 1.00 0.00 H new ATOM 0 HE2 MET A 7 71.336 6.746 -2.370 1.00 0.00 H new ATOM 0 HE3 MET A 7 71.181 8.354 -3.115 1.00 0.00 H new ATOM 112 N VAL A 8 65.464 7.215 -2.544 1.00 0.00 N ATOM 113 CA VAL A 8 64.248 7.734 -1.861 1.00 0.00 C ATOM 114 C VAL A 8 63.187 6.633 -1.788 1.00 0.00 C ATOM 115 O VAL A 8 62.429 6.556 -0.842 1.00 0.00 O ATOM 116 CB VAL A 8 63.712 8.933 -2.652 1.00 0.00 C ATOM 117 CG1 VAL A 8 62.333 9.342 -2.125 1.00 0.00 C ATOM 118 CG2 VAL A 8 64.684 10.108 -2.499 1.00 0.00 C ATOM 0 H VAL A 8 65.729 7.724 -3.387 1.00 0.00 H new ATOM 0 HA VAL A 8 64.495 8.047 -0.846 1.00 0.00 H new ATOM 0 HB VAL A 8 63.620 8.658 -3.703 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.964 10.194 -2.695 1.00 0.00 H new ATOM 0 HG12 VAL A 8 61.641 8.507 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 8 62.412 9.616 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 8 64.310 10.965 -3.059 1.00 0.00 H new ATOM 0 HG22 VAL A 8 64.771 10.373 -1.445 1.00 0.00 H new ATOM 0 HG23 VAL A 8 65.663 9.823 -2.884 1.00 0.00 H new ATOM 128 N ALA A 9 63.110 5.788 -2.778 1.00 0.00 N ATOM 129 CA ALA A 9 62.080 4.713 -2.746 1.00 0.00 C ATOM 130 C ALA A 9 62.292 3.833 -1.510 1.00 0.00 C ATOM 131 O ALA A 9 61.349 3.418 -0.868 1.00 0.00 O ATOM 132 CB ALA A 9 62.198 3.855 -4.012 1.00 0.00 C ATOM 0 H ALA A 9 63.711 5.795 -3.602 1.00 0.00 H new ATOM 0 HA ALA A 9 61.088 5.163 -2.702 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.444 3.068 -3.990 1.00 0.00 H new ATOM 0 HB2 ALA A 9 62.043 4.480 -4.891 1.00 0.00 H new ATOM 0 HB3 ALA A 9 63.190 3.406 -4.056 1.00 0.00 H new ATOM 138 N LEU A 10 63.518 3.535 -1.176 1.00 0.00 N ATOM 139 CA LEU A 10 63.778 2.672 0.018 1.00 0.00 C ATOM 140 C LEU A 10 63.250 3.340 1.297 1.00 0.00 C ATOM 141 O LEU A 10 62.614 2.704 2.114 1.00 0.00 O ATOM 142 CB LEU A 10 65.291 2.425 0.171 1.00 0.00 C ATOM 143 CG LEU A 10 65.770 1.335 -0.803 1.00 0.00 C ATOM 144 CD1 LEU A 10 65.870 1.903 -2.220 1.00 0.00 C ATOM 145 CD2 LEU A 10 67.150 0.839 -0.363 1.00 0.00 C ATOM 0 H LEU A 10 64.350 3.849 -1.675 1.00 0.00 H new ATOM 0 HA LEU A 10 63.261 1.724 -0.131 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.835 3.351 -0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.513 2.126 1.195 1.00 0.00 H new ATOM 0 HG LEU A 10 65.056 0.511 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 10 66.210 1.123 -2.901 1.00 0.00 H new ATOM 0 HD12 LEU A 10 64.891 2.262 -2.538 1.00 0.00 H new ATOM 0 HD13 LEU A 10 66.580 2.730 -2.231 1.00 0.00 H new ATOM 0 HD21 LEU A 10 67.495 0.066 -1.050 1.00 0.00 H new ATOM 0 HD22 LEU A 10 67.855 1.671 -0.369 1.00 0.00 H new ATOM 0 HD23 LEU A 10 67.084 0.427 0.644 1.00 0.00 H new ATOM 157 N ILE A 11 63.513 4.606 1.491 1.00 0.00 N ATOM 158 CA ILE A 11 63.022 5.271 2.738 1.00 0.00 C ATOM 159 C ILE A 11 61.500 5.185 2.787 1.00 0.00 C ATOM 160 O ILE A 11 60.919 4.786 3.777 1.00 0.00 O ATOM 161 CB ILE A 11 63.441 6.739 2.747 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.967 6.833 2.752 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.889 7.410 4.006 1.00 0.00 C ATOM 164 CD1 ILE A 11 65.386 8.277 2.471 1.00 0.00 C ATOM 0 H ILE A 11 64.038 5.202 0.852 1.00 0.00 H new ATOM 0 HA ILE A 11 63.453 4.769 3.605 1.00 0.00 H new ATOM 0 HB ILE A 11 63.049 7.238 1.861 1.00 0.00 H new ATOM 0 HG12 ILE A 11 65.359 6.510 3.716 1.00 0.00 H new ATOM 0 HG13 ILE A 11 65.386 6.167 1.998 1.00 0.00 H new ATOM 0 HG21 ILE A 11 63.185 8.459 4.019 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.801 7.340 4.009 1.00 0.00 H new ATOM 0 HG23 ILE A 11 63.287 6.910 4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 11 66.474 8.347 2.474 1.00 0.00 H new ATOM 0 HD12 ILE A 11 65.005 8.583 1.497 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.978 8.931 3.242 1.00 0.00 H new ATOM 176 N ASP A 12 60.847 5.558 1.724 1.00 0.00 N ATOM 177 CA ASP A 12 59.364 5.496 1.716 1.00 0.00 C ATOM 178 C ASP A 12 58.940 4.047 1.948 1.00 0.00 C ATOM 179 O ASP A 12 58.004 3.769 2.671 1.00 0.00 O ATOM 180 CB ASP A 12 58.845 5.980 0.359 1.00 0.00 C ATOM 181 CG ASP A 12 59.043 7.492 0.245 1.00 0.00 C ATOM 182 OD1 ASP A 12 59.166 8.133 1.276 1.00 0.00 O ATOM 183 OD2 ASP A 12 59.064 7.985 -0.871 1.00 0.00 O ATOM 0 H ASP A 12 61.275 5.902 0.864 1.00 0.00 H new ATOM 0 HA ASP A 12 58.952 6.132 2.500 1.00 0.00 H new ATOM 0 HB2 ASP A 12 59.375 5.472 -0.447 1.00 0.00 H new ATOM 0 HB3 ASP A 12 57.789 5.732 0.252 1.00 0.00 H new ATOM 188 N VAL A 13 59.636 3.123 1.351 1.00 0.00 N ATOM 189 CA VAL A 13 59.292 1.690 1.552 1.00 0.00 C ATOM 190 C VAL A 13 59.656 1.267 2.982 1.00 0.00 C ATOM 191 O VAL A 13 58.928 0.542 3.629 1.00 0.00 O ATOM 192 CB VAL A 13 60.058 0.836 0.535 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.908 -0.647 0.886 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.499 1.089 -0.872 1.00 0.00 C ATOM 0 H VAL A 13 60.428 3.298 0.733 1.00 0.00 H new ATOM 0 HA VAL A 13 58.222 1.545 1.405 1.00 0.00 H new ATOM 0 HB VAL A 13 61.114 1.107 0.561 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.454 -1.250 0.160 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.310 -0.827 1.883 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.853 -0.921 0.865 1.00 0.00 H new ATOM 0 HG21 VAL A 13 60.044 0.482 -1.595 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.442 0.822 -0.897 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.613 2.143 -1.125 1.00 0.00 H new ATOM 204 N PHE A 14 60.785 1.709 3.477 1.00 0.00 N ATOM 205 CA PHE A 14 61.200 1.323 4.860 1.00 0.00 C ATOM 206 C PHE A 14 60.242 1.926 5.888 1.00 0.00 C ATOM 207 O PHE A 14 59.677 1.229 6.706 1.00 0.00 O ATOM 208 CB PHE A 14 62.619 1.840 5.122 1.00 0.00 C ATOM 209 CG PHE A 14 63.034 1.518 6.541 1.00 0.00 C ATOM 210 CD1 PHE A 14 63.682 0.310 6.827 1.00 0.00 C ATOM 211 CD2 PHE A 14 62.780 2.435 7.570 1.00 0.00 C ATOM 212 CE1 PHE A 14 64.075 0.018 8.140 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.174 2.144 8.883 1.00 0.00 C ATOM 214 CZ PHE A 14 63.822 0.936 9.167 1.00 0.00 C ATOM 0 H PHE A 14 61.436 2.320 2.984 1.00 0.00 H new ATOM 0 HA PHE A 14 61.176 0.237 4.950 1.00 0.00 H new ATOM 0 HB2 PHE A 14 63.316 1.385 4.418 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.658 2.917 4.958 1.00 0.00 H new ATOM 0 HD1 PHE A 14 63.879 -0.397 6.035 1.00 0.00 H new ATOM 0 HD2 PHE A 14 62.280 3.367 7.351 1.00 0.00 H new ATOM 0 HE1 PHE A 14 64.573 -0.915 8.360 1.00 0.00 H new ATOM 0 HE2 PHE A 14 62.978 2.851 9.675 1.00 0.00 H new ATOM 0 HZ PHE A 14 64.127 0.712 10.179 1.00 0.00 H new ATOM 224 N HIS A 15 60.093 3.221 5.889 1.00 0.00 N ATOM 225 CA HIS A 15 59.222 3.872 6.906 1.00 0.00 C ATOM 226 C HIS A 15 57.787 3.363 6.812 1.00 0.00 C ATOM 227 O HIS A 15 57.157 3.113 7.819 1.00 0.00 O ATOM 228 CB HIS A 15 59.242 5.383 6.664 1.00 0.00 C ATOM 229 CG HIS A 15 58.365 6.075 7.669 1.00 0.00 C ATOM 230 ND1 HIS A 15 57.052 6.423 7.387 1.00 0.00 N ATOM 231 CD2 HIS A 15 58.600 6.503 8.952 1.00 0.00 C ATOM 232 CE1 HIS A 15 56.549 7.033 8.476 1.00 0.00 C ATOM 233 NE2 HIS A 15 57.453 7.106 9.455 1.00 0.00 N ATOM 0 H HIS A 15 60.538 3.858 5.228 1.00 0.00 H new ATOM 0 HA HIS A 15 59.599 3.634 7.900 1.00 0.00 H new ATOM 0 HB2 HIS A 15 60.262 5.758 6.740 1.00 0.00 H new ATOM 0 HB3 HIS A 15 58.896 5.603 5.654 1.00 0.00 H new ATOM 0 HD1 HIS A 15 56.557 6.248 6.512 1.00 0.00 H new ATOM 0 HD2 HIS A 15 59.531 6.389 9.487 1.00 0.00 H new ATOM 0 HE1 HIS A 15 55.541 7.415 8.548 1.00 0.00 H new ATOM 242 N GLN A 16 57.249 3.186 5.640 1.00 0.00 N ATOM 243 CA GLN A 16 55.857 2.674 5.564 1.00 0.00 C ATOM 244 C GLN A 16 55.844 1.213 6.009 1.00 0.00 C ATOM 245 O GLN A 16 54.946 0.766 6.694 1.00 0.00 O ATOM 246 CB GLN A 16 55.342 2.781 4.124 1.00 0.00 C ATOM 247 CG GLN A 16 53.889 2.301 4.065 1.00 0.00 C ATOM 248 CD GLN A 16 53.356 2.450 2.639 1.00 0.00 C ATOM 249 OE1 GLN A 16 54.046 2.156 1.683 1.00 0.00 O ATOM 250 NE2 GLN A 16 52.145 2.899 2.455 1.00 0.00 N ATOM 0 H GLN A 16 57.704 3.370 4.746 1.00 0.00 H new ATOM 0 HA GLN A 16 55.211 3.264 6.214 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.410 3.812 3.778 1.00 0.00 H new ATOM 0 HB3 GLN A 16 55.962 2.180 3.459 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.827 1.259 4.380 1.00 0.00 H new ATOM 0 HG3 GLN A 16 53.276 2.880 4.755 1.00 0.00 H new ATOM 0 HE21 GLN A 16 51.565 3.146 3.257 1.00 0.00 H new ATOM 0 HE22 GLN A 16 51.778 3.003 1.509 1.00 0.00 H new ATOM 259 N TYR A 17 56.837 0.467 5.612 1.00 0.00 N ATOM 260 CA TYR A 17 56.891 -0.971 5.997 1.00 0.00 C ATOM 261 C TYR A 17 57.259 -1.111 7.479 1.00 0.00 C ATOM 262 O TYR A 17 56.647 -1.861 8.213 1.00 0.00 O ATOM 263 CB TYR A 17 57.934 -1.689 5.142 1.00 0.00 C ATOM 264 CG TYR A 17 57.802 -3.175 5.360 1.00 0.00 C ATOM 265 CD1 TYR A 17 56.934 -3.916 4.550 1.00 0.00 C ATOM 266 CD2 TYR A 17 58.530 -3.812 6.372 1.00 0.00 C ATOM 267 CE1 TYR A 17 56.793 -5.293 4.750 1.00 0.00 C ATOM 268 CE2 TYR A 17 58.388 -5.190 6.574 1.00 0.00 C ATOM 269 CZ TYR A 17 57.518 -5.931 5.762 1.00 0.00 C ATOM 270 OH TYR A 17 57.377 -7.288 5.962 1.00 0.00 O ATOM 0 H TYR A 17 57.614 0.791 5.037 1.00 0.00 H new ATOM 0 HA TYR A 17 55.911 -1.418 5.833 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.789 -1.448 4.089 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.936 -1.356 5.411 1.00 0.00 H new ATOM 0 HD1 TYR A 17 56.372 -3.424 3.770 1.00 0.00 H new ATOM 0 HD2 TYR A 17 59.201 -3.241 6.997 1.00 0.00 H new ATOM 0 HE1 TYR A 17 56.124 -5.864 4.123 1.00 0.00 H new ATOM 0 HE2 TYR A 17 58.948 -5.682 7.355 1.00 0.00 H new ATOM 0 HH TYR A 17 56.735 -7.649 5.316 1.00 0.00 H new ATOM 280 N SER A 18 58.260 -0.399 7.921 1.00 0.00 N ATOM 281 CA SER A 18 58.674 -0.497 9.352 1.00 0.00 C ATOM 282 C SER A 18 57.612 0.141 10.245 1.00 0.00 C ATOM 283 O SER A 18 57.522 -0.153 11.422 1.00 0.00 O ATOM 284 CB SER A 18 60.008 0.221 9.562 1.00 0.00 C ATOM 285 OG SER A 18 60.437 0.022 10.905 1.00 0.00 O ATOM 0 H SER A 18 58.810 0.247 7.354 1.00 0.00 H new ATOM 0 HA SER A 18 58.785 -1.549 9.613 1.00 0.00 H new ATOM 0 HB2 SER A 18 60.755 -0.163 8.868 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.899 1.286 9.356 1.00 0.00 H new ATOM 0 HG SER A 18 61.416 0.029 10.940 1.00 0.00 H new ATOM 291 N GLY A 19 56.795 0.999 9.697 1.00 0.00 N ATOM 292 CA GLY A 19 55.722 1.645 10.510 1.00 0.00 C ATOM 293 C GLY A 19 54.452 0.795 10.434 1.00 0.00 C ATOM 294 O GLY A 19 53.363 1.269 10.688 1.00 0.00 O ATOM 0 H GLY A 19 56.824 1.282 8.718 1.00 0.00 H new ATOM 0 HA2 GLY A 19 56.045 1.746 11.546 1.00 0.00 H new ATOM 0 HA3 GLY A 19 55.524 2.651 10.139 1.00 0.00 H new ATOM 298 N ARG A 20 54.580 -0.458 10.090 1.00 0.00 N ATOM 299 CA ARG A 20 53.379 -1.337 10.004 1.00 0.00 C ATOM 300 C ARG A 20 53.018 -1.848 11.400 1.00 0.00 C ATOM 301 O ARG A 20 51.877 -1.804 11.815 1.00 0.00 O ATOM 302 CB ARG A 20 53.694 -2.530 9.098 1.00 0.00 C ATOM 303 CG ARG A 20 52.412 -3.316 8.814 1.00 0.00 C ATOM 304 CD ARG A 20 52.744 -4.502 7.910 1.00 0.00 C ATOM 305 NE ARG A 20 51.497 -5.243 7.575 1.00 0.00 N ATOM 306 CZ ARG A 20 51.530 -6.198 6.687 1.00 0.00 C ATOM 307 NH1 ARG A 20 52.658 -6.511 6.109 1.00 0.00 N ATOM 308 NH2 ARG A 20 50.439 -6.840 6.375 1.00 0.00 N ATOM 0 H ARG A 20 55.466 -0.911 9.865 1.00 0.00 H new ATOM 0 HA ARG A 20 52.542 -0.771 9.595 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.133 -2.183 8.163 1.00 0.00 H new ATOM 0 HB3 ARG A 20 54.430 -3.177 9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 20 51.971 -3.666 9.747 1.00 0.00 H new ATOM 0 HG3 ARG A 20 51.674 -2.672 8.335 1.00 0.00 H new ATOM 0 HD2 ARG A 20 53.227 -4.152 6.997 1.00 0.00 H new ATOM 0 HD3 ARG A 20 53.450 -5.166 8.409 1.00 0.00 H new ATOM 0 HE ARG A 20 50.620 -5.005 8.038 1.00 0.00 H new ATOM 0 HH11 ARG A 20 53.512 -6.009 6.352 1.00 0.00 H new ATOM 0 HH12 ARG A 20 52.685 -7.258 5.414 1.00 0.00 H new ATOM 0 HH21 ARG A 20 49.557 -6.596 6.826 1.00 0.00 H new ATOM 0 HH22 ARG A 20 50.467 -7.586 5.680 1.00 0.00 H new ATOM 322 N GLU A 21 53.990 -2.335 12.127 1.00 0.00 N ATOM 323 CA GLU A 21 53.724 -2.858 13.499 1.00 0.00 C ATOM 324 C GLU A 21 54.900 -2.512 14.416 1.00 0.00 C ATOM 325 O GLU A 21 56.039 -2.483 13.995 1.00 0.00 O ATOM 326 CB GLU A 21 53.552 -4.378 13.444 1.00 0.00 C ATOM 327 CG GLU A 21 53.239 -4.906 14.847 1.00 0.00 C ATOM 328 CD GLU A 21 52.923 -6.401 14.774 1.00 0.00 C ATOM 329 OE1 GLU A 21 52.912 -6.931 13.676 1.00 0.00 O ATOM 330 OE2 GLU A 21 52.698 -6.989 15.819 1.00 0.00 O ATOM 0 H GLU A 21 54.963 -2.393 11.826 1.00 0.00 H new ATOM 0 HA GLU A 21 52.813 -2.403 13.888 1.00 0.00 H new ATOM 0 HB2 GLU A 21 52.747 -4.639 12.757 1.00 0.00 H new ATOM 0 HB3 GLU A 21 54.460 -4.844 13.062 1.00 0.00 H new ATOM 0 HG2 GLU A 21 54.088 -4.735 15.509 1.00 0.00 H new ATOM 0 HG3 GLU A 21 52.392 -4.365 15.270 1.00 0.00 H new ATOM 337 N GLY A 22 54.630 -2.257 15.667 1.00 0.00 N ATOM 338 CA GLY A 22 55.730 -1.921 16.618 1.00 0.00 C ATOM 339 C GLY A 22 56.085 -0.439 16.502 1.00 0.00 C ATOM 340 O GLY A 22 55.258 0.426 16.717 1.00 0.00 O ATOM 0 H GLY A 22 53.694 -2.267 16.073 1.00 0.00 H new ATOM 0 HA2 GLY A 22 55.423 -2.151 17.638 1.00 0.00 H new ATOM 0 HA3 GLY A 22 56.607 -2.532 16.403 1.00 0.00 H new ATOM 344 N ASP A 23 57.315 -0.141 16.171 1.00 0.00 N ATOM 345 CA ASP A 23 57.748 1.286 16.047 1.00 0.00 C ATOM 346 C ASP A 23 58.654 1.437 14.823 1.00 0.00 C ATOM 347 O ASP A 23 59.385 0.537 14.463 1.00 0.00 O ATOM 348 CB ASP A 23 58.522 1.689 17.305 1.00 0.00 C ATOM 349 CG ASP A 23 58.812 3.190 17.272 1.00 0.00 C ATOM 350 OD1 ASP A 23 59.617 3.601 16.452 1.00 0.00 O ATOM 351 OD2 ASP A 23 58.224 3.904 18.067 1.00 0.00 O ATOM 0 H ASP A 23 58.044 -0.829 15.980 1.00 0.00 H new ATOM 0 HA ASP A 23 56.873 1.926 15.934 1.00 0.00 H new ATOM 0 HB2 ASP A 23 57.944 1.440 18.195 1.00 0.00 H new ATOM 0 HB3 ASP A 23 59.456 1.130 17.364 1.00 0.00 H new ATOM 356 N LYS A 24 58.607 2.572 14.183 1.00 0.00 N ATOM 357 CA LYS A 24 59.459 2.795 12.981 1.00 0.00 C ATOM 358 C LYS A 24 60.928 2.905 13.400 1.00 0.00 C ATOM 359 O LYS A 24 61.236 3.413 14.458 1.00 0.00 O ATOM 360 CB LYS A 24 59.022 4.083 12.280 1.00 0.00 C ATOM 361 CG LYS A 24 59.005 5.241 13.281 1.00 0.00 C ATOM 362 CD LYS A 24 58.515 6.508 12.576 1.00 0.00 C ATOM 363 CE LYS A 24 58.514 7.681 13.557 1.00 0.00 C ATOM 364 NZ LYS A 24 58.158 8.929 12.826 1.00 0.00 N ATOM 0 H LYS A 24 58.012 3.359 14.442 1.00 0.00 H new ATOM 0 HA LYS A 24 59.347 1.954 12.296 1.00 0.00 H new ATOM 0 HB2 LYS A 24 59.703 4.310 11.460 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.031 3.952 11.845 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.352 5.002 14.121 1.00 0.00 H new ATOM 0 HG3 LYS A 24 60.003 5.400 13.688 1.00 0.00 H new ATOM 0 HD2 LYS A 24 59.159 6.734 11.726 1.00 0.00 H new ATOM 0 HD3 LYS A 24 57.511 6.351 12.182 1.00 0.00 H new ATOM 0 HE2 LYS A 24 57.800 7.499 14.360 1.00 0.00 H new ATOM 0 HE3 LYS A 24 59.495 7.784 14.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 58.156 9.731 13.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 58.856 9.103 12.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 57.213 8.826 12.404 1.00 0.00 H new ATOM 378 N HIS A 25 61.824 2.410 12.577 1.00 0.00 N ATOM 379 CA HIS A 25 63.287 2.445 12.888 1.00 0.00 C ATOM 380 C HIS A 25 63.633 1.278 13.822 1.00 0.00 C ATOM 381 O HIS A 25 64.702 1.221 14.395 1.00 0.00 O ATOM 382 CB HIS A 25 63.647 3.787 13.543 1.00 0.00 C ATOM 383 CG HIS A 25 65.089 4.137 13.276 1.00 0.00 C ATOM 384 ND1 HIS A 25 65.549 4.482 12.013 1.00 0.00 N ATOM 385 CD2 HIS A 25 66.181 4.211 14.106 1.00 0.00 C ATOM 386 CE1 HIS A 25 66.865 4.747 12.118 1.00 0.00 C ATOM 387 NE2 HIS A 25 67.296 4.597 13.371 1.00 0.00 N ATOM 0 H HIS A 25 61.595 1.974 11.684 1.00 0.00 H new ATOM 0 HA HIS A 25 63.863 2.345 11.968 1.00 0.00 H new ATOM 0 HB2 HIS A 25 62.999 4.573 13.155 1.00 0.00 H new ATOM 0 HB3 HIS A 25 63.473 3.732 14.618 1.00 0.00 H new ATOM 0 HD2 HIS A 25 66.174 4.002 15.166 1.00 0.00 H new ATOM 0 HE1 HIS A 25 67.493 5.044 11.291 1.00 0.00 H new ATOM 0 HE2 HIS A 25 68.245 4.736 13.718 1.00 0.00 H new ATOM 396 N LYS A 26 62.734 0.337 13.959 1.00 0.00 N ATOM 397 CA LYS A 26 62.993 -0.848 14.832 1.00 0.00 C ATOM 398 C LYS A 26 62.266 -2.057 14.231 1.00 0.00 C ATOM 399 O LYS A 26 61.060 -2.164 14.323 1.00 0.00 O ATOM 400 CB LYS A 26 62.453 -0.586 16.241 1.00 0.00 C ATOM 401 CG LYS A 26 63.303 0.479 16.942 1.00 0.00 C ATOM 402 CD LYS A 26 62.747 0.723 18.346 1.00 0.00 C ATOM 403 CE LYS A 26 63.589 1.786 19.055 1.00 0.00 C ATOM 404 NZ LYS A 26 64.925 1.221 19.392 1.00 0.00 N ATOM 0 H LYS A 26 61.823 0.339 13.499 1.00 0.00 H new ATOM 0 HA LYS A 26 64.065 -1.036 14.892 1.00 0.00 H new ATOM 0 HB2 LYS A 26 61.416 -0.256 16.186 1.00 0.00 H new ATOM 0 HB3 LYS A 26 62.463 -1.509 16.820 1.00 0.00 H new ATOM 0 HG2 LYS A 26 64.341 0.152 17.001 1.00 0.00 H new ATOM 0 HG3 LYS A 26 63.293 1.405 16.368 1.00 0.00 H new ATOM 0 HD2 LYS A 26 61.709 1.048 18.285 1.00 0.00 H new ATOM 0 HD3 LYS A 26 62.757 -0.205 18.918 1.00 0.00 H new ATOM 0 HE2 LYS A 26 63.704 2.661 18.415 1.00 0.00 H new ATOM 0 HE3 LYS A 26 63.084 2.119 19.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 65.405 1.846 20.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 64.807 0.277 19.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 65.498 1.145 18.527 1.00 0.00 H new ATOM 418 N LEU A 27 62.981 -2.958 13.603 1.00 0.00 N ATOM 419 CA LEU A 27 62.314 -4.148 12.979 1.00 0.00 C ATOM 420 C LEU A 27 62.482 -5.384 13.867 1.00 0.00 C ATOM 421 O LEU A 27 63.571 -5.725 14.281 1.00 0.00 O ATOM 422 CB LEU A 27 62.954 -4.420 11.617 1.00 0.00 C ATOM 423 CG LEU A 27 62.603 -3.294 10.633 1.00 0.00 C ATOM 424 CD1 LEU A 27 63.452 -3.458 9.369 1.00 0.00 C ATOM 425 CD2 LEU A 27 61.107 -3.341 10.260 1.00 0.00 C ATOM 0 H LEU A 27 63.995 -2.923 13.495 1.00 0.00 H new ATOM 0 HA LEU A 27 61.251 -3.938 12.864 1.00 0.00 H new ATOM 0 HB2 LEU A 27 64.036 -4.496 11.724 1.00 0.00 H new ATOM 0 HB3 LEU A 27 62.605 -5.376 11.227 1.00 0.00 H new ATOM 0 HG LEU A 27 62.809 -2.333 11.104 1.00 0.00 H new ATOM 0 HD11 LEU A 27 63.211 -2.663 8.663 1.00 0.00 H new ATOM 0 HD12 LEU A 27 64.509 -3.402 9.631 1.00 0.00 H new ATOM 0 HD13 LEU A 27 63.242 -4.425 8.912 1.00 0.00 H new ATOM 0 HD21 LEU A 27 60.880 -2.535 9.562 1.00 0.00 H new ATOM 0 HD22 LEU A 27 60.878 -4.299 9.794 1.00 0.00 H new ATOM 0 HD23 LEU A 27 60.504 -3.222 11.160 1.00 0.00 H new ATOM 437 N LYS A 28 61.400 -6.068 14.138 1.00 0.00 N ATOM 438 CA LYS A 28 61.464 -7.303 14.978 1.00 0.00 C ATOM 439 C LYS A 28 61.661 -8.513 14.064 1.00 0.00 C ATOM 440 O LYS A 28 61.443 -8.441 12.871 1.00 0.00 O ATOM 441 CB LYS A 28 60.153 -7.473 15.757 1.00 0.00 C ATOM 442 CG LYS A 28 59.916 -6.271 16.684 1.00 0.00 C ATOM 443 CD LYS A 28 60.835 -6.350 17.912 1.00 0.00 C ATOM 444 CE LYS A 28 60.404 -5.300 18.937 1.00 0.00 C ATOM 445 NZ LYS A 28 59.042 -5.631 19.444 1.00 0.00 N ATOM 0 H LYS A 28 60.466 -5.822 13.810 1.00 0.00 H new ATOM 0 HA LYS A 28 62.293 -7.221 15.681 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.320 -7.572 15.061 1.00 0.00 H new ATOM 0 HB3 LYS A 28 60.189 -8.391 16.344 1.00 0.00 H new ATOM 0 HG2 LYS A 28 60.102 -5.344 16.142 1.00 0.00 H new ATOM 0 HG3 LYS A 28 58.874 -6.250 17.003 1.00 0.00 H new ATOM 0 HD2 LYS A 28 60.787 -7.346 18.353 1.00 0.00 H new ATOM 0 HD3 LYS A 28 61.871 -6.182 17.616 1.00 0.00 H new ATOM 0 HE2 LYS A 28 61.114 -5.270 19.763 1.00 0.00 H new ATOM 0 HE3 LYS A 28 60.403 -4.310 18.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 58.932 -5.262 20.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 58.327 -5.199 18.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 58.916 -6.663 19.451 1.00 0.00 H new ATOM 459 N LYS A 29 62.076 -9.626 14.606 1.00 0.00 N ATOM 460 CA LYS A 29 62.287 -10.827 13.750 1.00 0.00 C ATOM 461 C LYS A 29 60.969 -11.202 13.069 1.00 0.00 C ATOM 462 O LYS A 29 60.940 -11.552 11.906 1.00 0.00 O ATOM 463 CB LYS A 29 62.785 -11.988 14.624 1.00 0.00 C ATOM 464 CG LYS A 29 61.661 -12.470 15.548 1.00 0.00 C ATOM 465 CD LYS A 29 62.232 -13.451 16.578 1.00 0.00 C ATOM 466 CE LYS A 29 61.088 -14.101 17.361 1.00 0.00 C ATOM 467 NZ LYS A 29 61.639 -15.127 18.291 1.00 0.00 N ATOM 0 H LYS A 29 62.277 -9.755 15.598 1.00 0.00 H new ATOM 0 HA LYS A 29 63.032 -10.613 12.983 1.00 0.00 H new ATOM 0 HB2 LYS A 29 63.125 -12.809 13.993 1.00 0.00 H new ATOM 0 HB3 LYS A 29 63.641 -11.666 15.217 1.00 0.00 H new ATOM 0 HG2 LYS A 29 61.202 -11.621 16.054 1.00 0.00 H new ATOM 0 HG3 LYS A 29 60.878 -12.954 14.964 1.00 0.00 H new ATOM 0 HD2 LYS A 29 62.823 -14.217 16.076 1.00 0.00 H new ATOM 0 HD3 LYS A 29 62.902 -12.928 17.261 1.00 0.00 H new ATOM 0 HE2 LYS A 29 60.541 -13.343 17.922 1.00 0.00 H new ATOM 0 HE3 LYS A 29 60.379 -14.562 16.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 60.861 -15.568 18.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 62.142 -15.856 17.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 62.299 -14.675 18.955 1.00 0.00 H new ATOM 481 N SER A 30 59.875 -11.109 13.774 1.00 0.00 N ATOM 482 CA SER A 30 58.562 -11.438 13.152 1.00 0.00 C ATOM 483 C SER A 30 58.304 -10.470 11.993 1.00 0.00 C ATOM 484 O SER A 30 57.826 -10.849 10.945 1.00 0.00 O ATOM 485 CB SER A 30 57.455 -11.294 14.195 1.00 0.00 C ATOM 486 OG SER A 30 56.218 -11.695 13.624 1.00 0.00 O ATOM 0 H SER A 30 59.834 -10.820 14.751 1.00 0.00 H new ATOM 0 HA SER A 30 58.575 -12.463 12.780 1.00 0.00 H new ATOM 0 HB2 SER A 30 57.681 -11.905 15.069 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.393 -10.261 14.536 1.00 0.00 H new ATOM 0 HG SER A 30 55.506 -11.605 14.291 1.00 0.00 H new ATOM 492 N GLU A 31 58.643 -9.223 12.180 1.00 0.00 N ATOM 493 CA GLU A 31 58.444 -8.211 11.098 1.00 0.00 C ATOM 494 C GLU A 31 59.432 -8.495 9.970 1.00 0.00 C ATOM 495 O GLU A 31 59.163 -8.256 8.809 1.00 0.00 O ATOM 496 CB GLU A 31 58.702 -6.810 11.650 1.00 0.00 C ATOM 497 CG GLU A 31 57.584 -6.422 12.617 1.00 0.00 C ATOM 498 CD GLU A 31 57.928 -5.086 13.278 1.00 0.00 C ATOM 499 OE1 GLU A 31 58.975 -4.544 12.964 1.00 0.00 O ATOM 500 OE2 GLU A 31 57.138 -4.626 14.087 1.00 0.00 O ATOM 0 H GLU A 31 59.052 -8.858 13.040 1.00 0.00 H new ATOM 0 HA GLU A 31 57.421 -8.269 10.725 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.664 -6.782 12.162 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.755 -6.091 10.833 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.637 -6.343 12.083 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.459 -7.195 13.376 1.00 0.00 H new ATOM 507 N LEU A 32 60.568 -9.025 10.313 1.00 0.00 N ATOM 508 CA LEU A 32 61.582 -9.356 9.278 1.00 0.00 C ATOM 509 C LEU A 32 61.059 -10.516 8.429 1.00 0.00 C ATOM 510 O LEU A 32 61.227 -10.548 7.226 1.00 0.00 O ATOM 511 CB LEU A 32 62.895 -9.751 9.968 1.00 0.00 C ATOM 512 CG LEU A 32 63.958 -10.145 8.931 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.260 -8.963 7.997 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.239 -10.555 9.668 1.00 0.00 C ATOM 0 H LEU A 32 60.840 -9.245 11.271 1.00 0.00 H new ATOM 0 HA LEU A 32 61.765 -8.494 8.636 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.259 -8.919 10.571 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.718 -10.584 10.648 1.00 0.00 H new ATOM 0 HG LEU A 32 63.586 -10.976 8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.015 -9.259 7.268 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.349 -8.669 7.476 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.631 -8.122 8.583 1.00 0.00 H new ATOM 0 HD21 LEU A 32 66.002 -10.837 8.942 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.599 -9.717 10.266 1.00 0.00 H new ATOM 0 HD23 LEU A 32 65.028 -11.402 10.321 1.00 0.00 H new ATOM 526 N LYS A 33 60.430 -11.471 9.055 1.00 0.00 N ATOM 527 CA LYS A 33 59.894 -12.642 8.303 1.00 0.00 C ATOM 528 C LYS A 33 58.839 -12.191 7.284 1.00 0.00 C ATOM 529 O LYS A 33 58.803 -12.669 6.168 1.00 0.00 O ATOM 530 CB LYS A 33 59.263 -13.629 9.289 1.00 0.00 C ATOM 531 CG LYS A 33 58.831 -14.892 8.541 1.00 0.00 C ATOM 532 CD LYS A 33 58.210 -15.887 9.524 1.00 0.00 C ATOM 533 CE LYS A 33 57.831 -17.169 8.780 1.00 0.00 C ATOM 534 NZ LYS A 33 56.593 -16.936 7.984 1.00 0.00 N ATOM 0 H LYS A 33 60.263 -11.492 10.061 1.00 0.00 H new ATOM 0 HA LYS A 33 60.713 -13.123 7.767 1.00 0.00 H new ATOM 0 HB2 LYS A 33 59.977 -13.884 10.072 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.403 -13.171 9.778 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.111 -14.637 7.763 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.690 -15.344 8.045 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.915 -16.113 10.324 1.00 0.00 H new ATOM 0 HD3 LYS A 33 57.327 -15.450 9.991 1.00 0.00 H new ATOM 0 HE2 LYS A 33 58.646 -17.475 8.124 1.00 0.00 H new ATOM 0 HE3 LYS A 33 57.672 -17.980 9.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 56.166 -17.850 7.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 55.917 -16.382 8.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 56.831 -16.413 7.117 1.00 0.00 H new ATOM 548 N GLU A 34 57.975 -11.285 7.657 1.00 0.00 N ATOM 549 CA GLU A 34 56.924 -10.829 6.696 1.00 0.00 C ATOM 550 C GLU A 34 57.578 -10.211 5.455 1.00 0.00 C ATOM 551 O GLU A 34 57.168 -10.460 4.339 1.00 0.00 O ATOM 552 CB GLU A 34 56.005 -9.787 7.364 1.00 0.00 C ATOM 553 CG GLU A 34 54.959 -10.478 8.258 1.00 0.00 C ATOM 554 CD GLU A 34 55.584 -10.857 9.600 1.00 0.00 C ATOM 555 OE1 GLU A 34 55.709 -9.979 10.439 1.00 0.00 O ATOM 556 OE2 GLU A 34 55.916 -12.019 9.772 1.00 0.00 O ATOM 0 H GLU A 34 57.949 -10.843 8.576 1.00 0.00 H new ATOM 0 HA GLU A 34 56.329 -11.693 6.399 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.602 -9.097 7.961 1.00 0.00 H new ATOM 0 HB3 GLU A 34 55.503 -9.194 6.599 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.110 -9.813 8.418 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.577 -11.370 7.761 1.00 0.00 H new ATOM 563 N LEU A 35 58.570 -9.391 5.641 1.00 0.00 N ATOM 564 CA LEU A 35 59.229 -8.739 4.473 1.00 0.00 C ATOM 565 C LEU A 35 59.812 -9.799 3.533 1.00 0.00 C ATOM 566 O LEU A 35 59.635 -9.742 2.332 1.00 0.00 O ATOM 567 CB LEU A 35 60.351 -7.820 4.984 1.00 0.00 C ATOM 568 CG LEU A 35 61.001 -7.038 3.808 1.00 0.00 C ATOM 569 CD1 LEU A 35 61.388 -5.628 4.269 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.271 -7.750 3.309 1.00 0.00 C ATOM 0 H LEU A 35 58.956 -9.142 6.552 1.00 0.00 H new ATOM 0 HA LEU A 35 58.494 -8.154 3.921 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.949 -7.119 5.715 1.00 0.00 H new ATOM 0 HB3 LEU A 35 61.109 -8.413 5.495 1.00 0.00 H new ATOM 0 HG LEU A 35 60.273 -6.987 2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 35 61.843 -5.086 3.440 1.00 0.00 H new ATOM 0 HD12 LEU A 35 60.497 -5.097 4.604 1.00 0.00 H new ATOM 0 HD13 LEU A 35 62.100 -5.697 5.091 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.707 -7.183 2.486 1.00 0.00 H new ATOM 0 HD22 LEU A 35 62.992 -7.820 4.123 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.015 -8.752 2.964 1.00 0.00 H new ATOM 582 N ILE A 36 60.522 -10.753 4.065 1.00 0.00 N ATOM 583 CA ILE A 36 61.135 -11.804 3.202 1.00 0.00 C ATOM 584 C ILE A 36 60.054 -12.574 2.427 1.00 0.00 C ATOM 585 O ILE A 36 60.178 -12.808 1.241 1.00 0.00 O ATOM 586 CB ILE A 36 61.936 -12.767 4.086 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.159 -12.030 4.644 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.402 -13.971 3.259 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.829 -12.881 5.726 1.00 0.00 C ATOM 0 H ILE A 36 60.706 -10.852 5.063 1.00 0.00 H new ATOM 0 HA ILE A 36 61.795 -11.330 2.476 1.00 0.00 H new ATOM 0 HB ILE A 36 61.306 -13.119 4.903 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.867 -11.822 3.842 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.857 -11.069 5.060 1.00 0.00 H new ATOM 0 HG21 ILE A 36 62.970 -14.651 3.894 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.534 -14.492 2.855 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.033 -13.627 2.439 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.697 -12.352 6.119 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.121 -13.066 6.534 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.146 -13.831 5.297 1.00 0.00 H new ATOM 601 N ASN A 37 59.011 -12.990 3.088 1.00 0.00 N ATOM 602 CA ASN A 37 57.941 -13.767 2.393 1.00 0.00 C ATOM 603 C ASN A 37 57.154 -12.877 1.425 1.00 0.00 C ATOM 604 O ASN A 37 56.497 -13.364 0.527 1.00 0.00 O ATOM 605 CB ASN A 37 56.968 -14.323 3.433 1.00 0.00 C ATOM 606 CG ASN A 37 57.655 -15.412 4.262 1.00 0.00 C ATOM 607 OD1 ASN A 37 57.632 -15.370 5.476 1.00 0.00 O ATOM 608 ND2 ASN A 37 58.266 -16.393 3.657 1.00 0.00 N ATOM 0 H ASN A 37 58.851 -12.826 4.082 1.00 0.00 H new ATOM 0 HA ASN A 37 58.415 -14.572 1.832 1.00 0.00 H new ATOM 0 HB2 ASN A 37 56.623 -13.521 4.085 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.088 -14.732 2.937 1.00 0.00 H new ATOM 0 HD21 ASN A 37 58.723 -17.123 4.203 1.00 0.00 H new ATOM 0 HD22 ASN A 37 58.286 -16.430 2.638 1.00 0.00 H new ATOM 615 N ASN A 38 57.175 -11.586 1.617 1.00 0.00 N ATOM 616 CA ASN A 38 56.383 -10.679 0.726 1.00 0.00 C ATOM 617 C ASN A 38 57.163 -10.285 -0.537 1.00 0.00 C ATOM 618 O ASN A 38 56.645 -9.578 -1.378 1.00 0.00 O ATOM 619 CB ASN A 38 56.026 -9.411 1.505 1.00 0.00 C ATOM 620 CG ASN A 38 54.997 -9.744 2.586 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.262 -10.703 2.466 1.00 0.00 O ATOM 622 ND2 ASN A 38 54.915 -8.987 3.647 1.00 0.00 N ATOM 0 H ASN A 38 57.705 -11.117 2.351 1.00 0.00 H new ATOM 0 HA ASN A 38 55.487 -11.214 0.412 1.00 0.00 H new ATOM 0 HB2 ASN A 38 56.922 -8.987 1.960 1.00 0.00 H new ATOM 0 HB3 ASN A 38 55.625 -8.657 0.828 1.00 0.00 H new ATOM 0 HD21 ASN A 38 54.233 -9.201 4.375 1.00 0.00 H new ATOM 0 HD22 ASN A 38 55.533 -8.181 3.748 1.00 0.00 H new ATOM 629 N GLU A 39 58.382 -10.718 -0.701 1.00 0.00 N ATOM 630 CA GLU A 39 59.115 -10.319 -1.942 1.00 0.00 C ATOM 631 C GLU A 39 60.373 -11.173 -2.152 1.00 0.00 C ATOM 632 O GLU A 39 60.601 -11.685 -3.231 1.00 0.00 O ATOM 633 CB GLU A 39 59.498 -8.832 -1.857 1.00 0.00 C ATOM 634 CG GLU A 39 59.895 -8.474 -0.424 1.00 0.00 C ATOM 635 CD GLU A 39 60.368 -7.018 -0.380 1.00 0.00 C ATOM 636 OE1 GLU A 39 60.683 -6.486 -1.432 1.00 0.00 O ATOM 637 OE2 GLU A 39 60.407 -6.461 0.704 1.00 0.00 O ATOM 0 H GLU A 39 58.894 -11.315 -0.051 1.00 0.00 H new ATOM 0 HA GLU A 39 58.456 -10.483 -2.795 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.325 -8.622 -2.535 1.00 0.00 H new ATOM 0 HB3 GLU A 39 58.659 -8.213 -2.176 1.00 0.00 H new ATOM 0 HG2 GLU A 39 59.047 -8.614 0.246 1.00 0.00 H new ATOM 0 HG3 GLU A 39 60.688 -9.137 -0.077 1.00 0.00 H new ATOM 644 N LEU A 40 61.203 -11.323 -1.157 1.00 0.00 N ATOM 645 CA LEU A 40 62.444 -12.132 -1.357 1.00 0.00 C ATOM 646 C LEU A 40 62.124 -13.619 -1.198 1.00 0.00 C ATOM 647 O LEU A 40 61.664 -14.061 -0.164 1.00 0.00 O ATOM 648 CB LEU A 40 63.494 -11.730 -0.317 1.00 0.00 C ATOM 649 CG LEU A 40 63.839 -10.241 -0.462 1.00 0.00 C ATOM 650 CD1 LEU A 40 64.776 -9.831 0.678 1.00 0.00 C ATOM 651 CD2 LEU A 40 64.526 -9.981 -1.815 1.00 0.00 C ATOM 0 H LEU A 40 61.081 -10.927 -0.225 1.00 0.00 H new ATOM 0 HA LEU A 40 62.831 -11.948 -2.359 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.117 -11.928 0.686 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.393 -12.333 -0.445 1.00 0.00 H new ATOM 0 HG LEU A 40 62.922 -9.654 -0.418 1.00 0.00 H new ATOM 0 HD11 LEU A 40 65.026 -8.774 0.582 1.00 0.00 H new ATOM 0 HD12 LEU A 40 64.282 -10.001 1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 40 65.689 -10.425 0.630 1.00 0.00 H new ATOM 0 HD21 LEU A 40 64.765 -8.921 -1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 40 65.444 -10.566 -1.876 1.00 0.00 H new ATOM 0 HD23 LEU A 40 63.857 -10.271 -2.625 1.00 0.00 H new ATOM 663 N SER A 41 62.368 -14.398 -2.222 1.00 0.00 N ATOM 664 CA SER A 41 62.085 -15.862 -2.141 1.00 0.00 C ATOM 665 C SER A 41 63.056 -16.627 -3.047 1.00 0.00 C ATOM 666 O SER A 41 63.473 -17.726 -2.737 1.00 0.00 O ATOM 667 CB SER A 41 60.649 -16.128 -2.599 1.00 0.00 C ATOM 668 OG SER A 41 60.574 -15.996 -4.012 1.00 0.00 O ATOM 0 H SER A 41 62.752 -14.081 -3.112 1.00 0.00 H new ATOM 0 HA SER A 41 62.211 -16.197 -1.111 1.00 0.00 H new ATOM 0 HB2 SER A 41 60.339 -17.129 -2.299 1.00 0.00 H new ATOM 0 HB3 SER A 41 59.966 -15.426 -2.120 1.00 0.00 H new ATOM 0 HG SER A 41 59.656 -16.168 -4.308 1.00 0.00 H new ATOM 674 N HIS A 42 63.406 -16.062 -4.171 1.00 0.00 N ATOM 675 CA HIS A 42 64.335 -16.762 -5.107 1.00 0.00 C ATOM 676 C HIS A 42 65.791 -16.628 -4.636 1.00 0.00 C ATOM 677 O HIS A 42 66.657 -17.348 -5.090 1.00 0.00 O ATOM 678 CB HIS A 42 64.182 -16.169 -6.517 1.00 0.00 C ATOM 679 CG HIS A 42 63.982 -14.678 -6.439 1.00 0.00 C ATOM 680 ND1 HIS A 42 63.495 -13.947 -7.516 1.00 0.00 N ATOM 681 CD2 HIS A 42 64.192 -13.763 -5.434 1.00 0.00 C ATOM 682 CE1 HIS A 42 63.429 -12.658 -7.136 1.00 0.00 C ATOM 683 NE2 HIS A 42 63.842 -12.495 -5.880 1.00 0.00 N ATOM 0 H HIS A 42 63.089 -15.144 -4.483 1.00 0.00 H new ATOM 0 HA HIS A 42 64.081 -17.822 -5.125 1.00 0.00 H new ATOM 0 HB2 HIS A 42 65.068 -16.393 -7.111 1.00 0.00 H new ATOM 0 HB3 HIS A 42 63.334 -16.630 -7.023 1.00 0.00 H new ATOM 0 HD2 HIS A 42 64.571 -13.995 -4.449 1.00 0.00 H new ATOM 0 HE1 HIS A 42 63.084 -11.855 -7.771 1.00 0.00 H new ATOM 0 HE2 HIS A 42 63.891 -11.622 -5.355 1.00 0.00 H new ATOM 692 N PHE A 43 66.073 -15.716 -3.739 1.00 0.00 N ATOM 693 CA PHE A 43 67.479 -15.543 -3.253 1.00 0.00 C ATOM 694 C PHE A 43 67.623 -16.182 -1.871 1.00 0.00 C ATOM 695 O PHE A 43 68.715 -16.477 -1.426 1.00 0.00 O ATOM 696 CB PHE A 43 67.800 -14.049 -3.157 1.00 0.00 C ATOM 697 CG PHE A 43 67.725 -13.425 -4.535 1.00 0.00 C ATOM 698 CD1 PHE A 43 68.633 -13.814 -5.529 1.00 0.00 C ATOM 699 CD2 PHE A 43 66.751 -12.456 -4.820 1.00 0.00 C ATOM 700 CE1 PHE A 43 68.566 -13.237 -6.804 1.00 0.00 C ATOM 701 CE2 PHE A 43 66.686 -11.882 -6.096 1.00 0.00 C ATOM 702 CZ PHE A 43 67.593 -12.272 -7.087 1.00 0.00 C ATOM 0 H PHE A 43 65.391 -15.083 -3.321 1.00 0.00 H new ATOM 0 HA PHE A 43 68.167 -16.023 -3.949 1.00 0.00 H new ATOM 0 HB2 PHE A 43 67.096 -13.558 -2.485 1.00 0.00 H new ATOM 0 HB3 PHE A 43 68.795 -13.907 -2.736 1.00 0.00 H new ATOM 0 HD1 PHE A 43 69.385 -14.559 -5.312 1.00 0.00 H new ATOM 0 HD2 PHE A 43 66.051 -12.153 -4.055 1.00 0.00 H new ATOM 0 HE1 PHE A 43 69.266 -13.537 -7.569 1.00 0.00 H new ATOM 0 HE2 PHE A 43 65.935 -11.138 -6.315 1.00 0.00 H new ATOM 0 HZ PHE A 43 67.542 -11.828 -8.070 1.00 0.00 H new ATOM 712 N LEU A 44 66.523 -16.402 -1.194 1.00 0.00 N ATOM 713 CA LEU A 44 66.561 -17.032 0.165 1.00 0.00 C ATOM 714 C LEU A 44 65.912 -18.417 0.092 1.00 0.00 C ATOM 715 O LEU A 44 65.211 -18.737 -0.848 1.00 0.00 O ATOM 716 CB LEU A 44 65.794 -16.151 1.167 1.00 0.00 C ATOM 717 CG LEU A 44 66.680 -14.984 1.643 1.00 0.00 C ATOM 718 CD1 LEU A 44 66.920 -13.986 0.495 1.00 0.00 C ATOM 719 CD2 LEU A 44 65.986 -14.270 2.809 1.00 0.00 C ATOM 0 H LEU A 44 65.588 -16.169 -1.529 1.00 0.00 H new ATOM 0 HA LEU A 44 67.595 -17.128 0.496 1.00 0.00 H new ATOM 0 HB2 LEU A 44 64.889 -15.762 0.701 1.00 0.00 H new ATOM 0 HB3 LEU A 44 65.480 -16.750 2.022 1.00 0.00 H new ATOM 0 HG LEU A 44 67.643 -15.378 1.968 1.00 0.00 H new ATOM 0 HD11 LEU A 44 67.548 -13.168 0.849 1.00 0.00 H new ATOM 0 HD12 LEU A 44 67.418 -14.494 -0.331 1.00 0.00 H new ATOM 0 HD13 LEU A 44 65.965 -13.588 0.153 1.00 0.00 H new ATOM 0 HD21 LEU A 44 66.608 -13.443 3.151 1.00 0.00 H new ATOM 0 HD22 LEU A 44 65.021 -13.886 2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 44 65.835 -14.973 3.628 1.00 0.00 H new ATOM 731 N GLU A 45 66.144 -19.240 1.076 1.00 0.00 N ATOM 732 CA GLU A 45 65.548 -20.606 1.069 1.00 0.00 C ATOM 733 C GLU A 45 64.043 -20.507 1.328 1.00 0.00 C ATOM 734 O GLU A 45 63.363 -21.506 1.430 1.00 0.00 O ATOM 735 CB GLU A 45 66.198 -21.453 2.165 1.00 0.00 C ATOM 736 CG GLU A 45 67.674 -21.689 1.828 1.00 0.00 C ATOM 737 CD GLU A 45 68.478 -20.416 2.102 1.00 0.00 C ATOM 738 OE1 GLU A 45 67.927 -19.504 2.695 1.00 0.00 O ATOM 739 OE2 GLU A 45 69.633 -20.375 1.712 1.00 0.00 O ATOM 0 H GLU A 45 66.723 -19.025 1.888 1.00 0.00 H new ATOM 0 HA GLU A 45 65.721 -21.072 0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 45 66.111 -20.949 3.127 1.00 0.00 H new ATOM 0 HB3 GLU A 45 65.679 -22.407 2.257 1.00 0.00 H new ATOM 0 HG2 GLU A 45 68.066 -22.513 2.425 1.00 0.00 H new ATOM 0 HG3 GLU A 45 67.776 -21.977 0.782 1.00 0.00 H new ATOM 746 N GLU A 46 63.532 -19.306 1.439 1.00 0.00 N ATOM 747 CA GLU A 46 62.071 -19.103 1.695 1.00 0.00 C ATOM 748 C GLU A 46 61.778 -19.346 3.179 1.00 0.00 C ATOM 749 O GLU A 46 60.656 -19.606 3.567 1.00 0.00 O ATOM 750 CB GLU A 46 61.232 -20.058 0.824 1.00 0.00 C ATOM 751 CG GLU A 46 59.821 -19.488 0.641 1.00 0.00 C ATOM 752 CD GLU A 46 58.993 -20.441 -0.224 1.00 0.00 C ATOM 753 OE1 GLU A 46 59.574 -21.360 -0.780 1.00 0.00 O ATOM 754 OE2 GLU A 46 57.795 -20.235 -0.320 1.00 0.00 O ATOM 0 H GLU A 46 64.073 -18.445 1.362 1.00 0.00 H new ATOM 0 HA GLU A 46 61.802 -18.079 1.435 1.00 0.00 H new ATOM 0 HB2 GLU A 46 61.709 -20.193 -0.147 1.00 0.00 H new ATOM 0 HB3 GLU A 46 61.179 -21.041 1.292 1.00 0.00 H new ATOM 0 HG2 GLU A 46 59.343 -19.353 1.611 1.00 0.00 H new ATOM 0 HG3 GLU A 46 59.872 -18.506 0.172 1.00 0.00 H new ATOM 761 N ILE A 47 62.781 -19.249 4.010 1.00 0.00 N ATOM 762 CA ILE A 47 62.574 -19.457 5.474 1.00 0.00 C ATOM 763 C ILE A 47 61.742 -20.720 5.709 1.00 0.00 C ATOM 764 O ILE A 47 60.528 -20.695 5.667 1.00 0.00 O ATOM 765 CB ILE A 47 61.836 -18.249 6.055 1.00 0.00 C ATOM 766 CG1 ILE A 47 62.579 -16.955 5.677 1.00 0.00 C ATOM 767 CG2 ILE A 47 61.759 -18.375 7.578 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.050 -17.030 6.108 1.00 0.00 C ATOM 0 H ILE A 47 63.740 -19.034 3.737 1.00 0.00 H new ATOM 0 HA ILE A 47 63.542 -19.570 5.962 1.00 0.00 H new ATOM 0 HB ILE A 47 60.826 -18.215 5.646 1.00 0.00 H new ATOM 0 HG12 ILE A 47 62.518 -16.796 4.600 1.00 0.00 H new ATOM 0 HG13 ILE A 47 62.098 -16.101 6.154 1.00 0.00 H new ATOM 0 HG21 ILE A 47 61.233 -17.513 7.988 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.222 -19.287 7.841 1.00 0.00 H new ATOM 0 HG23 ILE A 47 62.767 -18.415 7.991 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.558 -16.106 5.832 1.00 0.00 H new ATOM 0 HD12 ILE A 47 64.106 -17.166 7.188 1.00 0.00 H new ATOM 0 HD13 ILE A 47 64.532 -17.871 5.611 1.00 0.00 H new ATOM 780 N LYS A 48 62.388 -21.826 5.960 1.00 0.00 N ATOM 781 CA LYS A 48 61.642 -23.093 6.203 1.00 0.00 C ATOM 782 C LYS A 48 61.125 -23.118 7.648 1.00 0.00 C ATOM 783 O LYS A 48 59.939 -23.023 7.894 1.00 0.00 O ATOM 784 CB LYS A 48 62.579 -24.282 5.982 1.00 0.00 C ATOM 785 CG LYS A 48 61.774 -25.583 5.984 1.00 0.00 C ATOM 786 CD LYS A 48 62.723 -26.766 5.788 1.00 0.00 C ATOM 787 CE LYS A 48 61.926 -28.072 5.804 1.00 0.00 C ATOM 788 NZ LYS A 48 61.056 -28.143 4.597 1.00 0.00 N ATOM 0 H LYS A 48 63.404 -21.907 6.007 1.00 0.00 H new ATOM 0 HA LYS A 48 60.799 -23.155 5.515 1.00 0.00 H new ATOM 0 HB2 LYS A 48 63.105 -24.171 5.034 1.00 0.00 H new ATOM 0 HB3 LYS A 48 63.336 -24.311 6.766 1.00 0.00 H new ATOM 0 HG2 LYS A 48 61.233 -25.688 6.925 1.00 0.00 H new ATOM 0 HG3 LYS A 48 61.029 -25.564 5.189 1.00 0.00 H new ATOM 0 HD2 LYS A 48 63.256 -26.665 4.842 1.00 0.00 H new ATOM 0 HD3 LYS A 48 63.474 -26.777 6.578 1.00 0.00 H new ATOM 0 HE2 LYS A 48 62.606 -28.924 5.825 1.00 0.00 H new ATOM 0 HE3 LYS A 48 61.318 -28.127 6.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 60.727 -29.121 4.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 60.236 -27.516 4.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 61.597 -27.842 3.761 1.00 0.00 H new ATOM 802 N GLU A 49 62.015 -23.254 8.604 1.00 0.00 N ATOM 803 CA GLU A 49 61.598 -23.299 10.046 1.00 0.00 C ATOM 804 C GLU A 49 61.988 -21.990 10.739 1.00 0.00 C ATOM 805 O GLU A 49 62.869 -21.279 10.300 1.00 0.00 O ATOM 806 CB GLU A 49 62.314 -24.455 10.752 1.00 0.00 C ATOM 807 CG GLU A 49 61.818 -25.794 10.201 1.00 0.00 C ATOM 808 CD GLU A 49 60.346 -25.990 10.566 1.00 0.00 C ATOM 809 OE1 GLU A 49 60.047 -26.011 11.749 1.00 0.00 O ATOM 810 OE2 GLU A 49 59.543 -26.120 9.657 1.00 0.00 O ATOM 0 H GLU A 49 63.019 -23.336 8.447 1.00 0.00 H new ATOM 0 HA GLU A 49 60.518 -23.440 10.097 1.00 0.00 H new ATOM 0 HB2 GLU A 49 63.391 -24.369 10.607 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.132 -24.405 11.826 1.00 0.00 H new ATOM 0 HG2 GLU A 49 61.940 -25.820 9.118 1.00 0.00 H new ATOM 0 HG3 GLU A 49 62.415 -26.609 10.609 1.00 0.00 H new ATOM 817 N GLN A 50 61.337 -21.671 11.826 1.00 0.00 N ATOM 818 CA GLN A 50 61.668 -20.417 12.560 1.00 0.00 C ATOM 819 C GLN A 50 63.135 -20.452 13.012 1.00 0.00 C ATOM 820 O GLN A 50 63.820 -19.450 13.004 1.00 0.00 O ATOM 821 CB GLN A 50 60.740 -20.271 13.769 1.00 0.00 C ATOM 822 CG GLN A 50 60.981 -21.414 14.757 1.00 0.00 C ATOM 823 CD GLN A 50 59.897 -21.384 15.836 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.221 -22.368 16.065 1.00 0.00 O ATOM 825 NE2 GLN A 50 59.692 -20.283 16.506 1.00 0.00 N ATOM 0 H GLN A 50 60.588 -22.228 12.238 1.00 0.00 H new ATOM 0 HA GLN A 50 61.526 -19.560 11.901 1.00 0.00 H new ATOM 0 HB2 GLN A 50 60.916 -19.313 14.259 1.00 0.00 H new ATOM 0 HB3 GLN A 50 59.700 -20.276 13.442 1.00 0.00 H new ATOM 0 HG2 GLN A 50 60.965 -22.371 14.235 1.00 0.00 H new ATOM 0 HG3 GLN A 50 61.967 -21.315 15.212 1.00 0.00 H new ATOM 0 HE21 GLN A 50 60.259 -19.457 16.315 1.00 0.00 H new ATOM 0 HE22 GLN A 50 58.965 -20.249 17.221 1.00 0.00 H new ATOM 834 N GLU A 51 63.614 -21.597 13.417 1.00 0.00 N ATOM 835 CA GLU A 51 65.032 -21.693 13.883 1.00 0.00 C ATOM 836 C GLU A 51 65.970 -21.132 12.815 1.00 0.00 C ATOM 837 O GLU A 51 67.019 -20.595 13.120 1.00 0.00 O ATOM 838 CB GLU A 51 65.396 -23.158 14.137 1.00 0.00 C ATOM 839 CG GLU A 51 64.655 -23.675 15.370 1.00 0.00 C ATOM 840 CD GLU A 51 65.030 -25.139 15.608 1.00 0.00 C ATOM 841 OE1 GLU A 51 65.666 -25.715 14.740 1.00 0.00 O ATOM 842 OE2 GLU A 51 64.678 -25.658 16.654 1.00 0.00 O ATOM 0 H GLU A 51 63.088 -22.470 13.446 1.00 0.00 H new ATOM 0 HA GLU A 51 65.137 -21.120 14.804 1.00 0.00 H new ATOM 0 HB2 GLU A 51 65.137 -23.762 13.267 1.00 0.00 H new ATOM 0 HB3 GLU A 51 66.472 -23.254 14.282 1.00 0.00 H new ATOM 0 HG2 GLU A 51 64.914 -23.075 16.242 1.00 0.00 H new ATOM 0 HG3 GLU A 51 63.578 -23.582 15.227 1.00 0.00 H new ATOM 849 N VAL A 52 65.604 -21.232 11.572 1.00 0.00 N ATOM 850 CA VAL A 52 66.473 -20.686 10.495 1.00 0.00 C ATOM 851 C VAL A 52 66.519 -19.161 10.618 1.00 0.00 C ATOM 852 O VAL A 52 67.524 -18.534 10.347 1.00 0.00 O ATOM 853 CB VAL A 52 65.905 -21.082 9.127 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.680 -20.364 8.018 1.00 0.00 C ATOM 855 CG2 VAL A 52 66.039 -22.596 8.943 1.00 0.00 C ATOM 0 H VAL A 52 64.739 -21.669 11.253 1.00 0.00 H new ATOM 0 HA VAL A 52 67.481 -21.090 10.591 1.00 0.00 H new ATOM 0 HB VAL A 52 64.854 -20.797 9.075 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.273 -20.648 7.047 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.587 -19.286 8.149 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.732 -20.646 8.068 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.636 -22.881 7.971 1.00 0.00 H new ATOM 0 HG22 VAL A 52 67.091 -22.877 8.997 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.486 -23.109 9.730 1.00 0.00 H new ATOM 865 N VAL A 53 65.432 -18.563 11.025 1.00 0.00 N ATOM 866 CA VAL A 53 65.400 -17.079 11.169 1.00 0.00 C ATOM 867 C VAL A 53 66.350 -16.642 12.291 1.00 0.00 C ATOM 868 O VAL A 53 67.115 -15.709 12.142 1.00 0.00 O ATOM 869 CB VAL A 53 63.971 -16.636 11.512 1.00 0.00 C ATOM 870 CG1 VAL A 53 63.955 -15.136 11.828 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.042 -16.928 10.326 1.00 0.00 C ATOM 0 H VAL A 53 64.563 -19.039 11.265 1.00 0.00 H new ATOM 0 HA VAL A 53 65.716 -16.619 10.233 1.00 0.00 H new ATOM 0 HB VAL A 53 63.623 -17.188 12.385 1.00 0.00 H new ATOM 0 HG11 VAL A 53 62.939 -14.826 12.071 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.608 -14.936 12.678 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.307 -14.578 10.961 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.028 -16.613 10.572 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.389 -16.382 9.449 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.048 -17.997 10.114 1.00 0.00 H new ATOM 881 N ASP A 54 66.294 -17.299 13.417 1.00 0.00 N ATOM 882 CA ASP A 54 67.179 -16.908 14.556 1.00 0.00 C ATOM 883 C ASP A 54 68.648 -17.026 14.154 1.00 0.00 C ATOM 884 O ASP A 54 69.455 -16.173 14.468 1.00 0.00 O ATOM 885 CB ASP A 54 66.905 -17.827 15.749 1.00 0.00 C ATOM 886 CG ASP A 54 65.526 -17.510 16.329 1.00 0.00 C ATOM 887 OD1 ASP A 54 65.104 -16.371 16.211 1.00 0.00 O ATOM 888 OD2 ASP A 54 64.915 -18.410 16.881 1.00 0.00 O ATOM 0 H ASP A 54 65.675 -18.089 13.600 1.00 0.00 H new ATOM 0 HA ASP A 54 66.969 -15.873 14.827 1.00 0.00 H new ATOM 0 HB2 ASP A 54 66.949 -18.870 15.436 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.672 -17.690 16.511 1.00 0.00 H new ATOM 893 N LYS A 55 69.004 -18.064 13.458 1.00 0.00 N ATOM 894 CA LYS A 55 70.423 -18.215 13.035 1.00 0.00 C ATOM 895 C LYS A 55 70.801 -17.029 12.152 1.00 0.00 C ATOM 896 O LYS A 55 71.807 -16.378 12.352 1.00 0.00 O ATOM 897 CB LYS A 55 70.585 -19.520 12.257 1.00 0.00 C ATOM 898 CG LYS A 55 72.057 -19.733 11.901 1.00 0.00 C ATOM 899 CD LYS A 55 72.198 -21.042 11.123 1.00 0.00 C ATOM 900 CE LYS A 55 73.677 -21.333 10.866 1.00 0.00 C ATOM 901 NZ LYS A 55 73.802 -22.597 10.085 1.00 0.00 N ATOM 0 H LYS A 55 68.378 -18.813 13.163 1.00 0.00 H new ATOM 0 HA LYS A 55 71.075 -18.242 13.908 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.221 -20.357 12.853 1.00 0.00 H new ATOM 0 HB3 LYS A 55 69.983 -19.490 11.349 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.424 -18.899 11.303 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.662 -19.767 12.807 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.749 -21.861 11.685 1.00 0.00 H new ATOM 0 HD3 LYS A 55 71.661 -20.973 10.177 1.00 0.00 H new ATOM 0 HE2 LYS A 55 74.132 -20.507 10.319 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.212 -21.422 11.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 74.807 -22.798 9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 73.382 -23.381 10.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.305 -22.495 9.177 1.00 0.00 H new ATOM 915 N VAL A 56 69.990 -16.752 11.173 1.00 0.00 N ATOM 916 CA VAL A 56 70.273 -15.614 10.258 1.00 0.00 C ATOM 917 C VAL A 56 70.128 -14.295 11.020 1.00 0.00 C ATOM 918 O VAL A 56 70.904 -13.375 10.844 1.00 0.00 O ATOM 919 CB VAL A 56 69.274 -15.659 9.096 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.368 -14.373 8.267 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.594 -16.862 8.206 1.00 0.00 C ATOM 0 H VAL A 56 69.136 -17.269 10.965 1.00 0.00 H new ATOM 0 HA VAL A 56 71.290 -15.687 9.872 1.00 0.00 H new ATOM 0 HB VAL A 56 68.264 -15.749 9.495 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.654 -14.417 7.445 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.141 -13.515 8.900 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.377 -14.271 7.866 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.887 -16.900 7.377 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.607 -16.766 7.815 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.517 -17.778 8.791 1.00 0.00 H new ATOM 931 N MET A 57 69.135 -14.191 11.859 1.00 0.00 N ATOM 932 CA MET A 57 68.932 -12.928 12.624 1.00 0.00 C ATOM 933 C MET A 57 70.144 -12.651 13.516 1.00 0.00 C ATOM 934 O MET A 57 70.705 -11.573 13.499 1.00 0.00 O ATOM 935 CB MET A 57 67.678 -13.065 13.492 1.00 0.00 C ATOM 936 CG MET A 57 67.328 -11.712 14.117 1.00 0.00 C ATOM 937 SD MET A 57 66.685 -10.607 12.836 1.00 0.00 S ATOM 938 CE MET A 57 66.115 -9.281 13.930 1.00 0.00 C ATOM 0 H MET A 57 68.454 -14.927 12.048 1.00 0.00 H new ATOM 0 HA MET A 57 68.812 -12.099 11.926 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.844 -13.423 12.888 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.846 -13.805 14.275 1.00 0.00 H new ATOM 0 HG2 MET A 57 66.586 -11.844 14.905 1.00 0.00 H new ATOM 0 HG3 MET A 57 68.212 -11.274 14.581 1.00 0.00 H new ATOM 0 HE1 MET A 57 65.393 -8.658 13.401 1.00 0.00 H new ATOM 0 HE2 MET A 57 65.643 -9.714 14.812 1.00 0.00 H new ATOM 0 HE3 MET A 57 66.965 -8.671 14.236 1.00 0.00 H new ATOM 948 N GLU A 58 70.554 -13.610 14.297 1.00 0.00 N ATOM 949 CA GLU A 58 71.730 -13.386 15.187 1.00 0.00 C ATOM 950 C GLU A 58 72.960 -13.123 14.324 1.00 0.00 C ATOM 951 O GLU A 58 73.763 -12.256 14.606 1.00 0.00 O ATOM 952 CB GLU A 58 71.966 -14.627 16.057 1.00 0.00 C ATOM 953 CG GLU A 58 73.154 -14.393 17.002 1.00 0.00 C ATOM 954 CD GLU A 58 72.854 -13.214 17.932 1.00 0.00 C ATOM 955 OE1 GLU A 58 71.685 -12.941 18.150 1.00 0.00 O ATOM 956 OE2 GLU A 58 73.797 -12.607 18.412 1.00 0.00 O ATOM 0 H GLU A 58 70.129 -14.535 14.359 1.00 0.00 H new ATOM 0 HA GLU A 58 71.543 -12.530 15.835 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.070 -14.850 16.636 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.160 -15.493 15.424 1.00 0.00 H new ATOM 0 HG2 GLU A 58 73.346 -15.291 17.589 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.056 -14.192 16.424 1.00 0.00 H new ATOM 963 N THR A 59 73.103 -13.865 13.265 1.00 0.00 N ATOM 964 CA THR A 59 74.268 -13.670 12.361 1.00 0.00 C ATOM 965 C THR A 59 74.127 -12.324 11.653 1.00 0.00 C ATOM 966 O THR A 59 75.085 -11.600 11.470 1.00 0.00 O ATOM 967 CB THR A 59 74.303 -14.796 11.325 1.00 0.00 C ATOM 968 OG1 THR A 59 74.423 -16.045 11.994 1.00 0.00 O ATOM 969 CG2 THR A 59 75.499 -14.602 10.391 1.00 0.00 C ATOM 0 H THR A 59 72.458 -14.604 12.984 1.00 0.00 H new ATOM 0 HA THR A 59 75.192 -13.686 12.938 1.00 0.00 H new ATOM 0 HB THR A 59 73.384 -14.779 10.740 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.555 -16.501 11.994 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.520 -15.406 9.655 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.409 -13.644 9.879 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.421 -14.618 10.972 1.00 0.00 H new ATOM 977 N LEU A 60 72.932 -11.986 11.255 1.00 0.00 N ATOM 978 CA LEU A 60 72.722 -10.687 10.557 1.00 0.00 C ATOM 979 C LEU A 60 72.901 -9.532 11.542 1.00 0.00 C ATOM 980 O LEU A 60 73.465 -8.508 11.213 1.00 0.00 O ATOM 981 CB LEU A 60 71.309 -10.645 9.962 1.00 0.00 C ATOM 982 CG LEU A 60 71.051 -9.288 9.288 1.00 0.00 C ATOM 983 CD1 LEU A 60 72.103 -9.024 8.200 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.653 -9.309 8.656 1.00 0.00 C ATOM 0 H LEU A 60 72.093 -12.552 11.383 1.00 0.00 H new ATOM 0 HA LEU A 60 73.455 -10.589 9.756 1.00 0.00 H new ATOM 0 HB2 LEU A 60 71.190 -11.448 9.234 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.572 -10.814 10.747 1.00 0.00 H new ATOM 0 HG LEU A 60 71.115 -8.495 10.033 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.908 -8.059 7.731 1.00 0.00 H new ATOM 0 HD12 LEU A 60 73.096 -9.015 8.649 1.00 0.00 H new ATOM 0 HD13 LEU A 60 72.053 -9.810 7.447 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.457 -8.351 8.174 1.00 0.00 H new ATOM 0 HD22 LEU A 60 69.601 -10.106 7.914 1.00 0.00 H new ATOM 0 HD23 LEU A 60 68.906 -9.485 9.430 1.00 0.00 H new ATOM 996 N ASP A 61 72.420 -9.679 12.746 1.00 0.00 N ATOM 997 CA ASP A 61 72.560 -8.575 13.736 1.00 0.00 C ATOM 998 C ASP A 61 74.032 -8.395 14.099 1.00 0.00 C ATOM 999 O ASP A 61 74.601 -9.169 14.843 1.00 0.00 O ATOM 1000 CB ASP A 61 71.760 -8.912 14.997 1.00 0.00 C ATOM 1001 CG ASP A 61 70.263 -8.835 14.689 1.00 0.00 C ATOM 1002 OD1 ASP A 61 69.911 -8.195 13.712 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.494 -9.419 15.435 1.00 0.00 O ATOM 0 H ASP A 61 71.938 -10.512 13.086 1.00 0.00 H new ATOM 0 HA ASP A 61 72.179 -7.651 13.301 1.00 0.00 H new ATOM 0 HB2 ASP A 61 72.019 -9.911 15.348 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.013 -8.217 15.798 1.00 0.00 H new ATOM 1008 N GLU A 62 74.649 -7.376 13.574 1.00 0.00 N ATOM 1009 CA GLU A 62 76.084 -7.134 13.878 1.00 0.00 C ATOM 1010 C GLU A 62 76.261 -6.877 15.377 1.00 0.00 C ATOM 1011 O GLU A 62 77.218 -7.316 15.982 1.00 0.00 O ATOM 1012 CB GLU A 62 76.568 -5.914 13.089 1.00 0.00 C ATOM 1013 CG GLU A 62 76.635 -6.260 11.600 1.00 0.00 C ATOM 1014 CD GLU A 62 77.093 -5.034 10.807 1.00 0.00 C ATOM 1015 OE1 GLU A 62 76.258 -4.195 10.515 1.00 0.00 O ATOM 1016 OE2 GLU A 62 78.273 -4.958 10.503 1.00 0.00 O ATOM 0 H GLU A 62 74.219 -6.698 12.945 1.00 0.00 H new ATOM 0 HA GLU A 62 76.667 -8.010 13.595 1.00 0.00 H new ATOM 0 HB2 GLU A 62 75.892 -5.074 13.248 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.550 -5.604 13.445 1.00 0.00 H new ATOM 0 HG2 GLU A 62 77.326 -7.088 11.440 1.00 0.00 H new ATOM 0 HG3 GLU A 62 75.657 -6.588 11.248 1.00 0.00 H new ATOM 1023 N ASP A 63 75.357 -6.146 15.976 1.00 0.00 N ATOM 1024 CA ASP A 63 75.482 -5.831 17.433 1.00 0.00 C ATOM 1025 C ASP A 63 74.734 -6.860 18.291 1.00 0.00 C ATOM 1026 O ASP A 63 74.838 -6.851 19.502 1.00 0.00 O ATOM 1027 CB ASP A 63 74.900 -4.440 17.687 1.00 0.00 C ATOM 1028 CG ASP A 63 73.428 -4.420 17.273 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.979 -5.402 16.706 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.778 -3.417 17.519 1.00 0.00 O ATOM 0 H ASP A 63 74.535 -5.752 15.519 1.00 0.00 H new ATOM 0 HA ASP A 63 76.536 -5.863 17.709 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.996 -4.181 18.741 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.458 -3.692 17.123 1.00 0.00 H new ATOM 1035 N GLY A 64 73.988 -7.745 17.692 1.00 0.00 N ATOM 1036 CA GLY A 64 73.255 -8.760 18.505 1.00 0.00 C ATOM 1037 C GLY A 64 72.177 -8.073 19.351 1.00 0.00 C ATOM 1038 O GLY A 64 71.793 -8.563 20.396 1.00 0.00 O ATOM 0 H GLY A 64 73.853 -7.811 16.683 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.798 -9.502 17.850 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.952 -9.293 19.152 1.00 0.00 H new ATOM 1042 N ASP A 65 71.683 -6.946 18.915 1.00 0.00 N ATOM 1043 CA ASP A 65 70.634 -6.239 19.703 1.00 0.00 C ATOM 1044 C ASP A 65 69.329 -7.033 19.633 1.00 0.00 C ATOM 1045 O ASP A 65 68.342 -6.676 20.244 1.00 0.00 O ATOM 1046 CB ASP A 65 70.406 -4.845 19.118 1.00 0.00 C ATOM 1047 CG ASP A 65 69.922 -4.977 17.673 1.00 0.00 C ATOM 1048 OD1 ASP A 65 70.138 -6.028 17.093 1.00 0.00 O ATOM 1049 OD2 ASP A 65 69.345 -4.026 17.172 1.00 0.00 O ATOM 0 H ASP A 65 71.960 -6.485 18.048 1.00 0.00 H new ATOM 0 HA ASP A 65 70.958 -6.150 20.740 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.670 -4.304 19.713 1.00 0.00 H new ATOM 0 HB3 ASP A 65 71.330 -4.268 19.153 1.00 0.00 H new ATOM 1054 N GLY A 66 69.325 -8.122 18.913 1.00 0.00 N ATOM 1055 CA GLY A 66 68.093 -8.961 18.820 1.00 0.00 C ATOM 1056 C GLY A 66 67.161 -8.445 17.719 1.00 0.00 C ATOM 1057 O GLY A 66 66.307 -9.166 17.245 1.00 0.00 O ATOM 0 H GLY A 66 70.124 -8.469 18.383 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.368 -9.996 18.614 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.571 -8.954 19.777 1.00 0.00 H new ATOM 1061 N GLU A 67 67.316 -7.210 17.301 1.00 0.00 N ATOM 1062 CA GLU A 67 66.439 -6.643 16.225 1.00 0.00 C ATOM 1063 C GLU A 67 67.316 -6.125 15.089 1.00 0.00 C ATOM 1064 O GLU A 67 68.527 -6.104 15.192 1.00 0.00 O ATOM 1065 CB GLU A 67 65.623 -5.473 16.781 1.00 0.00 C ATOM 1066 CG GLU A 67 64.698 -5.970 17.891 1.00 0.00 C ATOM 1067 CD GLU A 67 65.522 -6.251 19.146 1.00 0.00 C ATOM 1068 OE1 GLU A 67 66.468 -5.519 19.383 1.00 0.00 O ATOM 1069 OE2 GLU A 67 65.196 -7.195 19.846 1.00 0.00 O ATOM 0 H GLU A 67 68.019 -6.565 17.662 1.00 0.00 H new ATOM 0 HA GLU A 67 65.767 -7.421 15.864 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.291 -4.703 17.168 1.00 0.00 H new ATOM 0 HB3 GLU A 67 65.037 -5.015 15.984 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.933 -5.224 18.104 1.00 0.00 H new ATOM 0 HG3 GLU A 67 64.181 -6.875 17.571 1.00 0.00 H new ATOM 1076 N CYS A 68 66.716 -5.707 13.999 1.00 0.00 N ATOM 1077 CA CYS A 68 67.509 -5.182 12.843 1.00 0.00 C ATOM 1078 C CYS A 68 67.314 -3.666 12.735 1.00 0.00 C ATOM 1079 O CYS A 68 66.279 -3.187 12.309 1.00 0.00 O ATOM 1080 CB CYS A 68 67.018 -5.852 11.558 1.00 0.00 C ATOM 1081 SG CYS A 68 67.405 -7.619 11.618 1.00 0.00 S ATOM 0 H CYS A 68 65.705 -5.707 13.861 1.00 0.00 H new ATOM 0 HA CYS A 68 68.567 -5.399 12.992 1.00 0.00 H new ATOM 0 HB2 CYS A 68 65.943 -5.707 11.447 1.00 0.00 H new ATOM 0 HB3 CYS A 68 67.493 -5.393 10.691 1.00 0.00 H new ATOM 0 HG CYS A 68 68.404 -7.817 12.426 1.00 0.00 H new ATOM 1087 N ASP A 69 68.295 -2.909 13.149 1.00 0.00 N ATOM 1088 CA ASP A 69 68.180 -1.423 13.107 1.00 0.00 C ATOM 1089 C ASP A 69 68.212 -0.922 11.657 1.00 0.00 C ATOM 1090 O ASP A 69 68.400 -1.679 10.725 1.00 0.00 O ATOM 1091 CB ASP A 69 69.345 -0.803 13.881 1.00 0.00 C ATOM 1092 CG ASP A 69 69.182 -1.099 15.374 1.00 0.00 C ATOM 1093 OD1 ASP A 69 68.077 -1.425 15.776 1.00 0.00 O ATOM 1094 OD2 ASP A 69 70.165 -0.993 16.090 1.00 0.00 O ATOM 0 H ASP A 69 69.179 -3.260 13.518 1.00 0.00 H new ATOM 0 HA ASP A 69 67.233 -1.131 13.560 1.00 0.00 H new ATOM 0 HB2 ASP A 69 70.291 -1.207 13.521 1.00 0.00 H new ATOM 0 HB3 ASP A 69 69.374 0.274 13.714 1.00 0.00 H new ATOM 1099 N PHE A 70 68.040 0.361 11.474 1.00 0.00 N ATOM 1100 CA PHE A 70 68.073 0.935 10.097 1.00 0.00 C ATOM 1101 C PHE A 70 69.436 0.653 9.462 1.00 0.00 C ATOM 1102 O PHE A 70 69.531 0.222 8.330 1.00 0.00 O ATOM 1103 CB PHE A 70 67.847 2.448 10.154 1.00 0.00 C ATOM 1104 CG PHE A 70 67.893 3.020 8.756 1.00 0.00 C ATOM 1105 CD1 PHE A 70 69.113 3.445 8.216 1.00 0.00 C ATOM 1106 CD2 PHE A 70 66.720 3.122 7.998 1.00 0.00 C ATOM 1107 CE1 PHE A 70 69.160 3.974 6.920 1.00 0.00 C ATOM 1108 CE2 PHE A 70 66.767 3.651 6.703 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.987 4.076 6.163 1.00 0.00 C ATOM 0 H PHE A 70 67.878 1.037 12.220 1.00 0.00 H new ATOM 0 HA PHE A 70 67.284 0.476 9.501 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.883 2.665 10.615 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.610 2.917 10.775 1.00 0.00 H new ATOM 0 HD1 PHE A 70 70.018 3.365 8.799 1.00 0.00 H new ATOM 0 HD2 PHE A 70 65.779 2.792 8.413 1.00 0.00 H new ATOM 0 HE1 PHE A 70 70.101 4.303 6.505 1.00 0.00 H new ATOM 0 HE2 PHE A 70 65.862 3.731 6.120 1.00 0.00 H new ATOM 0 HZ PHE A 70 68.023 4.482 5.163 1.00 0.00 H new ATOM 1119 N GLN A 71 70.490 0.922 10.179 1.00 0.00 N ATOM 1120 CA GLN A 71 71.849 0.699 9.608 1.00 0.00 C ATOM 1121 C GLN A 71 71.987 -0.774 9.213 1.00 0.00 C ATOM 1122 O GLN A 71 72.301 -1.092 8.084 1.00 0.00 O ATOM 1123 CB GLN A 71 72.908 1.054 10.655 1.00 0.00 C ATOM 1124 CG GLN A 71 74.289 1.082 9.997 1.00 0.00 C ATOM 1125 CD GLN A 71 74.393 2.301 9.076 1.00 0.00 C ATOM 1126 OE1 GLN A 71 74.446 3.423 9.540 1.00 0.00 O ATOM 1127 NE2 GLN A 71 74.426 2.129 7.783 1.00 0.00 N ATOM 0 H GLN A 71 70.471 1.285 11.132 1.00 0.00 H new ATOM 0 HA GLN A 71 71.990 1.329 8.730 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.685 2.025 11.098 1.00 0.00 H new ATOM 0 HB3 GLN A 71 72.894 0.323 11.464 1.00 0.00 H new ATOM 0 HG2 GLN A 71 75.066 1.123 10.760 1.00 0.00 H new ATOM 0 HG3 GLN A 71 74.450 0.167 9.426 1.00 0.00 H new ATOM 0 HE21 GLN A 71 74.382 1.188 7.392 1.00 0.00 H new ATOM 0 HE22 GLN A 71 74.496 2.936 7.163 1.00 0.00 H new ATOM 1136 N GLU A 72 71.757 -1.680 10.128 1.00 0.00 N ATOM 1137 CA GLU A 72 71.884 -3.127 9.772 1.00 0.00 C ATOM 1138 C GLU A 72 70.892 -3.439 8.648 1.00 0.00 C ATOM 1139 O GLU A 72 71.200 -4.128 7.696 1.00 0.00 O ATOM 1140 CB GLU A 72 71.550 -3.986 10.995 1.00 0.00 C ATOM 1141 CG GLU A 72 72.659 -3.844 12.040 1.00 0.00 C ATOM 1142 CD GLU A 72 72.324 -4.704 13.261 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.209 -5.196 13.326 1.00 0.00 O ATOM 1144 OE2 GLU A 72 73.187 -4.855 14.110 1.00 0.00 O ATOM 0 H GLU A 72 71.490 -1.486 11.093 1.00 0.00 H new ATOM 0 HA GLU A 72 72.902 -3.344 9.448 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.595 -3.677 11.419 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.445 -5.030 10.701 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.614 -4.153 11.616 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.764 -2.800 12.335 1.00 0.00 H new ATOM 1151 N PHE A 73 69.700 -2.929 8.769 1.00 0.00 N ATOM 1152 CA PHE A 73 68.672 -3.188 7.721 1.00 0.00 C ATOM 1153 C PHE A 73 69.287 -2.867 6.360 1.00 0.00 C ATOM 1154 O PHE A 73 69.199 -3.641 5.427 1.00 0.00 O ATOM 1155 CB PHE A 73 67.441 -2.311 7.957 1.00 0.00 C ATOM 1156 CG PHE A 73 66.491 -2.456 6.793 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.504 -3.448 6.812 1.00 0.00 C ATOM 1158 CD2 PHE A 73 66.596 -1.593 5.697 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.622 -3.577 5.732 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.716 -1.722 4.616 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.728 -2.715 4.635 1.00 0.00 C ATOM 0 H PHE A 73 69.392 -2.345 9.546 1.00 0.00 H new ATOM 0 HA PHE A 73 68.359 -4.231 7.758 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.946 -2.602 8.883 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.740 -1.269 8.069 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.423 -4.113 7.659 1.00 0.00 H new ATOM 0 HD2 PHE A 73 67.357 -0.826 5.685 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.860 -4.342 5.746 1.00 0.00 H new ATOM 0 HE2 PHE A 73 65.799 -1.057 3.769 1.00 0.00 H new ATOM 0 HZ PHE A 73 64.048 -2.815 3.802 1.00 0.00 H new ATOM 1171 N MET A 74 69.939 -1.748 6.252 1.00 0.00 N ATOM 1172 CA MET A 74 70.599 -1.390 4.968 1.00 0.00 C ATOM 1173 C MET A 74 71.773 -2.346 4.742 1.00 0.00 C ATOM 1174 O MET A 74 72.032 -2.793 3.647 1.00 0.00 O ATOM 1175 CB MET A 74 71.117 0.050 5.037 1.00 0.00 C ATOM 1176 CG MET A 74 69.938 1.023 5.136 1.00 0.00 C ATOM 1177 SD MET A 74 68.948 0.951 3.619 1.00 0.00 S ATOM 1178 CE MET A 74 70.137 1.733 2.499 1.00 0.00 C ATOM 0 H MET A 74 70.045 -1.062 7.000 1.00 0.00 H new ATOM 0 HA MET A 74 69.886 -1.471 4.148 1.00 0.00 H new ATOM 0 HB2 MET A 74 71.772 0.169 5.900 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.712 0.275 4.152 1.00 0.00 H new ATOM 0 HG2 MET A 74 69.319 0.771 5.997 1.00 0.00 H new ATOM 0 HG3 MET A 74 70.305 2.037 5.293 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.638 2.516 1.928 1.00 0.00 H new ATOM 0 HE2 MET A 74 70.951 2.169 3.079 1.00 0.00 H new ATOM 0 HE3 MET A 74 70.539 0.985 1.815 1.00 0.00 H new ATOM 1188 N ALA A 75 72.490 -2.658 5.782 1.00 0.00 N ATOM 1189 CA ALA A 75 73.656 -3.576 5.656 1.00 0.00 C ATOM 1190 C ALA A 75 73.217 -4.920 5.062 1.00 0.00 C ATOM 1191 O ALA A 75 74.031 -5.702 4.601 1.00 0.00 O ATOM 1192 CB ALA A 75 74.241 -3.819 7.045 1.00 0.00 C ATOM 0 H ALA A 75 72.317 -2.313 6.726 1.00 0.00 H new ATOM 0 HA ALA A 75 74.398 -3.122 4.999 1.00 0.00 H new ATOM 0 HB1 ALA A 75 75.096 -4.490 6.967 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.562 -2.871 7.476 1.00 0.00 H new ATOM 0 HB3 ALA A 75 73.483 -4.270 7.685 1.00 0.00 H new ATOM 1198 N PHE A 76 71.941 -5.174 5.005 1.00 0.00 N ATOM 1199 CA PHE A 76 71.446 -6.436 4.387 1.00 0.00 C ATOM 1200 C PHE A 76 71.174 -6.149 2.911 1.00 0.00 C ATOM 1201 O PHE A 76 71.253 -7.009 2.057 1.00 0.00 O ATOM 1202 CB PHE A 76 70.146 -6.846 5.079 1.00 0.00 C ATOM 1203 CG PHE A 76 69.604 -8.096 4.438 1.00 0.00 C ATOM 1204 CD1 PHE A 76 68.723 -7.990 3.360 1.00 0.00 C ATOM 1205 CD2 PHE A 76 69.968 -9.355 4.929 1.00 0.00 C ATOM 1206 CE1 PHE A 76 68.202 -9.146 2.766 1.00 0.00 C ATOM 1207 CE2 PHE A 76 69.450 -10.512 4.336 1.00 0.00 C ATOM 1208 CZ PHE A 76 68.567 -10.409 3.255 1.00 0.00 C ATOM 0 H PHE A 76 71.213 -4.556 5.363 1.00 0.00 H new ATOM 0 HA PHE A 76 72.175 -7.239 4.490 1.00 0.00 H new ATOM 0 HB2 PHE A 76 70.326 -7.018 6.140 1.00 0.00 H new ATOM 0 HB3 PHE A 76 69.414 -6.041 5.006 1.00 0.00 H new ATOM 0 HD1 PHE A 76 68.443 -7.017 2.984 1.00 0.00 H new ATOM 0 HD2 PHE A 76 70.648 -9.434 5.765 1.00 0.00 H new ATOM 0 HE1 PHE A 76 67.520 -9.065 1.932 1.00 0.00 H new ATOM 0 HE2 PHE A 76 69.732 -11.484 4.713 1.00 0.00 H new ATOM 0 HZ PHE A 76 68.167 -11.302 2.797 1.00 0.00 H new ATOM 1218 N VAL A 77 70.865 -4.914 2.633 1.00 0.00 N ATOM 1219 CA VAL A 77 70.596 -4.509 1.227 1.00 0.00 C ATOM 1220 C VAL A 77 71.859 -4.797 0.417 1.00 0.00 C ATOM 1221 O VAL A 77 71.801 -5.311 -0.682 1.00 0.00 O ATOM 1222 CB VAL A 77 70.249 -3.017 1.148 1.00 0.00 C ATOM 1223 CG1 VAL A 77 70.161 -2.588 -0.318 1.00 0.00 C ATOM 1224 CG2 VAL A 77 68.903 -2.773 1.839 1.00 0.00 C ATOM 0 H VAL A 77 70.787 -4.166 3.322 1.00 0.00 H new ATOM 0 HA VAL A 77 69.746 -5.066 0.832 1.00 0.00 H new ATOM 0 HB VAL A 77 71.024 -2.435 1.646 1.00 0.00 H new ATOM 0 HG11 VAL A 77 69.914 -1.528 -0.373 1.00 0.00 H new ATOM 0 HG12 VAL A 77 71.119 -2.763 -0.807 1.00 0.00 H new ATOM 0 HG13 VAL A 77 69.386 -3.167 -0.821 1.00 0.00 H new ATOM 0 HG21 VAL A 77 68.653 -1.713 1.785 1.00 0.00 H new ATOM 0 HG22 VAL A 77 68.127 -3.355 1.341 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.970 -3.077 2.884 1.00 0.00 H new ATOM 1234 N SER A 78 73.008 -4.490 0.965 1.00 0.00 N ATOM 1235 CA SER A 78 74.277 -4.771 0.239 1.00 0.00 C ATOM 1236 C SER A 78 74.457 -6.284 0.122 1.00 0.00 C ATOM 1237 O SER A 78 74.804 -6.800 -0.921 1.00 0.00 O ATOM 1238 CB SER A 78 75.455 -4.175 1.009 1.00 0.00 C ATOM 1239 OG SER A 78 76.662 -4.470 0.321 1.00 0.00 O ATOM 0 H SER A 78 73.119 -4.058 1.882 1.00 0.00 H new ATOM 0 HA SER A 78 74.238 -4.324 -0.754 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.333 -3.096 1.106 1.00 0.00 H new ATOM 0 HB3 SER A 78 75.489 -4.584 2.019 1.00 0.00 H new ATOM 0 HG SER A 78 77.254 -3.690 0.350 1.00 0.00 H new ATOM 1245 N MET A 79 74.242 -7.003 1.190 1.00 0.00 N ATOM 1246 CA MET A 79 74.424 -8.484 1.130 1.00 0.00 C ATOM 1247 C MET A 79 73.637 -9.041 -0.058 1.00 0.00 C ATOM 1248 O MET A 79 74.097 -9.916 -0.764 1.00 0.00 O ATOM 1249 CB MET A 79 73.908 -9.118 2.426 1.00 0.00 C ATOM 1250 CG MET A 79 74.839 -8.755 3.584 1.00 0.00 C ATOM 1251 SD MET A 79 74.217 -9.492 5.118 1.00 0.00 S ATOM 1252 CE MET A 79 74.493 -11.230 4.687 1.00 0.00 C ATOM 0 H MET A 79 73.951 -6.634 2.095 1.00 0.00 H new ATOM 0 HA MET A 79 75.482 -8.717 1.011 1.00 0.00 H new ATOM 0 HB2 MET A 79 72.897 -8.768 2.636 1.00 0.00 H new ATOM 0 HB3 MET A 79 73.854 -10.201 2.316 1.00 0.00 H new ATOM 0 HG2 MET A 79 75.848 -9.114 3.379 1.00 0.00 H new ATOM 0 HG3 MET A 79 74.901 -7.672 3.688 1.00 0.00 H new ATOM 0 HE1 MET A 79 74.587 -11.820 5.598 1.00 0.00 H new ATOM 0 HE2 MET A 79 73.650 -11.598 4.101 1.00 0.00 H new ATOM 0 HE3 MET A 79 75.408 -11.319 4.101 1.00 0.00 H new ATOM 1262 N VAL A 80 72.465 -8.534 -0.290 1.00 0.00 N ATOM 1263 CA VAL A 80 71.652 -9.024 -1.440 1.00 0.00 C ATOM 1264 C VAL A 80 72.340 -8.641 -2.758 1.00 0.00 C ATOM 1265 O VAL A 80 72.229 -9.335 -3.749 1.00 0.00 O ATOM 1266 CB VAL A 80 70.256 -8.401 -1.388 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.452 -8.850 -2.610 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.544 -8.862 -0.114 1.00 0.00 C ATOM 0 H VAL A 80 72.029 -7.799 0.267 1.00 0.00 H new ATOM 0 HA VAL A 80 71.563 -10.109 -1.381 1.00 0.00 H new ATOM 0 HB VAL A 80 70.341 -7.314 -1.388 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.457 -8.407 -2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.960 -8.527 -3.519 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.365 -9.937 -2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.548 -8.420 -0.073 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.459 -9.949 -0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 80 70.117 -8.546 0.758 1.00 0.00 H new ATOM 1278 N THR A 81 73.064 -7.552 -2.773 1.00 0.00 N ATOM 1279 CA THR A 81 73.773 -7.143 -4.017 1.00 0.00 C ATOM 1280 C THR A 81 75.081 -7.931 -4.141 1.00 0.00 C ATOM 1281 O THR A 81 75.408 -8.460 -5.185 1.00 0.00 O ATOM 1282 CB THR A 81 74.079 -5.647 -3.954 1.00 0.00 C ATOM 1283 OG1 THR A 81 74.828 -5.364 -2.781 1.00 0.00 O ATOM 1284 CG2 THR A 81 72.772 -4.854 -3.935 1.00 0.00 C ATOM 0 H THR A 81 73.194 -6.929 -1.976 1.00 0.00 H new ATOM 0 HA THR A 81 73.144 -7.350 -4.883 1.00 0.00 H new ATOM 0 HB THR A 81 74.659 -5.360 -4.831 1.00 0.00 H new ATOM 0 HG1 THR A 81 74.725 -6.100 -2.142 1.00 0.00 H new ATOM 0 HG21 THR A 81 72.994 -3.788 -3.890 1.00 0.00 H new ATOM 0 HG22 THR A 81 72.203 -5.068 -4.840 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.186 -5.140 -3.062 1.00 0.00 H new ATOM 1292 N THR A 82 75.828 -8.009 -3.073 1.00 0.00 N ATOM 1293 CA THR A 82 77.117 -8.752 -3.096 1.00 0.00 C ATOM 1294 C THR A 82 76.850 -10.251 -3.205 1.00 0.00 C ATOM 1295 O THR A 82 77.731 -11.026 -3.519 1.00 0.00 O ATOM 1296 CB THR A 82 77.879 -8.469 -1.803 1.00 0.00 C ATOM 1297 OG1 THR A 82 77.160 -9.006 -0.702 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.039 -6.962 -1.625 1.00 0.00 C ATOM 0 H THR A 82 75.595 -7.584 -2.176 1.00 0.00 H new ATOM 0 HA THR A 82 77.706 -8.429 -3.955 1.00 0.00 H new ATOM 0 HB THR A 82 78.864 -8.933 -1.852 1.00 0.00 H new ATOM 0 HG1 THR A 82 77.649 -8.826 0.128 1.00 0.00 H new ATOM 0 HG21 THR A 82 78.583 -6.760 -0.702 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.593 -6.553 -2.470 1.00 0.00 H new ATOM 0 HG23 THR A 82 77.055 -6.495 -1.576 1.00 0.00 H new ATOM 1306 N ALA A 83 75.640 -10.667 -2.958 1.00 0.00 N ATOM 1307 CA ALA A 83 75.321 -12.116 -3.059 1.00 0.00 C ATOM 1308 C ALA A 83 75.349 -12.532 -4.531 1.00 0.00 C ATOM 1309 O ALA A 83 75.915 -13.543 -4.894 1.00 0.00 O ATOM 1310 CB ALA A 83 73.931 -12.363 -2.475 1.00 0.00 C ATOM 0 H ALA A 83 74.860 -10.067 -2.691 1.00 0.00 H new ATOM 0 HA ALA A 83 76.054 -12.702 -2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 83 73.690 -13.424 -2.546 1.00 0.00 H new ATOM 0 HB2 ALA A 83 73.916 -12.056 -1.429 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.194 -11.786 -3.033 1.00 0.00 H new ATOM 1316 N CYS A 84 74.738 -11.749 -5.378 1.00 0.00 N ATOM 1317 CA CYS A 84 74.718 -12.083 -6.830 1.00 0.00 C ATOM 1318 C CYS A 84 76.057 -11.690 -7.458 1.00 0.00 C ATOM 1319 O CYS A 84 76.664 -10.707 -7.082 1.00 0.00 O ATOM 1320 CB CYS A 84 73.587 -11.310 -7.513 1.00 0.00 C ATOM 1321 SG CYS A 84 71.991 -11.956 -6.952 1.00 0.00 S ATOM 0 H CYS A 84 74.250 -10.889 -5.126 1.00 0.00 H new ATOM 0 HA CYS A 84 74.556 -13.153 -6.958 1.00 0.00 H new ATOM 0 HB2 CYS A 84 73.664 -10.248 -7.279 1.00 0.00 H new ATOM 0 HB3 CYS A 84 73.670 -11.404 -8.596 1.00 0.00 H new ATOM 0 HG CYS A 84 71.030 -11.299 -7.530 1.00 0.00 H new ATOM 1327 N HIS A 85 76.525 -12.452 -8.409 1.00 0.00 N ATOM 1328 CA HIS A 85 77.828 -12.118 -9.053 1.00 0.00 C ATOM 1329 C HIS A 85 77.619 -11.014 -10.093 1.00 0.00 C ATOM 1330 O HIS A 85 76.505 -10.654 -10.419 1.00 0.00 O ATOM 1331 CB HIS A 85 78.404 -13.363 -9.733 1.00 0.00 C ATOM 1332 CG HIS A 85 77.459 -13.847 -10.798 1.00 0.00 C ATOM 1333 ND1 HIS A 85 77.544 -13.412 -12.113 1.00 0.00 N ATOM 1334 CD2 HIS A 85 76.413 -14.735 -10.762 1.00 0.00 C ATOM 1335 CE1 HIS A 85 76.575 -14.035 -12.809 1.00 0.00 C ATOM 1336 NE2 HIS A 85 75.860 -14.851 -12.032 1.00 0.00 N ATOM 0 H HIS A 85 76.064 -13.288 -8.767 1.00 0.00 H new ATOM 0 HA HIS A 85 78.526 -11.770 -8.292 1.00 0.00 H new ATOM 0 HB2 HIS A 85 79.374 -13.132 -10.173 1.00 0.00 H new ATOM 0 HB3 HIS A 85 78.567 -14.148 -8.995 1.00 0.00 H new ATOM 0 HD2 HIS A 85 76.072 -15.262 -9.883 1.00 0.00 H new ATOM 0 HE1 HIS A 85 76.398 -13.892 -13.865 1.00 0.00 H new ATOM 0 HE2 HIS A 85 75.073 -15.437 -12.311 1.00 0.00 H new ATOM 1345 N GLU A 86 78.686 -10.465 -10.605 1.00 0.00 N ATOM 1346 CA GLU A 86 78.562 -9.374 -11.614 1.00 0.00 C ATOM 1347 C GLU A 86 77.995 -9.934 -12.920 1.00 0.00 C ATOM 1348 O GLU A 86 78.097 -11.111 -13.199 1.00 0.00 O ATOM 1349 CB GLU A 86 79.944 -8.768 -11.882 1.00 0.00 C ATOM 1350 CG GLU A 86 80.479 -8.126 -10.601 1.00 0.00 C ATOM 1351 CD GLU A 86 79.620 -6.913 -10.236 1.00 0.00 C ATOM 1352 OE1 GLU A 86 78.961 -6.392 -11.120 1.00 0.00 O ATOM 1353 OE2 GLU A 86 79.634 -6.529 -9.078 1.00 0.00 O ATOM 0 H GLU A 86 79.643 -10.726 -10.367 1.00 0.00 H new ATOM 0 HA GLU A 86 77.891 -8.606 -11.229 1.00 0.00 H new ATOM 0 HB2 GLU A 86 80.630 -9.541 -12.228 1.00 0.00 H new ATOM 0 HB3 GLU A 86 79.878 -8.023 -12.674 1.00 0.00 H new ATOM 0 HG2 GLU A 86 80.467 -8.851 -9.787 1.00 0.00 H new ATOM 0 HG3 GLU A 86 81.516 -7.821 -10.741 1.00 0.00 H new ATOM 1360 N PHE A 87 77.401 -9.087 -13.721 1.00 0.00 N ATOM 1361 CA PHE A 87 76.823 -9.539 -15.020 1.00 0.00 C ATOM 1362 C PHE A 87 75.747 -10.601 -14.774 1.00 0.00 C ATOM 1363 O PHE A 87 75.457 -11.415 -15.627 1.00 0.00 O ATOM 1364 CB PHE A 87 77.940 -10.117 -15.895 1.00 0.00 C ATOM 1365 CG PHE A 87 77.453 -10.268 -17.318 1.00 0.00 C ATOM 1366 CD1 PHE A 87 77.464 -9.163 -18.178 1.00 0.00 C ATOM 1367 CD2 PHE A 87 76.992 -11.507 -17.778 1.00 0.00 C ATOM 1368 CE1 PHE A 87 77.014 -9.296 -19.496 1.00 0.00 C ATOM 1369 CE2 PHE A 87 76.542 -11.641 -19.098 1.00 0.00 C ATOM 1370 CZ PHE A 87 76.553 -10.535 -19.957 1.00 0.00 C ATOM 0 H PHE A 87 77.291 -8.092 -13.527 1.00 0.00 H new ATOM 0 HA PHE A 87 76.365 -8.691 -15.529 1.00 0.00 H new ATOM 0 HB2 PHE A 87 78.811 -9.462 -15.867 1.00 0.00 H new ATOM 0 HB3 PHE A 87 78.256 -11.085 -15.505 1.00 0.00 H new ATOM 0 HD1 PHE A 87 77.820 -8.207 -17.823 1.00 0.00 H new ATOM 0 HD2 PHE A 87 76.983 -12.360 -17.115 1.00 0.00 H new ATOM 0 HE1 PHE A 87 77.022 -8.443 -20.158 1.00 0.00 H new ATOM 0 HE2 PHE A 87 76.187 -12.597 -19.453 1.00 0.00 H new ATOM 0 HZ PHE A 87 76.206 -10.638 -20.975 1.00 0.00 H new ATOM 1380 N PHE A 88 75.142 -10.592 -13.616 1.00 0.00 N ATOM 1381 CA PHE A 88 74.079 -11.598 -13.325 1.00 0.00 C ATOM 1382 C PHE A 88 72.949 -11.435 -14.344 1.00 0.00 C ATOM 1383 O PHE A 88 72.387 -12.398 -14.826 1.00 0.00 O ATOM 1384 CB PHE A 88 73.527 -11.360 -11.919 1.00 0.00 C ATOM 1385 CG PHE A 88 72.450 -12.377 -11.625 1.00 0.00 C ATOM 1386 CD1 PHE A 88 71.116 -12.104 -11.956 1.00 0.00 C ATOM 1387 CD2 PHE A 88 72.786 -13.595 -11.024 1.00 0.00 C ATOM 1388 CE1 PHE A 88 70.122 -13.052 -11.685 1.00 0.00 C ATOM 1389 CE2 PHE A 88 71.792 -14.542 -10.753 1.00 0.00 C ATOM 1390 CZ PHE A 88 70.460 -14.270 -11.084 1.00 0.00 C ATOM 0 H PHE A 88 75.337 -9.934 -12.861 1.00 0.00 H new ATOM 0 HA PHE A 88 74.495 -12.604 -13.388 1.00 0.00 H new ATOM 0 HB2 PHE A 88 74.328 -11.439 -11.184 1.00 0.00 H new ATOM 0 HB3 PHE A 88 73.121 -10.351 -11.841 1.00 0.00 H new ATOM 0 HD1 PHE A 88 70.855 -11.164 -12.419 1.00 0.00 H new ATOM 0 HD2 PHE A 88 73.814 -13.805 -10.769 1.00 0.00 H new ATOM 0 HE1 PHE A 88 69.093 -12.843 -11.940 1.00 0.00 H new ATOM 0 HE2 PHE A 88 72.053 -15.482 -10.289 1.00 0.00 H new ATOM 0 HZ PHE A 88 69.692 -15.000 -10.876 1.00 0.00 H new ATOM 1400 N GLU A 89 72.619 -10.219 -14.672 1.00 0.00 N ATOM 1401 CA GLU A 89 71.531 -9.983 -15.661 1.00 0.00 C ATOM 1402 C GLU A 89 71.961 -10.536 -17.021 1.00 0.00 C ATOM 1403 O GLU A 89 73.103 -10.406 -17.414 1.00 0.00 O ATOM 1404 CB GLU A 89 71.273 -8.479 -15.792 1.00 0.00 C ATOM 1405 CG GLU A 89 70.754 -7.925 -14.464 1.00 0.00 C ATOM 1406 CD GLU A 89 70.502 -6.423 -14.607 1.00 0.00 C ATOM 1407 OE1 GLU A 89 70.880 -5.874 -15.630 1.00 0.00 O ATOM 1408 OE2 GLU A 89 69.940 -5.845 -13.692 1.00 0.00 O ATOM 0 H GLU A 89 73.056 -9.377 -14.298 1.00 0.00 H new ATOM 0 HA GLU A 89 70.621 -10.481 -15.326 1.00 0.00 H new ATOM 0 HB2 GLU A 89 72.192 -7.966 -16.076 1.00 0.00 H new ATOM 0 HB3 GLU A 89 70.547 -8.293 -16.583 1.00 0.00 H new ATOM 0 HG2 GLU A 89 69.833 -8.434 -14.179 1.00 0.00 H new ATOM 0 HG3 GLU A 89 71.479 -8.110 -13.671 1.00 0.00 H new ATOM 1415 N HIS A 90 71.058 -11.153 -17.736 1.00 0.00 N ATOM 1416 CA HIS A 90 71.403 -11.719 -19.077 1.00 0.00 C ATOM 1417 C HIS A 90 72.572 -12.691 -18.949 1.00 0.00 C ATOM 1418 O HIS A 90 73.322 -12.901 -19.882 1.00 0.00 O ATOM 1419 CB HIS A 90 71.815 -10.594 -20.020 1.00 0.00 C ATOM 1420 CG HIS A 90 70.731 -9.557 -20.085 1.00 0.00 C ATOM 1421 ND1 HIS A 90 70.769 -8.399 -19.319 1.00 0.00 N ATOM 1422 CD2 HIS A 90 69.575 -9.482 -20.821 1.00 0.00 C ATOM 1423 CE1 HIS A 90 69.667 -7.684 -19.610 1.00 0.00 C ATOM 1424 NE2 HIS A 90 68.909 -8.301 -20.518 1.00 0.00 N ATOM 0 H HIS A 90 70.089 -11.291 -17.448 1.00 0.00 H new ATOM 0 HA HIS A 90 70.529 -12.239 -19.470 1.00 0.00 H new ATOM 0 HB2 HIS A 90 72.744 -10.140 -19.674 1.00 0.00 H new ATOM 0 HB3 HIS A 90 72.007 -10.994 -21.015 1.00 0.00 H new ATOM 0 HD2 HIS A 90 69.236 -10.226 -21.527 1.00 0.00 H new ATOM 0 HE1 HIS A 90 69.426 -6.730 -19.164 1.00 0.00 H new ATOM 0 HE2 HIS A 90 68.025 -7.974 -20.908 1.00 0.00 H new ATOM 1433 N GLU A 91 72.734 -13.287 -17.810 1.00 0.00 N ATOM 1434 CA GLU A 91 73.860 -14.248 -17.630 1.00 0.00 C ATOM 1435 C GLU A 91 73.763 -15.348 -18.688 1.00 0.00 C ATOM 1436 O GLU A 91 74.635 -15.400 -19.540 1.00 0.00 O ATOM 1437 CB GLU A 91 73.792 -14.874 -16.236 1.00 0.00 C ATOM 1438 CG GLU A 91 74.951 -15.858 -16.067 1.00 0.00 C ATOM 1439 CD GLU A 91 75.032 -16.311 -14.607 1.00 0.00 C ATOM 1440 OE1 GLU A 91 74.285 -15.782 -13.800 1.00 0.00 O ATOM 1441 OE2 GLU A 91 75.843 -17.177 -14.321 1.00 0.00 O ATOM 1442 OXT GLU A 91 72.820 -16.120 -18.629 1.00 0.00 O ATOM 0 H GLU A 91 72.139 -13.155 -16.992 1.00 0.00 H new ATOM 0 HA GLU A 91 74.806 -13.717 -17.738 1.00 0.00 H new ATOM 0 HB2 GLU A 91 73.845 -14.097 -15.473 1.00 0.00 H new ATOM 0 HB3 GLU A 91 72.840 -15.388 -16.102 1.00 0.00 H new ATOM 0 HG2 GLU A 91 74.807 -16.720 -16.718 1.00 0.00 H new ATOM 0 HG3 GLU A 91 75.888 -15.387 -16.364 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 59.798 -6.754 -6.478 1.00 0.00 N ATOM 1451 CA SER B 1 58.913 -5.903 -7.322 1.00 0.00 C ATOM 1452 C SER B 1 59.527 -4.506 -7.455 1.00 0.00 C ATOM 1453 O SER B 1 60.642 -4.347 -7.911 1.00 0.00 O ATOM 1454 CB SER B 1 57.533 -5.800 -6.666 1.00 0.00 C ATOM 1455 OG SER B 1 56.617 -5.224 -7.588 1.00 0.00 O ATOM 0 H1 SER B 1 59.289 -7.619 -6.204 1.00 0.00 H new ATOM 0 H2 SER B 1 60.650 -7.010 -7.017 1.00 0.00 H new ATOM 0 H3 SER B 1 60.073 -6.228 -5.624 1.00 0.00 H new ATOM 0 HA SER B 1 58.811 -6.348 -8.312 1.00 0.00 H new ATOM 0 HB2 SER B 1 57.188 -6.788 -6.362 1.00 0.00 H new ATOM 0 HB3 SER B 1 57.591 -5.191 -5.764 1.00 0.00 H new ATOM 0 HG SER B 1 55.732 -5.158 -7.172 1.00 0.00 H new ATOM 1463 N GLU B 2 58.801 -3.491 -7.075 1.00 0.00 N ATOM 1464 CA GLU B 2 59.322 -2.098 -7.191 1.00 0.00 C ATOM 1465 C GLU B 2 60.601 -1.941 -6.363 1.00 0.00 C ATOM 1466 O GLU B 2 61.525 -1.262 -6.765 1.00 0.00 O ATOM 1467 CB GLU B 2 58.256 -1.123 -6.675 1.00 0.00 C ATOM 1468 CG GLU B 2 58.697 0.327 -6.927 1.00 0.00 C ATOM 1469 CD GLU B 2 59.700 0.772 -5.856 1.00 0.00 C ATOM 1470 OE1 GLU B 2 59.754 0.140 -4.814 1.00 0.00 O ATOM 1471 OE2 GLU B 2 60.394 1.746 -6.096 1.00 0.00 O ATOM 0 H GLU B 2 57.861 -3.567 -6.686 1.00 0.00 H new ATOM 0 HA GLU B 2 59.551 -1.884 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU B 2 57.306 -1.314 -7.174 1.00 0.00 H new ATOM 0 HB3 GLU B 2 58.093 -1.281 -5.609 1.00 0.00 H new ATOM 0 HG2 GLU B 2 59.149 0.410 -7.915 1.00 0.00 H new ATOM 0 HG3 GLU B 2 57.828 0.985 -6.917 1.00 0.00 H new ATOM 1478 N LEU B 3 60.670 -2.562 -5.219 1.00 0.00 N ATOM 1479 CA LEU B 3 61.894 -2.451 -4.375 1.00 0.00 C ATOM 1480 C LEU B 3 63.053 -3.202 -5.040 1.00 0.00 C ATOM 1481 O LEU B 3 64.195 -2.791 -4.968 1.00 0.00 O ATOM 1482 CB LEU B 3 61.605 -3.068 -3.001 1.00 0.00 C ATOM 1483 CG LEU B 3 62.834 -2.952 -2.087 1.00 0.00 C ATOM 1484 CD1 LEU B 3 63.153 -1.471 -1.815 1.00 0.00 C ATOM 1485 CD2 LEU B 3 62.534 -3.667 -0.764 1.00 0.00 C ATOM 0 H LEU B 3 59.929 -3.144 -4.830 1.00 0.00 H new ATOM 0 HA LEU B 3 62.169 -1.402 -4.262 1.00 0.00 H new ATOM 0 HB2 LEU B 3 60.755 -2.564 -2.542 1.00 0.00 H new ATOM 0 HB3 LEU B 3 61.329 -4.116 -3.118 1.00 0.00 H new ATOM 0 HG LEU B 3 63.695 -3.411 -2.572 1.00 0.00 H new ATOM 0 HD11 LEU B 3 64.026 -1.400 -1.166 1.00 0.00 H new ATOM 0 HD12 LEU B 3 63.359 -0.964 -2.758 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.300 -0.998 -1.328 1.00 0.00 H new ATOM 0 HD21 LEU B 3 63.399 -3.592 -0.106 1.00 0.00 H new ATOM 0 HD22 LEU B 3 61.673 -3.201 -0.286 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.317 -4.717 -0.959 1.00 0.00 H new ATOM 1497 N GLU B 4 62.769 -4.304 -5.682 1.00 0.00 N ATOM 1498 CA GLU B 4 63.855 -5.084 -6.343 1.00 0.00 C ATOM 1499 C GLU B 4 64.442 -4.275 -7.500 1.00 0.00 C ATOM 1500 O GLU B 4 65.638 -4.263 -7.715 1.00 0.00 O ATOM 1501 CB GLU B 4 63.277 -6.403 -6.869 1.00 0.00 C ATOM 1502 CG GLU B 4 64.399 -7.290 -7.419 1.00 0.00 C ATOM 1503 CD GLU B 4 65.323 -7.718 -6.276 1.00 0.00 C ATOM 1504 OE1 GLU B 4 64.893 -7.652 -5.137 1.00 0.00 O ATOM 1505 OE2 GLU B 4 66.443 -8.108 -6.562 1.00 0.00 O ATOM 0 H GLU B 4 61.833 -4.697 -5.777 1.00 0.00 H new ATOM 0 HA GLU B 4 64.646 -5.294 -5.623 1.00 0.00 H new ATOM 0 HB2 GLU B 4 62.752 -6.923 -6.068 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.546 -6.202 -7.652 1.00 0.00 H new ATOM 0 HG2 GLU B 4 63.976 -8.168 -7.906 1.00 0.00 H new ATOM 0 HG3 GLU B 4 64.967 -6.748 -8.175 1.00 0.00 H new ATOM 1512 N LYS B 5 63.618 -3.595 -8.249 1.00 0.00 N ATOM 1513 CA LYS B 5 64.146 -2.789 -9.389 1.00 0.00 C ATOM 1514 C LYS B 5 65.068 -1.684 -8.866 1.00 0.00 C ATOM 1515 O LYS B 5 66.093 -1.393 -9.450 1.00 0.00 O ATOM 1516 CB LYS B 5 62.988 -2.164 -10.178 1.00 0.00 C ATOM 1517 CG LYS B 5 62.226 -3.258 -10.933 1.00 0.00 C ATOM 1518 CD LYS B 5 61.071 -2.630 -11.720 1.00 0.00 C ATOM 1519 CE LYS B 5 60.311 -3.723 -12.474 1.00 0.00 C ATOM 1520 NZ LYS B 5 59.034 -3.169 -13.012 1.00 0.00 N ATOM 0 H LYS B 5 62.606 -3.562 -8.123 1.00 0.00 H new ATOM 0 HA LYS B 5 64.711 -3.447 -10.049 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.314 -1.640 -9.500 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.372 -1.424 -10.880 1.00 0.00 H new ATOM 0 HG2 LYS B 5 62.899 -3.782 -11.611 1.00 0.00 H new ATOM 0 HG3 LYS B 5 61.841 -3.998 -10.231 1.00 0.00 H new ATOM 0 HD2 LYS B 5 60.397 -2.106 -11.042 1.00 0.00 H new ATOM 0 HD3 LYS B 5 61.456 -1.890 -12.422 1.00 0.00 H new ATOM 0 HE2 LYS B 5 60.923 -4.109 -13.289 1.00 0.00 H new ATOM 0 HE3 LYS B 5 60.103 -4.560 -11.808 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 58.520 -3.915 -13.524 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 58.448 -2.822 -12.226 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 59.243 -2.384 -13.662 1.00 0.00 H new ATOM 1534 N ALA B 6 64.712 -1.064 -7.778 1.00 0.00 N ATOM 1535 CA ALA B 6 65.571 0.022 -7.227 1.00 0.00 C ATOM 1536 C ALA B 6 66.951 -0.539 -6.865 1.00 0.00 C ATOM 1537 O ALA B 6 67.972 0.034 -7.190 1.00 0.00 O ATOM 1538 CB ALA B 6 64.916 0.612 -5.976 1.00 0.00 C ATOM 0 H ALA B 6 63.864 -1.261 -7.246 1.00 0.00 H new ATOM 0 HA ALA B 6 65.686 0.802 -7.979 1.00 0.00 H new ATOM 0 HB1 ALA B 6 65.546 1.406 -5.575 1.00 0.00 H new ATOM 0 HB2 ALA B 6 63.939 1.020 -6.235 1.00 0.00 H new ATOM 0 HB3 ALA B 6 64.795 -0.169 -5.226 1.00 0.00 H new ATOM 1544 N MET B 7 66.985 -1.657 -6.192 1.00 0.00 N ATOM 1545 CA MET B 7 68.294 -2.262 -5.805 1.00 0.00 C ATOM 1546 C MET B 7 69.098 -2.564 -7.072 1.00 0.00 C ATOM 1547 O MET B 7 70.261 -2.223 -7.190 1.00 0.00 O ATOM 1548 CB MET B 7 68.030 -3.568 -5.054 1.00 0.00 C ATOM 1549 CG MET B 7 69.328 -4.082 -4.431 1.00 0.00 C ATOM 1550 SD MET B 7 69.068 -5.763 -3.803 1.00 0.00 S ATOM 1551 CE MET B 7 67.854 -5.362 -2.518 1.00 0.00 C ATOM 0 H MET B 7 66.162 -2.179 -5.892 1.00 0.00 H new ATOM 0 HA MET B 7 68.852 -1.574 -5.170 1.00 0.00 H new ATOM 0 HB2 MET B 7 67.283 -3.406 -4.277 1.00 0.00 H new ATOM 0 HB3 MET B 7 67.624 -4.314 -5.737 1.00 0.00 H new ATOM 0 HG2 MET B 7 70.127 -4.078 -5.172 1.00 0.00 H new ATOM 0 HG3 MET B 7 69.642 -3.423 -3.621 1.00 0.00 H new ATOM 0 HE1 MET B 7 68.058 -5.955 -1.627 1.00 0.00 H new ATOM 0 HE2 MET B 7 67.921 -4.302 -2.272 1.00 0.00 H new ATOM 0 HE3 MET B 7 66.851 -5.587 -2.882 1.00 0.00 H new ATOM 1561 N VAL B 8 68.476 -3.218 -8.011 1.00 0.00 N ATOM 1562 CA VAL B 8 69.167 -3.583 -9.279 1.00 0.00 C ATOM 1563 C VAL B 8 69.660 -2.317 -9.982 1.00 0.00 C ATOM 1564 O VAL B 8 70.692 -2.320 -10.623 1.00 0.00 O ATOM 1565 CB VAL B 8 68.181 -4.338 -10.180 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.780 -4.523 -11.577 1.00 0.00 C ATOM 1567 CG2 VAL B 8 67.892 -5.710 -9.566 1.00 0.00 C ATOM 0 H VAL B 8 67.503 -3.520 -7.953 1.00 0.00 H new ATOM 0 HA VAL B 8 70.026 -4.219 -9.065 1.00 0.00 H new ATOM 0 HB VAL B 8 67.258 -3.764 -10.263 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.072 -5.060 -12.208 1.00 0.00 H new ATOM 0 HG12 VAL B 8 68.989 -3.547 -12.015 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.706 -5.094 -11.503 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.192 -6.253 -10.201 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.821 -6.275 -9.484 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.458 -5.581 -8.575 1.00 0.00 H new ATOM 1577 N ALA B 9 68.935 -1.239 -9.884 1.00 0.00 N ATOM 1578 CA ALA B 9 69.381 0.009 -10.566 1.00 0.00 C ATOM 1579 C ALA B 9 70.758 0.423 -10.034 1.00 0.00 C ATOM 1580 O ALA B 9 71.608 0.864 -10.779 1.00 0.00 O ATOM 1581 CB ALA B 9 68.369 1.130 -10.295 1.00 0.00 C ATOM 0 H ALA B 9 68.059 -1.166 -9.366 1.00 0.00 H new ATOM 0 HA ALA B 9 69.447 -0.170 -11.639 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.695 2.043 -10.794 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.391 0.837 -10.677 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.301 1.307 -9.222 1.00 0.00 H new ATOM 1587 N LEU B 10 70.983 0.295 -8.755 1.00 0.00 N ATOM 1588 CA LEU B 10 72.309 0.694 -8.187 1.00 0.00 C ATOM 1589 C LEU B 10 73.439 -0.149 -8.800 1.00 0.00 C ATOM 1590 O LEU B 10 74.470 0.371 -9.178 1.00 0.00 O ATOM 1591 CB LEU B 10 72.307 0.498 -6.658 1.00 0.00 C ATOM 1592 CG LEU B 10 71.591 1.662 -5.956 1.00 0.00 C ATOM 1593 CD1 LEU B 10 70.076 1.511 -6.100 1.00 0.00 C ATOM 1594 CD2 LEU B 10 71.959 1.654 -4.469 1.00 0.00 C ATOM 0 H LEU B 10 70.311 -0.067 -8.078 1.00 0.00 H new ATOM 0 HA LEU B 10 72.479 1.744 -8.425 1.00 0.00 H new ATOM 0 HB2 LEU B 10 71.813 -0.441 -6.409 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.332 0.425 -6.296 1.00 0.00 H new ATOM 0 HG LEU B 10 71.901 2.601 -6.414 1.00 0.00 H new ATOM 0 HD11 LEU B 10 69.578 2.341 -5.599 1.00 0.00 H new ATOM 0 HD12 LEU B 10 69.809 1.512 -7.157 1.00 0.00 H new ATOM 0 HD13 LEU B 10 69.759 0.571 -5.647 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.454 2.478 -3.965 1.00 0.00 H new ATOM 0 HD22 LEU B 10 71.648 0.710 -4.022 1.00 0.00 H new ATOM 0 HD23 LEU B 10 73.038 1.769 -4.360 1.00 0.00 H new ATOM 1606 N ILE B 11 73.269 -1.444 -8.890 1.00 0.00 N ATOM 1607 CA ILE B 11 74.363 -2.284 -9.467 1.00 0.00 C ATOM 1608 C ILE B 11 74.639 -1.834 -10.896 1.00 0.00 C ATOM 1609 O ILE B 11 75.768 -1.594 -11.276 1.00 0.00 O ATOM 1610 CB ILE B 11 73.943 -3.753 -9.477 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.709 -4.224 -8.042 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.057 -4.593 -10.110 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.023 -5.590 -8.064 1.00 0.00 C ATOM 0 H ILE B 11 72.434 -1.950 -8.594 1.00 0.00 H new ATOM 0 HA ILE B 11 75.261 -2.171 -8.859 1.00 0.00 H new ATOM 0 HB ILE B 11 73.025 -3.867 -10.053 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.658 -4.289 -7.509 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.092 -3.503 -7.506 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.761 -5.642 -10.119 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.231 -4.256 -11.132 1.00 0.00 H new ATOM 0 HG23 ILE B 11 75.973 -4.479 -9.530 1.00 0.00 H new ATOM 0 HD11 ILE B 11 72.855 -5.929 -7.042 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.067 -5.509 -8.582 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.658 -6.307 -8.584 1.00 0.00 H new ATOM 1625 N ASP B 12 73.618 -1.716 -11.694 1.00 0.00 N ATOM 1626 CA ASP B 12 73.829 -1.282 -13.098 1.00 0.00 C ATOM 1627 C ASP B 12 74.475 0.102 -13.085 1.00 0.00 C ATOM 1628 O ASP B 12 75.367 0.393 -13.857 1.00 0.00 O ATOM 1629 CB ASP B 12 72.477 -1.219 -13.814 1.00 0.00 C ATOM 1630 CG ASP B 12 71.961 -2.638 -14.060 1.00 0.00 C ATOM 1631 OD1 ASP B 12 72.772 -3.549 -14.057 1.00 0.00 O ATOM 1632 OD2 ASP B 12 70.766 -2.789 -14.252 1.00 0.00 O ATOM 0 H ASP B 12 72.649 -1.901 -11.435 1.00 0.00 H new ATOM 0 HA ASP B 12 74.476 -1.986 -13.621 1.00 0.00 H new ATOM 0 HB2 ASP B 12 71.761 -0.660 -13.212 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.580 -0.689 -14.761 1.00 0.00 H new ATOM 1637 N VAL B 13 74.042 0.950 -12.196 1.00 0.00 N ATOM 1638 CA VAL B 13 74.643 2.307 -12.112 1.00 0.00 C ATOM 1639 C VAL B 13 76.070 2.206 -11.554 1.00 0.00 C ATOM 1640 O VAL B 13 76.972 2.880 -12.009 1.00 0.00 O ATOM 1641 CB VAL B 13 73.781 3.193 -11.206 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.514 4.506 -10.915 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.456 3.500 -11.911 1.00 0.00 C ATOM 0 H VAL B 13 73.298 0.761 -11.524 1.00 0.00 H new ATOM 0 HA VAL B 13 74.684 2.751 -13.107 1.00 0.00 H new ATOM 0 HB VAL B 13 73.589 2.671 -10.268 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.897 5.132 -10.271 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.459 4.292 -10.416 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.708 5.029 -11.851 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.840 4.130 -11.269 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.654 4.020 -12.848 1.00 0.00 H new ATOM 0 HG23 VAL B 13 71.929 2.568 -12.118 1.00 0.00 H new ATOM 1653 N PHE B 14 76.277 1.374 -10.564 1.00 0.00 N ATOM 1654 CA PHE B 14 77.642 1.238 -9.970 1.00 0.00 C ATOM 1655 C PHE B 14 78.606 0.632 -10.990 1.00 0.00 C ATOM 1656 O PHE B 14 79.645 1.189 -11.281 1.00 0.00 O ATOM 1657 CB PHE B 14 77.569 0.330 -8.739 1.00 0.00 C ATOM 1658 CG PHE B 14 78.951 0.123 -8.160 1.00 0.00 C ATOM 1659 CD1 PHE B 14 79.443 0.999 -7.182 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.737 -0.953 -8.592 1.00 0.00 C ATOM 1661 CE1 PHE B 14 80.720 0.798 -6.641 1.00 0.00 C ATOM 1662 CE2 PHE B 14 81.014 -1.152 -8.051 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.505 -0.277 -7.076 1.00 0.00 C ATOM 0 H PHE B 14 75.560 0.784 -10.142 1.00 0.00 H new ATOM 0 HA PHE B 14 78.005 2.225 -9.683 1.00 0.00 H new ATOM 0 HB2 PHE B 14 76.915 0.774 -7.989 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.134 -0.631 -9.012 1.00 0.00 H new ATOM 0 HD1 PHE B 14 78.838 1.828 -6.846 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.358 -1.630 -9.343 1.00 0.00 H new ATOM 0 HE1 PHE B 14 81.099 1.473 -5.888 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.619 -1.981 -8.387 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.489 -0.431 -6.659 1.00 0.00 H new ATOM 1673 N HIS B 15 78.300 -0.531 -11.496 1.00 0.00 N ATOM 1674 CA HIS B 15 79.229 -1.200 -12.449 1.00 0.00 C ATOM 1675 C HIS B 15 79.466 -0.339 -13.687 1.00 0.00 C ATOM 1676 O HIS B 15 80.582 -0.229 -14.155 1.00 0.00 O ATOM 1677 CB HIS B 15 78.614 -2.535 -12.869 1.00 0.00 C ATOM 1678 CG HIS B 15 79.523 -3.239 -13.838 1.00 0.00 C ATOM 1679 ND1 HIS B 15 79.343 -3.154 -15.212 1.00 0.00 N ATOM 1680 CD2 HIS B 15 80.613 -4.050 -13.652 1.00 0.00 C ATOM 1681 CE1 HIS B 15 80.302 -3.896 -15.795 1.00 0.00 C ATOM 1682 NE2 HIS B 15 81.101 -4.462 -14.888 1.00 0.00 N ATOM 0 H HIS B 15 77.445 -1.048 -11.290 1.00 0.00 H new ATOM 0 HA HIS B 15 80.189 -1.354 -11.957 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.450 -3.161 -11.992 1.00 0.00 H new ATOM 0 HB3 HIS B 15 77.640 -2.367 -13.328 1.00 0.00 H new ATOM 0 HD2 HIS B 15 81.028 -4.326 -12.694 1.00 0.00 H new ATOM 0 HE1 HIS B 15 80.411 -4.018 -16.862 1.00 0.00 H new ATOM 0 HE2 HIS B 15 81.901 -5.069 -15.064 1.00 0.00 H new ATOM 1691 N GLN B 16 78.464 0.288 -14.227 1.00 0.00 N ATOM 1692 CA GLN B 16 78.713 1.136 -15.421 1.00 0.00 C ATOM 1693 C GLN B 16 79.510 2.367 -14.995 1.00 0.00 C ATOM 1694 O GLN B 16 80.403 2.818 -15.684 1.00 0.00 O ATOM 1695 CB GLN B 16 77.379 1.572 -16.034 1.00 0.00 C ATOM 1696 CG GLN B 16 77.641 2.404 -17.294 1.00 0.00 C ATOM 1697 CD GLN B 16 76.311 2.798 -17.940 1.00 0.00 C ATOM 1698 OE1 GLN B 16 75.376 3.167 -17.259 1.00 0.00 O ATOM 1699 NE2 GLN B 16 76.190 2.736 -19.237 1.00 0.00 N ATOM 0 H GLN B 16 77.498 0.252 -13.901 1.00 0.00 H new ATOM 0 HA GLN B 16 79.275 0.570 -16.164 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.778 0.697 -16.282 1.00 0.00 H new ATOM 0 HB3 GLN B 16 76.809 2.156 -15.312 1.00 0.00 H new ATOM 0 HG2 GLN B 16 78.211 3.297 -17.039 1.00 0.00 H new ATOM 0 HG3 GLN B 16 78.244 1.832 -18.000 1.00 0.00 H new ATOM 0 HE21 GLN B 16 76.976 2.426 -19.808 1.00 0.00 H new ATOM 0 HE22 GLN B 16 75.309 2.998 -19.680 1.00 0.00 H new ATOM 1708 N TYR B 17 79.180 2.920 -13.859 1.00 0.00 N ATOM 1709 CA TYR B 17 79.904 4.129 -13.380 1.00 0.00 C ATOM 1710 C TYR B 17 81.309 3.753 -12.894 1.00 0.00 C ATOM 1711 O TYR B 17 82.285 4.395 -13.228 1.00 0.00 O ATOM 1712 CB TYR B 17 79.123 4.772 -12.234 1.00 0.00 C ATOM 1713 CG TYR B 17 79.724 6.121 -11.930 1.00 0.00 C ATOM 1714 CD1 TYR B 17 80.755 6.242 -10.990 1.00 0.00 C ATOM 1715 CD2 TYR B 17 79.258 7.252 -12.607 1.00 0.00 C ATOM 1716 CE1 TYR B 17 81.317 7.497 -10.728 1.00 0.00 C ATOM 1717 CE2 TYR B 17 79.817 8.507 -12.344 1.00 0.00 C ATOM 1718 CZ TYR B 17 80.847 8.630 -11.404 1.00 0.00 C ATOM 1719 OH TYR B 17 81.401 9.867 -11.148 1.00 0.00 O ATOM 0 H TYR B 17 78.439 2.585 -13.243 1.00 0.00 H new ATOM 0 HA TYR B 17 79.994 4.835 -14.206 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.073 4.880 -12.507 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.159 4.136 -11.350 1.00 0.00 H new ATOM 0 HD1 TYR B 17 81.116 5.368 -10.468 1.00 0.00 H new ATOM 0 HD2 TYR B 17 78.465 7.157 -13.334 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.113 7.592 -10.004 1.00 0.00 H new ATOM 0 HE2 TYR B 17 79.454 9.380 -12.866 1.00 0.00 H new ATOM 0 HH TYR B 17 80.960 10.544 -11.703 1.00 0.00 H new ATOM 1729 N SER B 18 81.416 2.721 -12.102 1.00 0.00 N ATOM 1730 CA SER B 18 82.754 2.309 -11.586 1.00 0.00 C ATOM 1731 C SER B 18 83.593 1.730 -12.727 1.00 0.00 C ATOM 1732 O SER B 18 84.806 1.693 -12.658 1.00 0.00 O ATOM 1733 CB SER B 18 82.589 1.262 -10.484 1.00 0.00 C ATOM 1734 OG SER B 18 83.869 0.927 -9.961 1.00 0.00 O ATOM 0 H SER B 18 80.635 2.145 -11.789 1.00 0.00 H new ATOM 0 HA SER B 18 83.260 3.182 -11.175 1.00 0.00 H new ATOM 0 HB2 SER B 18 81.949 1.649 -9.691 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.101 0.372 -10.882 1.00 0.00 H new ATOM 0 HG SER B 18 83.781 0.674 -9.018 1.00 0.00 H new ATOM 1740 N GLY B 19 82.963 1.294 -13.785 1.00 0.00 N ATOM 1741 CA GLY B 19 83.726 0.738 -14.941 1.00 0.00 C ATOM 1742 C GLY B 19 84.045 1.865 -15.924 1.00 0.00 C ATOM 1743 O GLY B 19 84.320 1.628 -17.084 1.00 0.00 O ATOM 0 H GLY B 19 81.949 1.299 -13.899 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.648 0.272 -14.593 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.143 -0.039 -15.437 1.00 0.00 H new ATOM 1747 N ARG B 20 84.012 3.091 -15.475 1.00 0.00 N ATOM 1748 CA ARG B 20 84.316 4.230 -16.386 1.00 0.00 C ATOM 1749 C ARG B 20 85.832 4.403 -16.497 1.00 0.00 C ATOM 1750 O ARG B 20 86.377 4.535 -17.575 1.00 0.00 O ATOM 1751 CB ARG B 20 83.699 5.507 -15.814 1.00 0.00 C ATOM 1752 CG ARG B 20 83.828 6.645 -16.826 1.00 0.00 C ATOM 1753 CD ARG B 20 83.207 7.911 -16.237 1.00 0.00 C ATOM 1754 NE ARG B 20 83.242 9.006 -17.247 1.00 0.00 N ATOM 1755 CZ ARG B 20 82.628 10.129 -17.004 1.00 0.00 C ATOM 1756 NH1 ARG B 20 81.995 10.294 -15.875 1.00 0.00 N ATOM 1757 NH2 ARG B 20 82.645 11.089 -17.887 1.00 0.00 N ATOM 0 H ARG B 20 83.787 3.352 -14.515 1.00 0.00 H new ATOM 0 HA ARG B 20 83.901 4.031 -17.374 1.00 0.00 H new ATOM 0 HB2 ARG B 20 82.649 5.339 -15.575 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.198 5.778 -14.884 1.00 0.00 H new ATOM 0 HG2 ARG B 20 84.877 6.817 -17.066 1.00 0.00 H new ATOM 0 HG3 ARG B 20 83.328 6.379 -17.757 1.00 0.00 H new ATOM 0 HD2 ARG B 20 82.178 7.716 -15.934 1.00 0.00 H new ATOM 0 HD3 ARG B 20 83.751 8.212 -15.342 1.00 0.00 H new ATOM 0 HE ARG B 20 83.745 8.877 -18.125 1.00 0.00 H new ATOM 0 HH11 ARG B 20 81.981 9.544 -15.184 1.00 0.00 H new ATOM 0 HH12 ARG B 20 81.514 11.173 -15.684 1.00 0.00 H new ATOM 0 HH21 ARG B 20 83.140 10.961 -18.770 1.00 0.00 H new ATOM 0 HH22 ARG B 20 82.164 11.967 -17.695 1.00 0.00 H new ATOM 1771 N GLU B 21 86.517 4.405 -15.383 1.00 0.00 N ATOM 1772 CA GLU B 21 88.001 4.571 -15.404 1.00 0.00 C ATOM 1773 C GLU B 21 88.630 3.697 -14.318 1.00 0.00 C ATOM 1774 O GLU B 21 88.063 3.500 -13.261 1.00 0.00 O ATOM 1775 CB GLU B 21 88.357 6.038 -15.147 1.00 0.00 C ATOM 1776 CG GLU B 21 89.877 6.212 -15.217 1.00 0.00 C ATOM 1777 CD GLU B 21 90.232 7.696 -15.099 1.00 0.00 C ATOM 1778 OE1 GLU B 21 89.317 8.501 -15.028 1.00 0.00 O ATOM 1779 OE2 GLU B 21 91.412 8.002 -15.081 1.00 0.00 O ATOM 0 H GLU B 21 86.110 4.298 -14.454 1.00 0.00 H new ATOM 0 HA GLU B 21 88.384 4.270 -16.379 1.00 0.00 H new ATOM 0 HB2 GLU B 21 87.872 6.676 -15.886 1.00 0.00 H new ATOM 0 HB3 GLU B 21 87.989 6.347 -14.169 1.00 0.00 H new ATOM 0 HG2 GLU B 21 90.355 5.649 -14.415 1.00 0.00 H new ATOM 0 HG3 GLU B 21 90.256 5.811 -16.157 1.00 0.00 H new ATOM 1786 N GLY B 22 89.802 3.179 -14.567 1.00 0.00 N ATOM 1787 CA GLY B 22 90.475 2.326 -13.547 1.00 0.00 C ATOM 1788 C GLY B 22 89.942 0.894 -13.630 1.00 0.00 C ATOM 1789 O GLY B 22 90.043 0.243 -14.651 1.00 0.00 O ATOM 0 H GLY B 22 90.323 3.310 -15.434 1.00 0.00 H new ATOM 0 HA2 GLY B 22 91.553 2.332 -13.710 1.00 0.00 H new ATOM 0 HA3 GLY B 22 90.301 2.731 -12.550 1.00 0.00 H new ATOM 1793 N ASP B 23 89.380 0.399 -12.556 1.00 0.00 N ATOM 1794 CA ASP B 23 88.842 -0.996 -12.551 1.00 0.00 C ATOM 1795 C ASP B 23 87.506 -1.022 -11.805 1.00 0.00 C ATOM 1796 O ASP B 23 87.286 -0.272 -10.874 1.00 0.00 O ATOM 1797 CB ASP B 23 89.838 -1.916 -11.842 1.00 0.00 C ATOM 1798 CG ASP B 23 89.387 -3.371 -11.988 1.00 0.00 C ATOM 1799 OD1 ASP B 23 88.389 -3.724 -11.383 1.00 0.00 O ATOM 1800 OD2 ASP B 23 90.050 -4.106 -12.701 1.00 0.00 O ATOM 0 H ASP B 23 89.270 0.905 -11.677 1.00 0.00 H new ATOM 0 HA ASP B 23 88.693 -1.336 -13.576 1.00 0.00 H new ATOM 0 HB2 ASP B 23 90.833 -1.789 -12.268 1.00 0.00 H new ATOM 0 HB3 ASP B 23 89.907 -1.650 -10.787 1.00 0.00 H new ATOM 1805 N LYS B 24 86.613 -1.881 -12.209 1.00 0.00 N ATOM 1806 CA LYS B 24 85.289 -1.964 -11.532 1.00 0.00 C ATOM 1807 C LYS B 24 85.459 -2.556 -10.131 1.00 0.00 C ATOM 1808 O LYS B 24 86.298 -3.404 -9.912 1.00 0.00 O ATOM 1809 CB LYS B 24 84.352 -2.849 -12.359 1.00 0.00 C ATOM 1810 CG LYS B 24 85.012 -4.206 -12.615 1.00 0.00 C ATOM 1811 CD LYS B 24 84.099 -5.050 -13.505 1.00 0.00 C ATOM 1812 CE LYS B 24 84.745 -6.410 -13.770 1.00 0.00 C ATOM 1813 NZ LYS B 24 83.784 -7.276 -14.513 1.00 0.00 N ATOM 0 H LYS B 24 86.744 -2.532 -12.983 1.00 0.00 H new ATOM 0 HA LYS B 24 84.862 -0.965 -11.445 1.00 0.00 H new ATOM 0 HB2 LYS B 24 83.408 -2.987 -11.832 1.00 0.00 H new ATOM 0 HB3 LYS B 24 84.120 -2.363 -13.306 1.00 0.00 H new ATOM 0 HG2 LYS B 24 85.981 -4.068 -13.095 1.00 0.00 H new ATOM 0 HG3 LYS B 24 85.194 -4.719 -11.671 1.00 0.00 H new ATOM 0 HD2 LYS B 24 83.131 -5.185 -13.023 1.00 0.00 H new ATOM 0 HD3 LYS B 24 83.917 -4.534 -14.448 1.00 0.00 H new ATOM 0 HE2 LYS B 24 85.661 -6.284 -14.348 1.00 0.00 H new ATOM 0 HE3 LYS B 24 85.025 -6.882 -12.828 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 84.220 -8.202 -14.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 82.922 -7.405 -13.945 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 83.538 -6.825 -15.418 1.00 0.00 H new ATOM 1827 N HIS B 25 84.675 -2.090 -9.184 1.00 0.00 N ATOM 1828 CA HIS B 25 84.761 -2.581 -7.773 1.00 0.00 C ATOM 1829 C HIS B 25 85.901 -1.851 -7.053 1.00 0.00 C ATOM 1830 O HIS B 25 86.316 -2.230 -5.976 1.00 0.00 O ATOM 1831 CB HIS B 25 84.999 -4.098 -7.765 1.00 0.00 C ATOM 1832 CG HIS B 25 84.457 -4.712 -6.498 1.00 0.00 C ATOM 1833 ND1 HIS B 25 83.096 -4.792 -6.234 1.00 0.00 N ATOM 1834 CD2 HIS B 25 85.082 -5.290 -5.420 1.00 0.00 C ATOM 1835 CE1 HIS B 25 82.949 -5.399 -5.041 1.00 0.00 C ATOM 1836 NE2 HIS B 25 84.127 -5.721 -4.507 1.00 0.00 N ATOM 0 H HIS B 25 83.965 -1.374 -9.336 1.00 0.00 H new ATOM 0 HA HIS B 25 83.825 -2.377 -7.252 1.00 0.00 H new ATOM 0 HB2 HIS B 25 84.517 -4.552 -8.631 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.066 -4.305 -7.849 1.00 0.00 H new ATOM 0 HD2 HIS B 25 86.150 -5.394 -5.300 1.00 0.00 H new ATOM 0 HE1 HIS B 25 81.996 -5.600 -4.575 1.00 0.00 H new ATOM 0 HE2 HIS B 25 84.293 -6.186 -3.615 1.00 0.00 H new ATOM 1845 N LYS B 26 86.394 -0.792 -7.642 1.00 0.00 N ATOM 1846 CA LYS B 26 87.493 -0.004 -7.006 1.00 0.00 C ATOM 1847 C LYS B 26 87.324 1.465 -7.402 1.00 0.00 C ATOM 1848 O LYS B 26 87.602 1.845 -8.521 1.00 0.00 O ATOM 1849 CB LYS B 26 88.853 -0.504 -7.500 1.00 0.00 C ATOM 1850 CG LYS B 26 89.136 -1.902 -6.945 1.00 0.00 C ATOM 1851 CD LYS B 26 90.499 -2.380 -7.453 1.00 0.00 C ATOM 1852 CE LYS B 26 90.793 -3.777 -6.904 1.00 0.00 C ATOM 1853 NZ LYS B 26 91.066 -3.692 -5.442 1.00 0.00 N ATOM 0 H LYS B 26 86.079 -0.436 -8.545 1.00 0.00 H new ATOM 0 HA LYS B 26 87.447 -0.118 -5.923 1.00 0.00 H new ATOM 0 HB2 LYS B 26 88.866 -0.528 -8.590 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.637 0.185 -7.187 1.00 0.00 H new ATOM 0 HG2 LYS B 26 89.127 -1.882 -5.855 1.00 0.00 H new ATOM 0 HG3 LYS B 26 88.355 -2.595 -7.257 1.00 0.00 H new ATOM 0 HD2 LYS B 26 90.506 -2.398 -8.543 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.278 -1.685 -7.141 1.00 0.00 H new ATOM 0 HE2 LYS B 26 89.945 -4.437 -7.088 1.00 0.00 H new ATOM 0 HE3 LYS B 26 91.651 -4.208 -7.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 91.508 -4.576 -5.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 91.708 -2.896 -5.254 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 90.173 -3.545 -4.930 1.00 0.00 H new ATOM 1867 N LEU B 27 86.852 2.296 -6.503 1.00 0.00 N ATOM 1868 CA LEU B 27 86.645 3.742 -6.848 1.00 0.00 C ATOM 1869 C LEU B 27 87.786 4.596 -6.285 1.00 0.00 C ATOM 1870 O LEU B 27 88.119 4.522 -5.120 1.00 0.00 O ATOM 1871 CB LEU B 27 85.322 4.215 -6.244 1.00 0.00 C ATOM 1872 CG LEU B 27 84.144 3.543 -6.963 1.00 0.00 C ATOM 1873 CD1 LEU B 27 82.856 3.833 -6.187 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.016 4.073 -8.408 1.00 0.00 C ATOM 0 H LEU B 27 86.602 2.038 -5.548 1.00 0.00 H new ATOM 0 HA LEU B 27 86.626 3.848 -7.933 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.293 3.977 -5.181 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.241 5.299 -6.330 1.00 0.00 H new ATOM 0 HG LEU B 27 84.317 2.468 -7.007 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.013 3.359 -6.691 1.00 0.00 H new ATOM 0 HD12 LEU B 27 82.944 3.437 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU B 27 82.693 4.910 -6.142 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.176 3.585 -8.901 1.00 0.00 H new ATOM 0 HD22 LEU B 27 83.849 5.150 -8.387 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.933 3.859 -8.957 1.00 0.00 H new ATOM 1886 N LYS B 28 88.368 5.427 -7.113 1.00 0.00 N ATOM 1887 CA LYS B 28 89.476 6.319 -6.653 1.00 0.00 C ATOM 1888 C LYS B 28 88.879 7.645 -6.181 1.00 0.00 C ATOM 1889 O LYS B 28 87.750 7.969 -6.489 1.00 0.00 O ATOM 1890 CB LYS B 28 90.446 6.590 -7.811 1.00 0.00 C ATOM 1891 CG LYS B 28 91.067 5.280 -8.320 1.00 0.00 C ATOM 1892 CD LYS B 28 92.117 4.763 -7.327 1.00 0.00 C ATOM 1893 CE LYS B 28 92.911 3.624 -7.973 1.00 0.00 C ATOM 1894 NZ LYS B 28 93.669 4.145 -9.145 1.00 0.00 N ATOM 0 H LYS B 28 88.120 5.526 -8.097 1.00 0.00 H new ATOM 0 HA LYS B 28 90.016 5.836 -5.839 1.00 0.00 H new ATOM 0 HB2 LYS B 28 89.918 7.088 -8.625 1.00 0.00 H new ATOM 0 HB3 LYS B 28 91.234 7.267 -7.481 1.00 0.00 H new ATOM 0 HG2 LYS B 28 90.288 4.530 -8.458 1.00 0.00 H new ATOM 0 HG3 LYS B 28 91.528 5.443 -9.294 1.00 0.00 H new ATOM 0 HD2 LYS B 28 92.789 5.571 -7.038 1.00 0.00 H new ATOM 0 HD3 LYS B 28 91.631 4.412 -6.417 1.00 0.00 H new ATOM 0 HE2 LYS B 28 93.598 3.189 -7.247 1.00 0.00 H new ATOM 0 HE3 LYS B 28 92.235 2.829 -8.288 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 94.514 3.559 -9.300 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 93.065 4.113 -9.991 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 93.957 5.128 -8.963 1.00 0.00 H new ATOM 1908 N LYS B 29 89.622 8.419 -5.436 1.00 0.00 N ATOM 1909 CA LYS B 29 89.077 9.718 -4.952 1.00 0.00 C ATOM 1910 C LYS B 29 88.701 10.589 -6.154 1.00 0.00 C ATOM 1911 O LYS B 29 87.681 11.247 -6.157 1.00 0.00 O ATOM 1912 CB LYS B 29 90.136 10.426 -4.095 1.00 0.00 C ATOM 1913 CG LYS B 29 91.300 10.894 -4.977 1.00 0.00 C ATOM 1914 CD LYS B 29 92.454 11.370 -4.089 1.00 0.00 C ATOM 1915 CE LYS B 29 93.526 12.040 -4.954 1.00 0.00 C ATOM 1916 NZ LYS B 29 94.598 12.595 -4.078 1.00 0.00 N ATOM 0 H LYS B 29 90.576 8.209 -5.144 1.00 0.00 H new ATOM 0 HA LYS B 29 88.188 9.545 -4.346 1.00 0.00 H new ATOM 0 HB2 LYS B 29 89.690 11.280 -3.584 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.503 9.749 -3.324 1.00 0.00 H new ATOM 0 HG2 LYS B 29 91.634 10.079 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS B 29 90.973 11.702 -5.631 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.085 12.072 -3.341 1.00 0.00 H new ATOM 0 HD3 LYS B 29 92.883 10.526 -3.550 1.00 0.00 H new ATOM 0 HE2 LYS B 29 93.950 11.317 -5.651 1.00 0.00 H new ATOM 0 HE3 LYS B 29 93.081 12.836 -5.551 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 95.326 13.050 -4.666 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 94.188 13.297 -3.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 95.029 11.826 -3.527 1.00 0.00 H new ATOM 1930 N SER B 30 89.503 10.582 -7.182 1.00 0.00 N ATOM 1931 CA SER B 30 89.171 11.392 -8.387 1.00 0.00 C ATOM 1932 C SER B 30 87.851 10.887 -8.979 1.00 0.00 C ATOM 1933 O SER B 30 87.009 11.653 -9.397 1.00 0.00 O ATOM 1934 CB SER B 30 90.286 11.243 -9.422 1.00 0.00 C ATOM 1935 OG SER B 30 90.014 12.090 -10.530 1.00 0.00 O ATOM 0 H SER B 30 90.372 10.052 -7.240 1.00 0.00 H new ATOM 0 HA SER B 30 89.073 12.442 -8.112 1.00 0.00 H new ATOM 0 HB2 SER B 30 91.247 11.503 -8.978 1.00 0.00 H new ATOM 0 HB3 SER B 30 90.357 10.206 -9.751 1.00 0.00 H new ATOM 0 HG SER B 30 90.728 11.998 -11.195 1.00 0.00 H new ATOM 1941 N GLU B 31 87.668 9.594 -8.993 1.00 0.00 N ATOM 1942 CA GLU B 31 86.403 9.012 -9.536 1.00 0.00 C ATOM 1943 C GLU B 31 85.257 9.341 -8.582 1.00 0.00 C ATOM 1944 O GLU B 31 84.123 9.515 -8.981 1.00 0.00 O ATOM 1945 CB GLU B 31 86.541 7.493 -9.649 1.00 0.00 C ATOM 1946 CG GLU B 31 87.523 7.146 -10.767 1.00 0.00 C ATOM 1947 CD GLU B 31 87.774 5.637 -10.769 1.00 0.00 C ATOM 1948 OE1 GLU B 31 87.196 4.961 -9.934 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.540 5.185 -11.604 1.00 0.00 O ATOM 0 H GLU B 31 88.343 8.911 -8.650 1.00 0.00 H new ATOM 0 HA GLU B 31 86.202 9.431 -10.522 1.00 0.00 H new ATOM 0 HB2 GLU B 31 86.891 7.079 -8.703 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.569 7.044 -9.854 1.00 0.00 H new ATOM 0 HG2 GLU B 31 87.121 7.461 -11.730 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.461 7.682 -10.622 1.00 0.00 H new ATOM 1956 N LEU B 32 85.565 9.448 -7.323 1.00 0.00 N ATOM 1957 CA LEU B 32 84.519 9.791 -6.324 1.00 0.00 C ATOM 1958 C LEU B 32 84.072 11.234 -6.555 1.00 0.00 C ATOM 1959 O LEU B 32 82.905 11.559 -6.460 1.00 0.00 O ATOM 1960 CB LEU B 32 85.102 9.636 -4.913 1.00 0.00 C ATOM 1961 CG LEU B 32 84.057 10.014 -3.852 1.00 0.00 C ATOM 1962 CD1 LEU B 32 82.822 9.108 -3.970 1.00 0.00 C ATOM 1963 CD2 LEU B 32 84.685 9.850 -2.464 1.00 0.00 C ATOM 0 H LEU B 32 86.501 9.312 -6.941 1.00 0.00 H new ATOM 0 HA LEU B 32 83.661 9.127 -6.428 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.429 8.607 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU B 32 85.983 10.269 -4.806 1.00 0.00 H new ATOM 0 HG LEU B 32 83.744 11.047 -4.004 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.091 9.389 -3.212 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.380 9.222 -4.960 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.117 8.069 -3.823 1.00 0.00 H new ATOM 0 HD21 LEU B 32 83.954 10.115 -1.700 1.00 0.00 H new ATOM 0 HD22 LEU B 32 84.995 8.814 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU B 32 85.553 10.504 -2.378 1.00 0.00 H new ATOM 1975 N LYS B 33 85.000 12.100 -6.852 1.00 0.00 N ATOM 1976 CA LYS B 33 84.649 13.531 -7.084 1.00 0.00 C ATOM 1977 C LYS B 33 83.703 13.668 -8.286 1.00 0.00 C ATOM 1978 O LYS B 33 82.759 14.433 -8.257 1.00 0.00 O ATOM 1979 CB LYS B 33 85.930 14.327 -7.354 1.00 0.00 C ATOM 1980 CG LYS B 33 85.594 15.817 -7.440 1.00 0.00 C ATOM 1981 CD LYS B 33 86.870 16.618 -7.709 1.00 0.00 C ATOM 1982 CE LYS B 33 86.534 18.111 -7.763 1.00 0.00 C ATOM 1983 NZ LYS B 33 85.892 18.431 -9.069 1.00 0.00 N ATOM 0 H LYS B 33 85.991 11.878 -6.945 1.00 0.00 H new ATOM 0 HA LYS B 33 84.146 13.918 -6.198 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.655 14.152 -6.559 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.390 13.992 -8.284 1.00 0.00 H new ATOM 0 HG2 LYS B 33 84.869 15.991 -8.235 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.133 16.150 -6.510 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.604 16.428 -6.926 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.319 16.301 -8.650 1.00 0.00 H new ATOM 0 HE2 LYS B 33 85.865 18.374 -6.943 1.00 0.00 H new ATOM 0 HE3 LYS B 33 87.440 18.703 -7.637 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 85.955 19.454 -9.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 86.379 17.917 -9.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 84.892 18.145 -9.044 1.00 0.00 H new ATOM 1997 N GLU B 34 83.950 12.943 -9.345 1.00 0.00 N ATOM 1998 CA GLU B 34 83.059 13.054 -10.541 1.00 0.00 C ATOM 1999 C GLU B 34 81.626 12.666 -10.166 1.00 0.00 C ATOM 2000 O GLU B 34 80.676 13.313 -10.557 1.00 0.00 O ATOM 2001 CB GLU B 34 83.564 12.133 -11.669 1.00 0.00 C ATOM 2002 CG GLU B 34 84.739 12.784 -12.420 1.00 0.00 C ATOM 2003 CD GLU B 34 86.033 12.603 -11.628 1.00 0.00 C ATOM 2004 OE1 GLU B 34 86.599 11.524 -11.700 1.00 0.00 O ATOM 2005 OE2 GLU B 34 86.444 13.548 -10.974 1.00 0.00 O ATOM 0 H GLU B 34 84.723 12.284 -9.435 1.00 0.00 H new ATOM 0 HA GLU B 34 83.073 14.087 -10.890 1.00 0.00 H new ATOM 0 HB2 GLU B 34 83.879 11.177 -11.251 1.00 0.00 H new ATOM 0 HB3 GLU B 34 82.752 11.924 -12.366 1.00 0.00 H new ATOM 0 HG2 GLU B 34 84.842 12.335 -13.408 1.00 0.00 H new ATOM 0 HG3 GLU B 34 84.541 13.845 -12.571 1.00 0.00 H new ATOM 2012 N LEU B 35 81.461 11.603 -9.435 1.00 0.00 N ATOM 2013 CA LEU B 35 80.087 11.161 -9.063 1.00 0.00 C ATOM 2014 C LEU B 35 79.374 12.257 -8.265 1.00 0.00 C ATOM 2015 O LEU B 35 78.233 12.584 -8.527 1.00 0.00 O ATOM 2016 CB LEU B 35 80.189 9.880 -8.218 1.00 0.00 C ATOM 2017 CG LEU B 35 78.776 9.324 -7.882 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.809 7.790 -7.871 1.00 0.00 C ATOM 2019 CD2 LEU B 35 78.303 9.812 -6.499 1.00 0.00 C ATOM 0 H LEU B 35 82.217 11.019 -9.078 1.00 0.00 H new ATOM 0 HA LEU B 35 79.511 10.964 -9.967 1.00 0.00 H new ATOM 0 HB2 LEU B 35 80.761 9.127 -8.759 1.00 0.00 H new ATOM 0 HB3 LEU B 35 80.731 10.090 -7.296 1.00 0.00 H new ATOM 0 HG LEU B 35 78.086 9.685 -8.645 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.816 7.406 -7.635 1.00 0.00 H new ATOM 0 HD12 LEU B 35 79.115 7.426 -8.852 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.519 7.447 -7.119 1.00 0.00 H new ATOM 0 HD21 LEU B 35 77.312 9.408 -6.290 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.002 9.472 -5.735 1.00 0.00 H new ATOM 0 HD23 LEU B 35 78.260 10.901 -6.493 1.00 0.00 H new ATOM 2031 N ILE B 36 80.028 12.814 -7.284 1.00 0.00 N ATOM 2032 CA ILE B 36 79.381 13.875 -6.457 1.00 0.00 C ATOM 2033 C ILE B 36 78.982 15.078 -7.326 1.00 0.00 C ATOM 2034 O ILE B 36 77.886 15.594 -7.218 1.00 0.00 O ATOM 2035 CB ILE B 36 80.358 14.318 -5.361 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.537 13.167 -4.362 1.00 0.00 C ATOM 2037 CG2 ILE B 36 79.803 15.548 -4.630 1.00 0.00 C ATOM 2038 CD1 ILE B 36 81.686 13.481 -3.400 1.00 0.00 C ATOM 0 H ILE B 36 80.985 12.581 -7.018 1.00 0.00 H new ATOM 0 HA ILE B 36 78.475 13.472 -6.005 1.00 0.00 H new ATOM 0 HB ILE B 36 81.317 14.576 -5.810 1.00 0.00 H new ATOM 0 HG12 ILE B 36 79.615 13.014 -3.802 1.00 0.00 H new ATOM 0 HG13 ILE B 36 80.743 12.240 -4.896 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.503 15.856 -3.853 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.668 16.363 -5.341 1.00 0.00 H new ATOM 0 HG23 ILE B 36 78.844 15.299 -4.176 1.00 0.00 H new ATOM 0 HD11 ILE B 36 81.805 12.658 -2.695 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.609 13.611 -3.965 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.463 14.398 -2.854 1.00 0.00 H new ATOM 2050 N ASN B 37 79.864 15.541 -8.165 1.00 0.00 N ATOM 2051 CA ASN B 37 79.541 16.726 -9.017 1.00 0.00 C ATOM 2052 C ASN B 37 78.499 16.371 -10.083 1.00 0.00 C ATOM 2053 O ASN B 37 77.853 17.240 -10.635 1.00 0.00 O ATOM 2054 CB ASN B 37 80.811 17.195 -9.726 1.00 0.00 C ATOM 2055 CG ASN B 37 81.785 17.795 -8.709 1.00 0.00 C ATOM 2056 OD1 ASN B 37 82.941 17.419 -8.663 1.00 0.00 O ATOM 2057 ND2 ASN B 37 81.369 18.720 -7.888 1.00 0.00 N ATOM 0 H ASN B 37 80.797 15.152 -8.300 1.00 0.00 H new ATOM 0 HA ASN B 37 79.140 17.509 -8.373 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.280 16.357 -10.242 1.00 0.00 H new ATOM 0 HB3 ASN B 37 80.561 17.937 -10.485 1.00 0.00 H new ATOM 0 HD21 ASN B 37 82.013 19.126 -7.209 1.00 0.00 H new ATOM 0 HD22 ASN B 37 80.400 19.037 -7.925 1.00 0.00 H new ATOM 2064 N ASN B 38 78.352 15.117 -10.411 1.00 0.00 N ATOM 2065 CA ASN B 38 77.379 14.728 -11.480 1.00 0.00 C ATOM 2066 C ASN B 38 75.962 14.521 -10.928 1.00 0.00 C ATOM 2067 O ASN B 38 75.049 14.236 -11.676 1.00 0.00 O ATOM 2068 CB ASN B 38 77.852 13.425 -12.128 1.00 0.00 C ATOM 2069 CG ASN B 38 79.114 13.690 -12.951 1.00 0.00 C ATOM 2070 OD1 ASN B 38 79.340 14.796 -13.400 1.00 0.00 O ATOM 2071 ND2 ASN B 38 79.951 12.714 -13.168 1.00 0.00 N ATOM 0 H ASN B 38 78.862 14.342 -9.987 1.00 0.00 H new ATOM 0 HA ASN B 38 77.339 15.540 -12.206 1.00 0.00 H new ATOM 0 HB2 ASN B 38 78.056 12.679 -11.360 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.068 13.019 -12.767 1.00 0.00 H new ATOM 0 HD21 ASN B 38 80.796 12.879 -13.715 1.00 0.00 H new ATOM 0 HD22 ASN B 38 79.761 11.786 -12.791 1.00 0.00 H new ATOM 2078 N GLU B 39 75.746 14.657 -9.647 1.00 0.00 N ATOM 2079 CA GLU B 39 74.356 14.452 -9.135 1.00 0.00 C ATOM 2080 C GLU B 39 74.198 14.985 -7.704 1.00 0.00 C ATOM 2081 O GLU B 39 73.263 15.703 -7.410 1.00 0.00 O ATOM 2082 CB GLU B 39 74.006 12.954 -9.179 1.00 0.00 C ATOM 2083 CG GLU B 39 75.235 12.121 -8.813 1.00 0.00 C ATOM 2084 CD GLU B 39 74.844 10.642 -8.763 1.00 0.00 C ATOM 2085 OE1 GLU B 39 73.660 10.366 -8.676 1.00 0.00 O ATOM 2086 OE2 GLU B 39 75.736 9.811 -8.812 1.00 0.00 O ATOM 0 H GLU B 39 76.449 14.895 -8.947 1.00 0.00 H new ATOM 0 HA GLU B 39 73.673 15.010 -9.775 1.00 0.00 H new ATOM 0 HB2 GLU B 39 73.192 12.741 -8.486 1.00 0.00 H new ATOM 0 HB3 GLU B 39 73.655 12.683 -10.175 1.00 0.00 H new ATOM 0 HG2 GLU B 39 76.026 12.276 -9.547 1.00 0.00 H new ATOM 0 HG3 GLU B 39 75.630 12.438 -7.848 1.00 0.00 H new ATOM 2093 N LEU B 40 75.075 14.634 -6.802 1.00 0.00 N ATOM 2094 CA LEU B 40 74.918 15.126 -5.398 1.00 0.00 C ATOM 2095 C LEU B 40 75.487 16.542 -5.280 1.00 0.00 C ATOM 2096 O LEU B 40 76.652 16.777 -5.532 1.00 0.00 O ATOM 2097 CB LEU B 40 75.671 14.201 -4.439 1.00 0.00 C ATOM 2098 CG LEU B 40 75.112 12.775 -4.536 1.00 0.00 C ATOM 2099 CD1 LEU B 40 75.967 11.841 -3.674 1.00 0.00 C ATOM 2100 CD2 LEU B 40 73.651 12.740 -4.050 1.00 0.00 C ATOM 0 H LEU B 40 75.884 14.036 -6.970 1.00 0.00 H new ATOM 0 HA LEU B 40 73.859 15.135 -5.141 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.734 14.201 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU B 40 75.577 14.569 -3.417 1.00 0.00 H new ATOM 0 HG LEU B 40 75.141 12.448 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU B 40 75.575 10.826 -3.738 1.00 0.00 H new ATOM 0 HD12 LEU B 40 76.996 11.856 -4.032 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.939 12.176 -2.637 1.00 0.00 H new ATOM 0 HD21 LEU B 40 73.267 11.723 -4.124 1.00 0.00 H new ATOM 0 HD22 LEU B 40 73.605 13.070 -3.012 1.00 0.00 H new ATOM 0 HD23 LEU B 40 73.046 13.402 -4.669 1.00 0.00 H new ATOM 2112 N SER B 41 74.671 17.487 -4.892 1.00 0.00 N ATOM 2113 CA SER B 41 75.156 18.892 -4.750 1.00 0.00 C ATOM 2114 C SER B 41 74.348 19.610 -3.663 1.00 0.00 C ATOM 2115 O SER B 41 74.864 20.436 -2.938 1.00 0.00 O ATOM 2116 CB SER B 41 74.983 19.627 -6.080 1.00 0.00 C ATOM 2117 OG SER B 41 73.607 19.925 -6.277 1.00 0.00 O ATOM 0 H SER B 41 73.686 17.346 -4.667 1.00 0.00 H new ATOM 0 HA SER B 41 76.210 18.883 -4.471 1.00 0.00 H new ATOM 0 HB2 SER B 41 75.569 20.546 -6.080 1.00 0.00 H new ATOM 0 HB3 SER B 41 75.355 19.012 -6.900 1.00 0.00 H new ATOM 0 HG SER B 41 73.493 20.398 -7.128 1.00 0.00 H new ATOM 2123 N HIS B 42 73.080 19.311 -3.558 1.00 0.00 N ATOM 2124 CA HIS B 42 72.234 19.990 -2.532 1.00 0.00 C ATOM 2125 C HIS B 42 72.451 19.366 -1.144 1.00 0.00 C ATOM 2126 O HIS B 42 72.082 19.943 -0.141 1.00 0.00 O ATOM 2127 CB HIS B 42 70.754 19.874 -2.933 1.00 0.00 C ATOM 2128 CG HIS B 42 70.478 18.521 -3.539 1.00 0.00 C ATOM 2129 ND1 HIS B 42 69.330 18.271 -4.281 1.00 0.00 N ATOM 2130 CD2 HIS B 42 71.181 17.338 -3.530 1.00 0.00 C ATOM 2131 CE1 HIS B 42 69.377 16.987 -4.682 1.00 0.00 C ATOM 2132 NE2 HIS B 42 70.483 16.378 -4.251 1.00 0.00 N ATOM 0 H HIS B 42 72.594 18.627 -4.137 1.00 0.00 H new ATOM 0 HA HIS B 42 72.520 21.041 -2.482 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.121 20.024 -2.058 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.502 20.658 -3.647 1.00 0.00 H new ATOM 0 HD2 HIS B 42 72.129 17.180 -3.038 1.00 0.00 H new ATOM 0 HE1 HIS B 42 68.614 16.509 -5.279 1.00 0.00 H new ATOM 0 HE2 HIS B 42 70.758 15.410 -4.416 1.00 0.00 H new ATOM 2141 N PHE B 43 73.039 18.198 -1.073 1.00 0.00 N ATOM 2142 CA PHE B 43 73.269 17.546 0.258 1.00 0.00 C ATOM 2143 C PHE B 43 74.735 17.711 0.661 1.00 0.00 C ATOM 2144 O PHE B 43 75.087 17.583 1.817 1.00 0.00 O ATOM 2145 CB PHE B 43 72.936 16.055 0.153 1.00 0.00 C ATOM 2146 CG PHE B 43 71.469 15.883 -0.184 1.00 0.00 C ATOM 2147 CD1 PHE B 43 70.489 16.296 0.728 1.00 0.00 C ATOM 2148 CD2 PHE B 43 71.089 15.310 -1.405 1.00 0.00 C ATOM 2149 CE1 PHE B 43 69.132 16.137 0.421 1.00 0.00 C ATOM 2150 CE2 PHE B 43 69.731 15.151 -1.713 1.00 0.00 C ATOM 2151 CZ PHE B 43 68.753 15.564 -0.800 1.00 0.00 C ATOM 0 H PHE B 43 73.371 17.666 -1.878 1.00 0.00 H new ATOM 0 HA PHE B 43 72.632 18.013 1.009 1.00 0.00 H new ATOM 0 HB2 PHE B 43 73.553 15.588 -0.615 1.00 0.00 H new ATOM 0 HB3 PHE B 43 73.164 15.554 1.094 1.00 0.00 H new ATOM 0 HD1 PHE B 43 70.781 16.738 1.669 1.00 0.00 H new ATOM 0 HD2 PHE B 43 71.843 14.991 -2.109 1.00 0.00 H new ATOM 0 HE1 PHE B 43 68.378 16.456 1.125 1.00 0.00 H new ATOM 0 HE2 PHE B 43 69.439 14.710 -2.655 1.00 0.00 H new ATOM 0 HZ PHE B 43 67.707 15.441 -1.037 1.00 0.00 H new ATOM 2161 N LEU B 44 75.589 18.004 -0.288 1.00 0.00 N ATOM 2162 CA LEU B 44 77.046 18.195 0.012 1.00 0.00 C ATOM 2163 C LEU B 44 77.413 19.663 -0.225 1.00 0.00 C ATOM 2164 O LEU B 44 76.689 20.400 -0.866 1.00 0.00 O ATOM 2165 CB LEU B 44 77.889 17.297 -0.909 1.00 0.00 C ATOM 2166 CG LEU B 44 77.924 15.857 -0.361 1.00 0.00 C ATOM 2167 CD1 LEU B 44 76.535 15.201 -0.476 1.00 0.00 C ATOM 2168 CD2 LEU B 44 78.950 15.041 -1.161 1.00 0.00 C ATOM 0 H LEU B 44 75.338 18.121 -1.270 1.00 0.00 H new ATOM 0 HA LEU B 44 77.246 17.926 1.049 1.00 0.00 H new ATOM 0 HB2 LEU B 44 77.470 17.301 -1.915 1.00 0.00 H new ATOM 0 HB3 LEU B 44 78.903 17.690 -0.984 1.00 0.00 H new ATOM 0 HG LEU B 44 78.208 15.882 0.691 1.00 0.00 H new ATOM 0 HD11 LEU B 44 76.579 14.185 -0.084 1.00 0.00 H new ATOM 0 HD12 LEU B 44 75.811 15.780 0.097 1.00 0.00 H new ATOM 0 HD13 LEU B 44 76.231 15.174 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU B 44 78.981 14.021 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU B 44 78.663 15.027 -2.212 1.00 0.00 H new ATOM 0 HD23 LEU B 44 79.935 15.496 -1.060 1.00 0.00 H new ATOM 2180 N GLU B 45 78.531 20.092 0.291 1.00 0.00 N ATOM 2181 CA GLU B 45 78.950 21.509 0.103 1.00 0.00 C ATOM 2182 C GLU B 45 79.382 21.725 -1.348 1.00 0.00 C ATOM 2183 O GLU B 45 79.830 22.791 -1.711 1.00 0.00 O ATOM 2184 CB GLU B 45 80.122 21.826 1.035 1.00 0.00 C ATOM 2185 CG GLU B 45 79.654 21.765 2.492 1.00 0.00 C ATOM 2186 CD GLU B 45 79.488 20.305 2.921 1.00 0.00 C ATOM 2187 OE1 GLU B 45 79.906 19.435 2.174 1.00 0.00 O ATOM 2188 OE2 GLU B 45 78.943 20.081 3.989 1.00 0.00 O ATOM 0 H GLU B 45 79.175 19.520 0.837 1.00 0.00 H new ATOM 0 HA GLU B 45 78.113 22.167 0.336 1.00 0.00 H new ATOM 0 HB2 GLU B 45 80.931 21.114 0.873 1.00 0.00 H new ATOM 0 HB3 GLU B 45 80.519 22.816 0.812 1.00 0.00 H new ATOM 0 HG2 GLU B 45 80.377 22.264 3.137 1.00 0.00 H new ATOM 0 HG3 GLU B 45 78.709 22.296 2.603 1.00 0.00 H new ATOM 2195 N GLU B 46 79.254 20.712 -2.169 1.00 0.00 N ATOM 2196 CA GLU B 46 79.651 20.820 -3.609 1.00 0.00 C ATOM 2197 C GLU B 46 81.175 20.705 -3.728 1.00 0.00 C ATOM 2198 O GLU B 46 81.767 21.119 -4.705 1.00 0.00 O ATOM 2199 CB GLU B 46 79.172 22.159 -4.201 1.00 0.00 C ATOM 2200 CG GLU B 46 79.055 22.043 -5.724 1.00 0.00 C ATOM 2201 CD GLU B 46 78.577 23.376 -6.303 1.00 0.00 C ATOM 2202 OE1 GLU B 46 78.189 24.233 -5.525 1.00 0.00 O ATOM 2203 OE2 GLU B 46 78.605 23.518 -7.515 1.00 0.00 O ATOM 0 H GLU B 46 78.885 19.800 -1.899 1.00 0.00 H new ATOM 0 HA GLU B 46 79.182 20.011 -4.169 1.00 0.00 H new ATOM 0 HB2 GLU B 46 78.207 22.432 -3.773 1.00 0.00 H new ATOM 0 HB3 GLU B 46 79.872 22.953 -3.941 1.00 0.00 H new ATOM 0 HG2 GLU B 46 80.020 21.773 -6.154 1.00 0.00 H new ATOM 0 HG3 GLU B 46 78.356 21.249 -5.986 1.00 0.00 H new ATOM 2210 N ILE B 47 81.808 20.129 -2.741 1.00 0.00 N ATOM 2211 CA ILE B 47 83.290 19.962 -2.786 1.00 0.00 C ATOM 2212 C ILE B 47 83.951 21.275 -3.213 1.00 0.00 C ATOM 2213 O ILE B 47 84.070 21.569 -4.386 1.00 0.00 O ATOM 2214 CB ILE B 47 83.642 18.866 -3.793 1.00 0.00 C ATOM 2215 CG1 ILE B 47 82.857 17.585 -3.466 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.144 18.578 -3.741 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.082 17.169 -2.006 1.00 0.00 C ATOM 0 H ILE B 47 81.359 19.765 -1.900 1.00 0.00 H new ATOM 0 HA ILE B 47 83.652 19.686 -1.796 1.00 0.00 H new ATOM 0 HB ILE B 47 83.375 19.203 -4.795 1.00 0.00 H new ATOM 0 HG12 ILE B 47 81.794 17.749 -3.643 1.00 0.00 H new ATOM 0 HG13 ILE B 47 83.171 16.780 -4.131 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.390 17.797 -4.460 1.00 0.00 H new ATOM 0 HG22 ILE B 47 85.697 19.485 -3.987 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.417 18.247 -2.739 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.518 16.261 -1.795 1.00 0.00 H new ATOM 0 HD12 ILE B 47 84.143 16.984 -1.840 1.00 0.00 H new ATOM 0 HD13 ILE B 47 82.745 17.967 -1.344 1.00 0.00 H new ATOM 2229 N LYS B 48 84.381 22.065 -2.268 1.00 0.00 N ATOM 2230 CA LYS B 48 85.036 23.360 -2.612 1.00 0.00 C ATOM 2231 C LYS B 48 86.497 23.105 -3.009 1.00 0.00 C ATOM 2232 O LYS B 48 86.871 23.247 -4.156 1.00 0.00 O ATOM 2233 CB LYS B 48 84.999 24.285 -1.394 1.00 0.00 C ATOM 2234 CG LYS B 48 85.437 25.694 -1.801 1.00 0.00 C ATOM 2235 CD LYS B 48 85.418 26.606 -0.573 1.00 0.00 C ATOM 2236 CE LYS B 48 85.868 28.013 -0.970 1.00 0.00 C ATOM 2237 NZ LYS B 48 84.847 28.629 -1.863 1.00 0.00 N ATOM 0 H LYS B 48 84.307 21.870 -1.270 1.00 0.00 H new ATOM 0 HA LYS B 48 84.507 23.825 -3.444 1.00 0.00 H new ATOM 0 HB2 LYS B 48 83.992 24.313 -0.977 1.00 0.00 H new ATOM 0 HB3 LYS B 48 85.656 23.901 -0.614 1.00 0.00 H new ATOM 0 HG2 LYS B 48 86.438 25.666 -2.231 1.00 0.00 H new ATOM 0 HG3 LYS B 48 84.771 26.086 -2.569 1.00 0.00 H new ATOM 0 HD2 LYS B 48 84.414 26.641 -0.149 1.00 0.00 H new ATOM 0 HD3 LYS B 48 86.076 26.207 0.199 1.00 0.00 H new ATOM 0 HE2 LYS B 48 86.006 28.627 -0.080 1.00 0.00 H new ATOM 0 HE3 LYS B 48 86.831 27.968 -1.478 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 84.995 29.658 -1.901 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 84.937 28.231 -2.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 83.896 28.429 -1.493 1.00 0.00 H new ATOM 2251 N GLU B 49 87.327 22.739 -2.058 1.00 0.00 N ATOM 2252 CA GLU B 49 88.776 22.479 -2.355 1.00 0.00 C ATOM 2253 C GLU B 49 89.055 20.974 -2.302 1.00 0.00 C ATOM 2254 O GLU B 49 88.333 20.217 -1.685 1.00 0.00 O ATOM 2255 CB GLU B 49 89.647 23.172 -1.301 1.00 0.00 C ATOM 2256 CG GLU B 49 89.521 24.691 -1.432 1.00 0.00 C ATOM 2257 CD GLU B 49 90.125 25.145 -2.762 1.00 0.00 C ATOM 2258 OE1 GLU B 49 91.304 24.909 -2.967 1.00 0.00 O ATOM 2259 OE2 GLU B 49 89.398 25.722 -3.553 1.00 0.00 O ATOM 0 H GLU B 49 87.061 22.608 -1.082 1.00 0.00 H new ATOM 0 HA GLU B 49 89.007 22.865 -3.348 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.342 22.859 -0.303 1.00 0.00 H new ATOM 0 HB3 GLU B 49 90.688 22.873 -1.425 1.00 0.00 H new ATOM 0 HG2 GLU B 49 88.473 24.985 -1.378 1.00 0.00 H new ATOM 0 HG3 GLU B 49 90.032 25.181 -0.603 1.00 0.00 H new ATOM 2266 N GLN B 50 90.107 20.537 -2.944 1.00 0.00 N ATOM 2267 CA GLN B 50 90.444 19.085 -2.930 1.00 0.00 C ATOM 2268 C GLN B 50 90.683 18.624 -1.486 1.00 0.00 C ATOM 2269 O GLN B 50 90.330 17.524 -1.111 1.00 0.00 O ATOM 2270 CB GLN B 50 91.695 18.841 -3.778 1.00 0.00 C ATOM 2271 CG GLN B 50 92.889 19.582 -3.175 1.00 0.00 C ATOM 2272 CD GLN B 50 94.068 19.516 -4.149 1.00 0.00 C ATOM 2273 OE1 GLN B 50 94.634 20.530 -4.506 1.00 0.00 O ATOM 2274 NE2 GLN B 50 94.455 18.357 -4.609 1.00 0.00 N ATOM 0 H GLN B 50 90.747 21.125 -3.478 1.00 0.00 H new ATOM 0 HA GLN B 50 89.615 18.514 -3.349 1.00 0.00 H new ATOM 0 HB2 GLN B 50 91.907 17.773 -3.829 1.00 0.00 H new ATOM 0 HB3 GLN B 50 91.524 19.181 -4.799 1.00 0.00 H new ATOM 0 HG2 GLN B 50 92.625 20.620 -2.976 1.00 0.00 H new ATOM 0 HG3 GLN B 50 93.165 19.134 -2.220 1.00 0.00 H new ATOM 0 HE21 GLN B 50 93.980 17.505 -4.310 1.00 0.00 H new ATOM 0 HE22 GLN B 50 95.232 18.303 -5.268 1.00 0.00 H new ATOM 2283 N GLU B 51 91.294 19.450 -0.681 1.00 0.00 N ATOM 2284 CA GLU B 51 91.570 19.051 0.734 1.00 0.00 C ATOM 2285 C GLU B 51 90.277 18.594 1.408 1.00 0.00 C ATOM 2286 O GLU B 51 90.287 17.749 2.281 1.00 0.00 O ATOM 2287 CB GLU B 51 92.133 20.244 1.508 1.00 0.00 C ATOM 2288 CG GLU B 51 93.547 20.563 1.021 1.00 0.00 C ATOM 2289 CD GLU B 51 94.092 21.758 1.806 1.00 0.00 C ATOM 2290 OE1 GLU B 51 93.319 22.374 2.523 1.00 0.00 O ATOM 2291 OE2 GLU B 51 95.274 22.036 1.681 1.00 0.00 O ATOM 0 H GLU B 51 91.615 20.383 -0.939 1.00 0.00 H new ATOM 0 HA GLU B 51 92.293 18.235 0.733 1.00 0.00 H new ATOM 0 HB2 GLU B 51 91.488 21.113 1.373 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.149 20.021 2.575 1.00 0.00 H new ATOM 0 HG2 GLU B 51 94.195 19.697 1.157 1.00 0.00 H new ATOM 0 HG3 GLU B 51 93.535 20.788 -0.045 1.00 0.00 H new ATOM 2298 N VAL B 52 89.161 19.129 1.003 1.00 0.00 N ATOM 2299 CA VAL B 52 87.871 18.707 1.612 1.00 0.00 C ATOM 2300 C VAL B 52 87.599 17.249 1.238 1.00 0.00 C ATOM 2301 O VAL B 52 87.042 16.491 2.007 1.00 0.00 O ATOM 2302 CB VAL B 52 86.740 19.598 1.091 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.389 19.049 1.567 1.00 0.00 C ATOM 2304 CG2 VAL B 52 86.929 21.020 1.627 1.00 0.00 C ATOM 0 H VAL B 52 89.086 19.841 0.276 1.00 0.00 H new ATOM 0 HA VAL B 52 87.925 18.803 2.696 1.00 0.00 H new ATOM 0 HB VAL B 52 86.760 19.610 0.001 1.00 0.00 H new ATOM 0 HG11 VAL B 52 84.586 19.685 1.195 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.254 18.036 1.188 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.365 19.035 2.657 1.00 0.00 H new ATOM 0 HG21 VAL B 52 86.126 21.658 1.258 1.00 0.00 H new ATOM 0 HG22 VAL B 52 86.908 21.004 2.717 1.00 0.00 H new ATOM 0 HG23 VAL B 52 87.888 21.412 1.288 1.00 0.00 H new ATOM 2314 N VAL B 53 87.989 16.854 0.055 1.00 0.00 N ATOM 2315 CA VAL B 53 87.755 15.448 -0.383 1.00 0.00 C ATOM 2316 C VAL B 53 88.589 14.489 0.476 1.00 0.00 C ATOM 2317 O VAL B 53 88.105 13.474 0.938 1.00 0.00 O ATOM 2318 CB VAL B 53 88.164 15.305 -1.854 1.00 0.00 C ATOM 2319 CG1 VAL B 53 88.113 13.831 -2.269 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.210 16.120 -2.733 1.00 0.00 C ATOM 0 H VAL B 53 88.461 17.447 -0.628 1.00 0.00 H new ATOM 0 HA VAL B 53 86.699 15.203 -0.268 1.00 0.00 H new ATOM 0 HB VAL B 53 89.181 15.676 -1.980 1.00 0.00 H new ATOM 0 HG11 VAL B 53 88.405 13.737 -3.315 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.798 13.254 -1.648 1.00 0.00 H new ATOM 0 HG13 VAL B 53 87.099 13.451 -2.140 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.502 16.018 -3.778 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.192 15.753 -2.603 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.257 17.170 -2.444 1.00 0.00 H new ATOM 2330 N ASP B 54 89.841 14.794 0.679 1.00 0.00 N ATOM 2331 CA ASP B 54 90.711 13.889 1.488 1.00 0.00 C ATOM 2332 C ASP B 54 90.153 13.740 2.904 1.00 0.00 C ATOM 2333 O ASP B 54 90.128 12.659 3.459 1.00 0.00 O ATOM 2334 CB ASP B 54 92.125 14.473 1.559 1.00 0.00 C ATOM 2335 CG ASP B 54 92.789 14.367 0.186 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.447 13.453 -0.547 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.628 15.201 -0.110 1.00 0.00 O ATOM 0 H ASP B 54 90.301 15.631 0.320 1.00 0.00 H new ATOM 0 HA ASP B 54 90.738 12.908 1.013 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.084 15.515 1.876 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.715 13.937 2.303 1.00 0.00 H new ATOM 2342 N LYS B 55 89.699 14.808 3.492 1.00 0.00 N ATOM 2343 CA LYS B 55 89.135 14.708 4.867 1.00 0.00 C ATOM 2344 C LYS B 55 87.939 13.761 4.840 1.00 0.00 C ATOM 2345 O LYS B 55 87.828 12.847 5.633 1.00 0.00 O ATOM 2346 CB LYS B 55 88.681 16.091 5.332 1.00 0.00 C ATOM 2347 CG LYS B 55 88.230 16.023 6.791 1.00 0.00 C ATOM 2348 CD LYS B 55 87.779 17.414 7.239 1.00 0.00 C ATOM 2349 CE LYS B 55 87.386 17.378 8.717 1.00 0.00 C ATOM 2350 NZ LYS B 55 86.950 18.738 9.143 1.00 0.00 N ATOM 0 H LYS B 55 89.693 15.743 3.084 1.00 0.00 H new ATOM 0 HA LYS B 55 89.892 14.329 5.553 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.497 16.806 5.227 1.00 0.00 H new ATOM 0 HB3 LYS B 55 87.863 16.446 4.705 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.413 15.309 6.900 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.047 15.671 7.421 1.00 0.00 H new ATOM 0 HD2 LYS B 55 88.582 18.135 7.084 1.00 0.00 H new ATOM 0 HD3 LYS B 55 86.933 17.744 6.636 1.00 0.00 H new ATOM 0 HE2 LYS B 55 86.581 16.660 8.874 1.00 0.00 H new ATOM 0 HE3 LYS B 55 88.231 17.048 9.322 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 86.682 18.718 10.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 87.731 19.411 9.006 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 86.133 19.035 8.573 1.00 0.00 H new ATOM 2364 N VAL B 56 87.044 13.983 3.922 1.00 0.00 N ATOM 2365 CA VAL B 56 85.841 13.116 3.816 1.00 0.00 C ATOM 2366 C VAL B 56 86.257 11.717 3.356 1.00 0.00 C ATOM 2367 O VAL B 56 85.749 10.720 3.829 1.00 0.00 O ATOM 2368 CB VAL B 56 84.876 13.735 2.798 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.744 12.755 2.475 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.283 15.019 3.383 1.00 0.00 C ATOM 0 H VAL B 56 87.095 14.735 3.234 1.00 0.00 H new ATOM 0 HA VAL B 56 85.350 13.037 4.786 1.00 0.00 H new ATOM 0 HB VAL B 56 85.421 13.960 1.881 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.066 13.208 1.751 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.163 11.840 2.057 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.196 12.519 3.387 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.596 15.463 2.663 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.745 14.786 4.302 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.085 15.724 3.601 1.00 0.00 H new ATOM 2380 N MET B 57 87.170 11.637 2.428 1.00 0.00 N ATOM 2381 CA MET B 57 87.610 10.304 1.929 1.00 0.00 C ATOM 2382 C MET B 57 88.230 9.489 3.069 1.00 0.00 C ATOM 2383 O MET B 57 87.863 8.355 3.303 1.00 0.00 O ATOM 2384 CB MET B 57 88.646 10.506 0.820 1.00 0.00 C ATOM 2385 CG MET B 57 88.955 9.168 0.144 1.00 0.00 C ATOM 2386 SD MET B 57 87.536 8.654 -0.853 1.00 0.00 S ATOM 2387 CE MET B 57 88.345 7.277 -1.702 1.00 0.00 C ATOM 0 H MET B 57 87.630 12.437 1.994 1.00 0.00 H new ATOM 0 HA MET B 57 86.748 9.761 1.540 1.00 0.00 H new ATOM 0 HB2 MET B 57 88.270 11.217 0.084 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.559 10.932 1.237 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.840 9.262 -0.485 1.00 0.00 H new ATOM 0 HG3 MET B 57 89.178 8.411 0.896 1.00 0.00 H new ATOM 0 HE1 MET B 57 87.763 6.998 -2.580 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.346 7.578 -2.011 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.414 6.424 -1.027 1.00 0.00 H new ATOM 2397 N GLU B 58 89.164 10.055 3.780 1.00 0.00 N ATOM 2398 CA GLU B 58 89.798 9.300 4.901 1.00 0.00 C ATOM 2399 C GLU B 58 88.734 8.989 5.948 1.00 0.00 C ATOM 2400 O GLU B 58 88.671 7.903 6.488 1.00 0.00 O ATOM 2401 CB GLU B 58 90.913 10.147 5.531 1.00 0.00 C ATOM 2402 CG GLU B 58 91.595 9.366 6.662 1.00 0.00 C ATOM 2403 CD GLU B 58 92.227 8.090 6.104 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.527 8.069 4.922 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.403 7.155 6.868 1.00 0.00 O ATOM 0 H GLU B 58 89.516 11.002 3.637 1.00 0.00 H new ATOM 0 HA GLU B 58 90.229 8.372 4.525 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.647 10.418 4.772 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.498 11.077 5.920 1.00 0.00 H new ATOM 0 HG2 GLU B 58 92.359 9.984 7.134 1.00 0.00 H new ATOM 0 HG3 GLU B 58 90.867 9.115 7.433 1.00 0.00 H new ATOM 2412 N THR B 59 87.889 9.937 6.226 1.00 0.00 N ATOM 2413 CA THR B 59 86.812 9.717 7.226 1.00 0.00 C ATOM 2414 C THR B 59 85.813 8.706 6.667 1.00 0.00 C ATOM 2415 O THR B 59 85.321 7.845 7.371 1.00 0.00 O ATOM 2416 CB THR B 59 86.101 11.042 7.509 1.00 0.00 C ATOM 2417 OG1 THR B 59 87.040 11.978 8.020 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.989 10.820 8.535 1.00 0.00 C ATOM 0 H THR B 59 87.898 10.864 5.800 1.00 0.00 H new ATOM 0 HA THR B 59 87.240 9.335 8.153 1.00 0.00 H new ATOM 0 HB THR B 59 85.666 11.426 6.586 1.00 0.00 H new ATOM 0 HG1 THR B 59 87.534 12.384 7.278 1.00 0.00 H new ATOM 0 HG21 THR B 59 84.484 11.765 8.735 1.00 0.00 H new ATOM 0 HG22 THR B 59 84.270 10.101 8.143 1.00 0.00 H new ATOM 0 HG23 THR B 59 85.419 10.436 9.460 1.00 0.00 H new ATOM 2426 N LEU B 60 85.511 8.805 5.403 1.00 0.00 N ATOM 2427 CA LEU B 60 84.544 7.849 4.798 1.00 0.00 C ATOM 2428 C LEU B 60 85.173 6.459 4.714 1.00 0.00 C ATOM 2429 O LEU B 60 84.522 5.462 4.954 1.00 0.00 O ATOM 2430 CB LEU B 60 84.153 8.331 3.395 1.00 0.00 C ATOM 2431 CG LEU B 60 83.198 7.325 2.729 1.00 0.00 C ATOM 2432 CD1 LEU B 60 81.938 7.138 3.587 1.00 0.00 C ATOM 2433 CD2 LEU B 60 82.801 7.860 1.349 1.00 0.00 C ATOM 0 H LEU B 60 85.891 9.504 4.765 1.00 0.00 H new ATOM 0 HA LEU B 60 83.651 7.797 5.421 1.00 0.00 H new ATOM 0 HB2 LEU B 60 83.675 9.308 3.459 1.00 0.00 H new ATOM 0 HB3 LEU B 60 85.047 8.453 2.783 1.00 0.00 H new ATOM 0 HG LEU B 60 83.699 6.362 2.630 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.271 6.424 3.104 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.220 6.763 4.571 1.00 0.00 H new ATOM 0 HD13 LEU B 60 81.427 8.095 3.696 1.00 0.00 H new ATOM 0 HD21 LEU B 60 82.124 7.155 0.867 1.00 0.00 H new ATOM 0 HD22 LEU B 60 82.303 8.823 1.462 1.00 0.00 H new ATOM 0 HD23 LEU B 60 83.694 7.983 0.736 1.00 0.00 H new ATOM 2445 N ASP B 61 86.425 6.378 4.363 1.00 0.00 N ATOM 2446 CA ASP B 61 87.077 5.043 4.252 1.00 0.00 C ATOM 2447 C ASP B 61 87.175 4.403 5.635 1.00 0.00 C ATOM 2448 O ASP B 61 88.004 4.768 6.446 1.00 0.00 O ATOM 2449 CB ASP B 61 88.480 5.205 3.662 1.00 0.00 C ATOM 2450 CG ASP B 61 88.371 5.597 2.188 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.323 5.365 1.609 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.340 6.121 1.662 1.00 0.00 O ATOM 0 H ASP B 61 87.024 7.175 4.149 1.00 0.00 H new ATOM 0 HA ASP B 61 86.481 4.404 3.600 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.032 5.967 4.212 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.038 4.274 3.761 1.00 0.00 H new ATOM 2457 N GLU B 62 86.331 3.451 5.906 1.00 0.00 N ATOM 2458 CA GLU B 62 86.362 2.779 7.231 1.00 0.00 C ATOM 2459 C GLU B 62 87.708 2.076 7.427 1.00 0.00 C ATOM 2460 O GLU B 62 88.267 2.074 8.506 1.00 0.00 O ATOM 2461 CB GLU B 62 85.233 1.748 7.299 1.00 0.00 C ATOM 2462 CG GLU B 62 83.884 2.471 7.361 1.00 0.00 C ATOM 2463 CD GLU B 62 82.754 1.442 7.414 1.00 0.00 C ATOM 2464 OE1 GLU B 62 82.376 0.953 6.363 1.00 0.00 O ATOM 2465 OE2 GLU B 62 82.284 1.161 8.505 1.00 0.00 O ATOM 0 H GLU B 62 85.617 3.108 5.263 1.00 0.00 H new ATOM 0 HA GLU B 62 86.230 3.523 8.017 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.268 1.096 6.426 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.358 1.113 8.176 1.00 0.00 H new ATOM 0 HG2 GLU B 62 83.845 3.115 8.240 1.00 0.00 H new ATOM 0 HG3 GLU B 62 83.764 3.114 6.489 1.00 0.00 H new ATOM 2472 N ASP B 63 88.223 1.459 6.395 1.00 0.00 N ATOM 2473 CA ASP B 63 89.522 0.728 6.519 1.00 0.00 C ATOM 2474 C ASP B 63 90.706 1.630 6.145 1.00 0.00 C ATOM 2475 O ASP B 63 91.849 1.258 6.320 1.00 0.00 O ATOM 2476 CB ASP B 63 89.492 -0.485 5.588 1.00 0.00 C ATOM 2477 CG ASP B 63 89.294 -0.015 4.146 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.061 1.167 3.955 1.00 0.00 O ATOM 2479 OD2 ASP B 63 89.368 -0.848 3.258 1.00 0.00 O ATOM 0 H ASP B 63 87.799 1.429 5.468 1.00 0.00 H new ATOM 0 HA ASP B 63 89.651 0.414 7.555 1.00 0.00 H new ATOM 0 HB2 ASP B 63 90.422 -1.047 5.674 1.00 0.00 H new ATOM 0 HB3 ASP B 63 88.685 -1.159 5.876 1.00 0.00 H new ATOM 2484 N GLY B 64 90.459 2.806 5.640 1.00 0.00 N ATOM 2485 CA GLY B 64 91.596 3.702 5.274 1.00 0.00 C ATOM 2486 C GLY B 64 92.381 3.101 4.104 1.00 0.00 C ATOM 2487 O GLY B 64 93.558 3.359 3.940 1.00 0.00 O ATOM 0 H GLY B 64 89.528 3.185 5.465 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.220 4.688 5.002 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.254 3.838 6.132 1.00 0.00 H new ATOM 2491 N ASP B 65 91.747 2.303 3.288 1.00 0.00 N ATOM 2492 CA ASP B 65 92.467 1.693 2.133 1.00 0.00 C ATOM 2493 C ASP B 65 92.782 2.777 1.103 1.00 0.00 C ATOM 2494 O ASP B 65 93.414 2.526 0.096 1.00 0.00 O ATOM 2495 CB ASP B 65 91.586 0.623 1.486 1.00 0.00 C ATOM 2496 CG ASP B 65 90.301 1.271 0.969 1.00 0.00 C ATOM 2497 OD1 ASP B 65 89.980 2.352 1.434 1.00 0.00 O ATOM 2498 OD2 ASP B 65 89.661 0.677 0.118 1.00 0.00 O ATOM 0 H ASP B 65 90.763 2.047 3.371 1.00 0.00 H new ATOM 0 HA ASP B 65 93.393 1.238 2.484 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.120 0.143 0.666 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.348 -0.156 2.211 1.00 0.00 H new ATOM 2503 N GLY B 66 92.366 3.990 1.358 1.00 0.00 N ATOM 2504 CA GLY B 66 92.660 5.103 0.409 1.00 0.00 C ATOM 2505 C GLY B 66 91.604 5.168 -0.700 1.00 0.00 C ATOM 2506 O GLY B 66 91.449 6.186 -1.346 1.00 0.00 O ATOM 0 H GLY B 66 91.834 4.258 2.186 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.685 6.050 0.949 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.647 4.960 -0.031 1.00 0.00 H new ATOM 2510 N GLU B 67 90.870 4.102 -0.925 1.00 0.00 N ATOM 2511 CA GLU B 67 89.817 4.102 -1.992 1.00 0.00 C ATOM 2512 C GLU B 67 88.477 3.720 -1.369 1.00 0.00 C ATOM 2513 O GLU B 67 88.405 3.367 -0.208 1.00 0.00 O ATOM 2514 CB GLU B 67 90.166 3.070 -3.067 1.00 0.00 C ATOM 2515 CG GLU B 67 91.483 3.452 -3.741 1.00 0.00 C ATOM 2516 CD GLU B 67 92.642 3.149 -2.793 1.00 0.00 C ATOM 2517 OE1 GLU B 67 92.554 2.165 -2.076 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.597 3.907 -2.794 1.00 0.00 O ATOM 0 H GLU B 67 90.957 3.225 -0.411 1.00 0.00 H new ATOM 0 HA GLU B 67 89.761 5.094 -2.440 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.249 2.079 -2.620 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.369 3.019 -3.808 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.604 2.896 -4.671 1.00 0.00 H new ATOM 0 HG3 GLU B 67 91.478 4.511 -4.001 1.00 0.00 H new ATOM 2525 N CYS B 68 87.411 3.788 -2.131 1.00 0.00 N ATOM 2526 CA CYS B 68 86.062 3.426 -1.592 1.00 0.00 C ATOM 2527 C CYS B 68 85.602 2.101 -2.211 1.00 0.00 C ATOM 2528 O CYS B 68 85.215 2.039 -3.363 1.00 0.00 O ATOM 2529 CB CYS B 68 85.067 4.530 -1.956 1.00 0.00 C ATOM 2530 SG CYS B 68 85.512 6.052 -1.083 1.00 0.00 S ATOM 0 H CYS B 68 87.418 4.080 -3.108 1.00 0.00 H new ATOM 0 HA CYS B 68 86.115 3.319 -0.509 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.073 4.700 -3.033 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.055 4.226 -1.687 1.00 0.00 H new ATOM 0 HG CYS B 68 86.236 5.760 -0.044 1.00 0.00 H new ATOM 2536 N ASP B 69 85.671 1.037 -1.458 1.00 0.00 N ATOM 2537 CA ASP B 69 85.270 -0.298 -1.990 1.00 0.00 C ATOM 2538 C ASP B 69 83.751 -0.362 -2.191 1.00 0.00 C ATOM 2539 O ASP B 69 83.025 0.552 -1.859 1.00 0.00 O ATOM 2540 CB ASP B 69 85.695 -1.385 -0.999 1.00 0.00 C ATOM 2541 CG ASP B 69 87.221 -1.487 -0.975 1.00 0.00 C ATOM 2542 OD1 ASP B 69 87.842 -1.018 -1.915 1.00 0.00 O ATOM 2543 OD2 ASP B 69 87.743 -2.034 -0.018 1.00 0.00 O ATOM 0 H ASP B 69 85.990 1.035 -0.489 1.00 0.00 H new ATOM 0 HA ASP B 69 85.759 -0.456 -2.951 1.00 0.00 H new ATOM 0 HB2 ASP B 69 85.320 -1.150 -0.003 1.00 0.00 H new ATOM 0 HB3 ASP B 69 85.261 -2.343 -1.285 1.00 0.00 H new ATOM 2548 N PHE B 70 83.277 -1.455 -2.727 1.00 0.00 N ATOM 2549 CA PHE B 70 81.808 -1.609 -2.945 1.00 0.00 C ATOM 2550 C PHE B 70 81.085 -1.513 -1.601 1.00 0.00 C ATOM 2551 O PHE B 70 80.097 -0.819 -1.460 1.00 0.00 O ATOM 2552 CB PHE B 70 81.513 -2.970 -3.580 1.00 0.00 C ATOM 2553 CG PHE B 70 80.023 -3.118 -3.786 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.230 -3.670 -2.773 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.433 -2.703 -4.987 1.00 0.00 C ATOM 2556 CE1 PHE B 70 77.849 -3.807 -2.959 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.051 -2.841 -5.173 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.260 -3.392 -4.158 1.00 0.00 C ATOM 0 H PHE B 70 83.844 -2.249 -3.024 1.00 0.00 H new ATOM 0 HA PHE B 70 81.460 -0.819 -3.611 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.033 -3.059 -4.534 1.00 0.00 H new ATOM 0 HB3 PHE B 70 81.884 -3.770 -2.939 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.684 -3.991 -1.847 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.043 -2.277 -5.769 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.238 -4.233 -2.177 1.00 0.00 H new ATOM 0 HE2 PHE B 70 77.596 -2.522 -6.099 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.195 -3.497 -4.301 1.00 0.00 H new ATOM 2568 N GLN B 71 81.557 -2.232 -0.623 1.00 0.00 N ATOM 2569 CA GLN B 71 80.881 -2.207 0.704 1.00 0.00 C ATOM 2570 C GLN B 71 80.859 -0.767 1.225 1.00 0.00 C ATOM 2571 O GLN B 71 79.814 -0.235 1.545 1.00 0.00 O ATOM 2572 CB GLN B 71 81.646 -3.097 1.685 1.00 0.00 C ATOM 2573 CG GLN B 71 80.818 -3.286 2.960 1.00 0.00 C ATOM 2574 CD GLN B 71 79.614 -4.183 2.661 1.00 0.00 C ATOM 2575 OE1 GLN B 71 79.767 -5.366 2.428 1.00 0.00 O ATOM 2576 NE2 GLN B 71 78.415 -3.668 2.659 1.00 0.00 N ATOM 0 H GLN B 71 82.378 -2.834 -0.683 1.00 0.00 H new ATOM 0 HA GLN B 71 79.861 -2.578 0.606 1.00 0.00 H new ATOM 0 HB2 GLN B 71 81.854 -4.064 1.228 1.00 0.00 H new ATOM 0 HB3 GLN B 71 82.608 -2.645 1.928 1.00 0.00 H new ATOM 0 HG2 GLN B 71 81.432 -3.733 3.742 1.00 0.00 H new ATOM 0 HG3 GLN B 71 80.480 -2.319 3.333 1.00 0.00 H new ATOM 0 HE21 GLN B 71 78.286 -2.675 2.855 1.00 0.00 H new ATOM 0 HE22 GLN B 71 77.607 -4.258 2.462 1.00 0.00 H new ATOM 2585 N GLU B 72 81.994 -0.128 1.316 1.00 0.00 N ATOM 2586 CA GLU B 72 82.002 1.278 1.822 1.00 0.00 C ATOM 2587 C GLU B 72 81.140 2.133 0.890 1.00 0.00 C ATOM 2588 O GLU B 72 80.361 2.961 1.319 1.00 0.00 O ATOM 2589 CB GLU B 72 83.436 1.816 1.824 1.00 0.00 C ATOM 2590 CG GLU B 72 84.247 1.110 2.911 1.00 0.00 C ATOM 2591 CD GLU B 72 85.679 1.650 2.909 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.017 2.371 1.985 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.411 1.336 3.833 1.00 0.00 O ATOM 0 H GLU B 72 82.906 -0.511 1.066 1.00 0.00 H new ATOM 0 HA GLU B 72 81.607 1.311 2.837 1.00 0.00 H new ATOM 0 HB2 GLU B 72 83.897 1.655 0.850 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.431 2.892 2.000 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.787 1.272 3.886 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.252 0.034 2.735 1.00 0.00 H new ATOM 2600 N PHE B 73 81.291 1.929 -0.388 1.00 0.00 N ATOM 2601 CA PHE B 73 80.494 2.724 -1.366 1.00 0.00 C ATOM 2602 C PHE B 73 79.023 2.654 -0.954 1.00 0.00 C ATOM 2603 O PHE B 73 78.337 3.654 -0.882 1.00 0.00 O ATOM 2604 CB PHE B 73 80.666 2.156 -2.776 1.00 0.00 C ATOM 2605 CG PHE B 73 79.718 2.858 -3.719 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.123 4.019 -4.387 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.434 2.342 -3.928 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.244 4.665 -5.264 1.00 0.00 C ATOM 2609 CE2 PHE B 73 77.554 2.987 -4.805 1.00 0.00 C ATOM 2610 CZ PHE B 73 77.959 4.149 -5.473 1.00 0.00 C ATOM 0 H PHE B 73 81.930 1.248 -0.798 1.00 0.00 H new ATOM 0 HA PHE B 73 80.837 3.759 -1.370 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.695 2.290 -3.111 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.468 1.084 -2.775 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.114 4.417 -4.226 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.122 1.446 -3.412 1.00 0.00 H new ATOM 0 HE1 PHE B 73 79.557 5.561 -5.779 1.00 0.00 H new ATOM 0 HE2 PHE B 73 76.563 2.589 -4.966 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.280 4.647 -6.149 1.00 0.00 H new ATOM 2620 N MET B 74 78.546 1.482 -0.647 1.00 0.00 N ATOM 2621 CA MET B 74 77.134 1.346 -0.199 1.00 0.00 C ATOM 2622 C MET B 74 76.999 1.998 1.180 1.00 0.00 C ATOM 2623 O MET B 74 76.028 2.654 1.484 1.00 0.00 O ATOM 2624 CB MET B 74 76.765 -0.139 -0.101 1.00 0.00 C ATOM 2625 CG MET B 74 76.776 -0.773 -1.496 1.00 0.00 C ATOM 2626 SD MET B 74 75.481 -0.030 -2.525 1.00 0.00 S ATOM 2627 CE MET B 74 74.045 -0.721 -1.662 1.00 0.00 C ATOM 0 H MET B 74 79.074 0.610 -0.687 1.00 0.00 H new ATOM 0 HA MET B 74 76.467 1.831 -0.912 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.471 -0.656 0.548 1.00 0.00 H new ATOM 0 HB3 MET B 74 75.779 -0.248 0.350 1.00 0.00 H new ATOM 0 HG2 MET B 74 77.750 -0.628 -1.963 1.00 0.00 H new ATOM 0 HG3 MET B 74 76.617 -1.848 -1.417 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.203 -0.787 -2.351 1.00 0.00 H new ATOM 0 HE2 MET B 74 74.288 -1.716 -1.290 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.778 -0.076 -0.825 1.00 0.00 H new ATOM 2637 N ALA B 75 77.976 1.815 2.021 1.00 0.00 N ATOM 2638 CA ALA B 75 77.924 2.410 3.388 1.00 0.00 C ATOM 2639 C ALA B 75 77.754 3.929 3.303 1.00 0.00 C ATOM 2640 O ALA B 75 77.400 4.579 4.269 1.00 0.00 O ATOM 2641 CB ALA B 75 79.233 2.109 4.107 1.00 0.00 C ATOM 0 H ALA B 75 78.817 1.274 1.820 1.00 0.00 H new ATOM 0 HA ALA B 75 77.079 1.983 3.928 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.206 2.540 5.108 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.368 1.030 4.180 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.063 2.542 3.548 1.00 0.00 H new ATOM 2647 N PHE B 76 77.941 4.500 2.147 1.00 0.00 N ATOM 2648 CA PHE B 76 77.736 5.966 1.985 1.00 0.00 C ATOM 2649 C PHE B 76 76.288 6.184 1.552 1.00 0.00 C ATOM 2650 O PHE B 76 75.675 7.200 1.815 1.00 0.00 O ATOM 2651 CB PHE B 76 78.679 6.482 0.900 1.00 0.00 C ATOM 2652 CG PHE B 76 78.459 7.956 0.692 1.00 0.00 C ATOM 2653 CD1 PHE B 76 77.519 8.385 -0.247 1.00 0.00 C ATOM 2654 CD2 PHE B 76 79.199 8.891 1.424 1.00 0.00 C ATOM 2655 CE1 PHE B 76 77.316 9.755 -0.459 1.00 0.00 C ATOM 2656 CE2 PHE B 76 78.997 10.261 1.216 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.056 10.693 0.275 1.00 0.00 C ATOM 0 H PHE B 76 78.229 4.010 1.300 1.00 0.00 H new ATOM 0 HA PHE B 76 77.939 6.496 2.916 1.00 0.00 H new ATOM 0 HB2 PHE B 76 79.714 6.296 1.187 1.00 0.00 H new ATOM 0 HB3 PHE B 76 78.505 5.944 -0.032 1.00 0.00 H new ATOM 0 HD1 PHE B 76 76.948 7.661 -0.810 1.00 0.00 H new ATOM 0 HD2 PHE B 76 79.926 8.556 2.149 1.00 0.00 H new ATOM 0 HE1 PHE B 76 76.591 10.088 -1.187 1.00 0.00 H new ATOM 0 HE2 PHE B 76 79.567 10.983 1.781 1.00 0.00 H new ATOM 0 HZ PHE B 76 77.900 11.749 0.114 1.00 0.00 H new ATOM 2667 N VAL B 77 75.753 5.197 0.894 1.00 0.00 N ATOM 2668 CA VAL B 77 74.341 5.283 0.433 1.00 0.00 C ATOM 2669 C VAL B 77 73.463 5.460 1.672 1.00 0.00 C ATOM 2670 O VAL B 77 72.550 6.260 1.691 1.00 0.00 O ATOM 2671 CB VAL B 77 73.938 4.011 -0.321 1.00 0.00 C ATOM 2672 CG1 VAL B 77 72.440 4.047 -0.617 1.00 0.00 C ATOM 2673 CG2 VAL B 77 74.719 3.930 -1.635 1.00 0.00 C ATOM 0 H VAL B 77 76.234 4.330 0.654 1.00 0.00 H new ATOM 0 HA VAL B 77 74.219 6.123 -0.251 1.00 0.00 H new ATOM 0 HB VAL B 77 74.165 3.137 0.290 1.00 0.00 H new ATOM 0 HG11 VAL B 77 72.153 3.142 -1.153 1.00 0.00 H new ATOM 0 HG12 VAL B 77 71.885 4.105 0.320 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.211 4.920 -1.229 1.00 0.00 H new ATOM 0 HG21 VAL B 77 74.434 3.026 -2.173 1.00 0.00 H new ATOM 0 HG22 VAL B 77 74.493 4.803 -2.247 1.00 0.00 H new ATOM 0 HG23 VAL B 77 75.788 3.903 -1.422 1.00 0.00 H new ATOM 2683 N SER B 78 73.751 4.731 2.720 1.00 0.00 N ATOM 2684 CA SER B 78 72.952 4.875 3.968 1.00 0.00 C ATOM 2685 C SER B 78 73.199 6.265 4.557 1.00 0.00 C ATOM 2686 O SER B 78 72.282 6.948 4.965 1.00 0.00 O ATOM 2687 CB SER B 78 73.376 3.808 4.977 1.00 0.00 C ATOM 2688 OG SER B 78 72.628 3.972 6.176 1.00 0.00 O ATOM 0 H SER B 78 74.504 4.044 2.763 1.00 0.00 H new ATOM 0 HA SER B 78 71.893 4.751 3.743 1.00 0.00 H new ATOM 0 HB2 SER B 78 73.209 2.813 4.564 1.00 0.00 H new ATOM 0 HB3 SER B 78 74.443 3.892 5.186 1.00 0.00 H new ATOM 0 HG SER B 78 72.375 3.093 6.527 1.00 0.00 H new ATOM 2694 N MET B 79 74.433 6.683 4.623 1.00 0.00 N ATOM 2695 CA MET B 79 74.724 8.026 5.208 1.00 0.00 C ATOM 2696 C MET B 79 73.836 9.074 4.535 1.00 0.00 C ATOM 2697 O MET B 79 73.317 9.966 5.177 1.00 0.00 O ATOM 2698 CB MET B 79 76.195 8.379 4.973 1.00 0.00 C ATOM 2699 CG MET B 79 77.085 7.485 5.838 1.00 0.00 C ATOM 2700 SD MET B 79 78.827 7.896 5.547 1.00 0.00 S ATOM 2701 CE MET B 79 78.815 9.556 6.270 1.00 0.00 C ATOM 0 H MET B 79 75.247 6.160 4.301 1.00 0.00 H new ATOM 0 HA MET B 79 74.522 8.008 6.279 1.00 0.00 H new ATOM 0 HB2 MET B 79 76.446 8.249 3.920 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.371 9.427 5.216 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.840 7.621 6.891 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.904 6.437 5.601 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.813 9.803 6.632 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.514 10.280 5.513 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.110 9.586 7.101 1.00 0.00 H new ATOM 2711 N VAL B 80 73.648 8.967 3.255 1.00 0.00 N ATOM 2712 CA VAL B 80 72.781 9.948 2.540 1.00 0.00 C ATOM 2713 C VAL B 80 71.327 9.790 3.006 1.00 0.00 C ATOM 2714 O VAL B 80 70.568 10.738 3.032 1.00 0.00 O ATOM 2715 CB VAL B 80 72.866 9.707 1.032 1.00 0.00 C ATOM 2716 CG1 VAL B 80 71.919 10.668 0.310 1.00 0.00 C ATOM 2717 CG2 VAL B 80 74.300 9.953 0.556 1.00 0.00 C ATOM 0 H VAL B 80 74.057 8.241 2.667 1.00 0.00 H new ATOM 0 HA VAL B 80 73.123 10.959 2.764 1.00 0.00 H new ATOM 0 HB VAL B 80 72.581 8.678 0.811 1.00 0.00 H new ATOM 0 HG11 VAL B 80 71.978 10.498 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL B 80 70.898 10.496 0.649 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.206 11.696 0.531 1.00 0.00 H new ATOM 0 HG21 VAL B 80 74.361 9.781 -0.519 1.00 0.00 H new ATOM 0 HG22 VAL B 80 74.585 10.982 0.776 1.00 0.00 H new ATOM 0 HG23 VAL B 80 74.976 9.271 1.071 1.00 0.00 H new ATOM 2727 N THR B 81 70.940 8.602 3.394 1.00 0.00 N ATOM 2728 CA THR B 81 69.548 8.392 3.878 1.00 0.00 C ATOM 2729 C THR B 81 69.448 8.826 5.344 1.00 0.00 C ATOM 2730 O THR B 81 68.537 9.527 5.738 1.00 0.00 O ATOM 2731 CB THR B 81 69.188 6.911 3.757 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.133 6.131 4.474 1.00 0.00 O ATOM 2733 CG2 THR B 81 69.192 6.500 2.284 1.00 0.00 C ATOM 0 H THR B 81 71.530 7.770 3.396 1.00 0.00 H new ATOM 0 HA THR B 81 68.858 8.984 3.277 1.00 0.00 H new ATOM 0 HB THR B 81 68.194 6.746 4.174 1.00 0.00 H new ATOM 0 HG1 THR B 81 70.959 6.645 4.592 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.935 5.444 2.200 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.461 7.096 1.738 1.00 0.00 H new ATOM 0 HG23 THR B 81 70.183 6.667 1.862 1.00 0.00 H new ATOM 2741 N THR B 82 70.386 8.409 6.150 1.00 0.00 N ATOM 2742 CA THR B 82 70.374 8.779 7.590 1.00 0.00 C ATOM 2743 C THR B 82 70.685 10.266 7.748 1.00 0.00 C ATOM 2744 O THR B 82 70.456 10.851 8.788 1.00 0.00 O ATOM 2745 CB THR B 82 71.435 7.963 8.326 1.00 0.00 C ATOM 2746 OG1 THR B 82 72.723 8.333 7.857 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.204 6.475 8.070 1.00 0.00 C ATOM 0 H THR B 82 71.169 7.820 5.866 1.00 0.00 H new ATOM 0 HA THR B 82 69.388 8.572 8.007 1.00 0.00 H new ATOM 0 HB THR B 82 71.368 8.159 9.396 1.00 0.00 H new ATOM 0 HG1 THR B 82 73.405 7.811 8.329 1.00 0.00 H new ATOM 0 HG21 THR B 82 71.962 5.894 8.596 1.00 0.00 H new ATOM 0 HG22 THR B 82 70.215 6.193 8.431 1.00 0.00 H new ATOM 0 HG23 THR B 82 71.270 6.275 7.001 1.00 0.00 H new ATOM 2755 N ALA B 83 71.195 10.888 6.723 1.00 0.00 N ATOM 2756 CA ALA B 83 71.507 12.338 6.817 1.00 0.00 C ATOM 2757 C ALA B 83 70.198 13.128 6.866 1.00 0.00 C ATOM 2758 O ALA B 83 70.027 14.025 7.669 1.00 0.00 O ATOM 2759 CB ALA B 83 72.319 12.753 5.592 1.00 0.00 C ATOM 0 H ALA B 83 71.409 10.454 5.825 1.00 0.00 H new ATOM 0 HA ALA B 83 72.085 12.541 7.719 1.00 0.00 H new ATOM 0 HB1 ALA B 83 72.552 13.816 5.653 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.245 12.180 5.558 1.00 0.00 H new ATOM 0 HB3 ALA B 83 71.740 12.560 4.689 1.00 0.00 H new ATOM 2765 N CYS B 84 69.273 12.797 6.008 1.00 0.00 N ATOM 2766 CA CYS B 84 67.971 13.519 5.991 1.00 0.00 C ATOM 2767 C CYS B 84 67.085 12.993 7.122 1.00 0.00 C ATOM 2768 O CYS B 84 67.114 11.823 7.450 1.00 0.00 O ATOM 2769 CB CYS B 84 67.278 13.283 4.649 1.00 0.00 C ATOM 2770 SG CYS B 84 68.201 14.121 3.337 1.00 0.00 S ATOM 0 H CYS B 84 69.364 12.054 5.315 1.00 0.00 H new ATOM 0 HA CYS B 84 68.143 14.587 6.129 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.219 12.215 4.441 1.00 0.00 H new ATOM 0 HB3 CYS B 84 66.255 13.658 4.685 1.00 0.00 H new ATOM 0 HG CYS B 84 67.613 13.919 2.195 1.00 0.00 H new ATOM 2776 N HIS B 85 66.301 13.846 7.723 1.00 0.00 N ATOM 2777 CA HIS B 85 65.420 13.388 8.835 1.00 0.00 C ATOM 2778 C HIS B 85 64.174 12.710 8.259 1.00 0.00 C ATOM 2779 O HIS B 85 63.924 12.751 7.071 1.00 0.00 O ATOM 2780 CB HIS B 85 65.005 14.586 9.691 1.00 0.00 C ATOM 2781 CG HIS B 85 64.238 15.571 8.855 1.00 0.00 C ATOM 2782 ND1 HIS B 85 62.857 15.515 8.727 1.00 0.00 N ATOM 2783 CD2 HIS B 85 64.640 16.652 8.110 1.00 0.00 C ATOM 2784 CE1 HIS B 85 62.482 16.534 7.932 1.00 0.00 C ATOM 2785 NE2 HIS B 85 63.530 17.255 7.531 1.00 0.00 N ATOM 0 H HIS B 85 66.232 14.837 7.493 1.00 0.00 H new ATOM 0 HA HIS B 85 65.964 12.675 9.454 1.00 0.00 H new ATOM 0 HB2 HIS B 85 64.392 14.251 10.528 1.00 0.00 H new ATOM 0 HB3 HIS B 85 65.888 15.065 10.114 1.00 0.00 H new ATOM 0 HD2 HIS B 85 65.661 16.983 7.992 1.00 0.00 H new ATOM 0 HE1 HIS B 85 61.460 16.742 7.653 1.00 0.00 H new ATOM 0 HE2 HIS B 85 63.519 18.076 6.926 1.00 0.00 H new ATOM 2794 N GLU B 86 63.399 12.077 9.095 1.00 0.00 N ATOM 2795 CA GLU B 86 62.174 11.381 8.608 1.00 0.00 C ATOM 2796 C GLU B 86 61.143 12.409 8.136 1.00 0.00 C ATOM 2797 O GLU B 86 61.159 13.551 8.547 1.00 0.00 O ATOM 2798 CB GLU B 86 61.577 10.546 9.743 1.00 0.00 C ATOM 2799 CG GLU B 86 62.570 9.459 10.156 1.00 0.00 C ATOM 2800 CD GLU B 86 62.727 8.448 9.018 1.00 0.00 C ATOM 2801 OE1 GLU B 86 61.839 8.379 8.186 1.00 0.00 O ATOM 2802 OE2 GLU B 86 63.736 7.762 8.997 1.00 0.00 O ATOM 0 H GLU B 86 63.562 12.011 10.100 1.00 0.00 H new ATOM 0 HA GLU B 86 62.439 10.731 7.774 1.00 0.00 H new ATOM 0 HB2 GLU B 86 61.346 11.185 10.595 1.00 0.00 H new ATOM 0 HB3 GLU B 86 60.639 10.093 9.421 1.00 0.00 H new ATOM 0 HG2 GLU B 86 63.535 9.906 10.395 1.00 0.00 H new ATOM 0 HG3 GLU B 86 62.220 8.956 11.057 1.00 0.00 H new ATOM 2809 N PHE B 87 60.244 11.999 7.279 1.00 0.00 N ATOM 2810 CA PHE B 87 59.193 12.929 6.768 1.00 0.00 C ATOM 2811 C PHE B 87 59.845 14.115 6.051 1.00 0.00 C ATOM 2812 O PHE B 87 59.272 15.180 5.947 1.00 0.00 O ATOM 2813 CB PHE B 87 58.346 13.426 7.943 1.00 0.00 C ATOM 2814 CG PHE B 87 57.090 14.089 7.429 1.00 0.00 C ATOM 2815 CD1 PHE B 87 55.985 13.305 7.074 1.00 0.00 C ATOM 2816 CD2 PHE B 87 57.027 15.483 7.306 1.00 0.00 C ATOM 2817 CE1 PHE B 87 54.818 13.913 6.597 1.00 0.00 C ATOM 2818 CE2 PHE B 87 55.859 16.091 6.829 1.00 0.00 C ATOM 2819 CZ PHE B 87 54.754 15.306 6.475 1.00 0.00 C ATOM 0 H PHE B 87 60.193 11.050 6.908 1.00 0.00 H new ATOM 0 HA PHE B 87 58.555 12.402 6.058 1.00 0.00 H new ATOM 0 HB2 PHE B 87 58.086 12.591 8.594 1.00 0.00 H new ATOM 0 HB3 PHE B 87 58.920 14.132 8.543 1.00 0.00 H new ATOM 0 HD1 PHE B 87 56.033 12.230 7.168 1.00 0.00 H new ATOM 0 HD2 PHE B 87 57.879 16.089 7.579 1.00 0.00 H new ATOM 0 HE1 PHE B 87 53.967 13.307 6.323 1.00 0.00 H new ATOM 0 HE2 PHE B 87 55.810 17.166 6.734 1.00 0.00 H new ATOM 0 HZ PHE B 87 53.853 15.775 6.108 1.00 0.00 H new ATOM 2829 N PHE B 88 61.035 13.938 5.544 1.00 0.00 N ATOM 2830 CA PHE B 88 61.714 15.055 4.827 1.00 0.00 C ATOM 2831 C PHE B 88 60.854 15.474 3.635 1.00 0.00 C ATOM 2832 O PHE B 88 60.711 16.642 3.333 1.00 0.00 O ATOM 2833 CB PHE B 88 63.077 14.580 4.320 1.00 0.00 C ATOM 2834 CG PHE B 88 63.766 15.708 3.594 1.00 0.00 C ATOM 2835 CD1 PHE B 88 63.566 15.885 2.220 1.00 0.00 C ATOM 2836 CD2 PHE B 88 64.601 16.584 4.298 1.00 0.00 C ATOM 2837 CE1 PHE B 88 64.201 16.937 1.550 1.00 0.00 C ATOM 2838 CE2 PHE B 88 65.236 17.636 3.628 1.00 0.00 C ATOM 2839 CZ PHE B 88 65.037 17.813 2.253 1.00 0.00 C ATOM 0 H PHE B 88 61.566 13.069 5.595 1.00 0.00 H new ATOM 0 HA PHE B 88 61.851 15.898 5.504 1.00 0.00 H new ATOM 0 HB2 PHE B 88 63.690 14.243 5.156 1.00 0.00 H new ATOM 0 HB3 PHE B 88 62.951 13.727 3.653 1.00 0.00 H new ATOM 0 HD1 PHE B 88 62.922 15.210 1.677 1.00 0.00 H new ATOM 0 HD2 PHE B 88 64.755 16.448 5.358 1.00 0.00 H new ATOM 0 HE1 PHE B 88 64.046 17.073 0.490 1.00 0.00 H new ATOM 0 HE2 PHE B 88 65.880 18.312 4.172 1.00 0.00 H new ATOM 0 HZ PHE B 88 65.528 18.624 1.736 1.00 0.00 H new ATOM 2849 N GLU B 89 60.279 14.523 2.957 1.00 0.00 N ATOM 2850 CA GLU B 89 59.422 14.853 1.786 1.00 0.00 C ATOM 2851 C GLU B 89 58.200 15.639 2.268 1.00 0.00 C ATOM 2852 O GLU B 89 57.634 15.342 3.300 1.00 0.00 O ATOM 2853 CB GLU B 89 58.952 13.555 1.123 1.00 0.00 C ATOM 2854 CG GLU B 89 60.152 12.822 0.520 1.00 0.00 C ATOM 2855 CD GLU B 89 59.673 11.526 -0.140 1.00 0.00 C ATOM 2856 OE1 GLU B 89 58.504 11.206 0.008 1.00 0.00 O ATOM 2857 OE2 GLU B 89 60.484 10.873 -0.775 1.00 0.00 O ATOM 0 H GLU B 89 60.366 13.528 3.164 1.00 0.00 H new ATOM 0 HA GLU B 89 59.989 15.448 1.070 1.00 0.00 H new ATOM 0 HB2 GLU B 89 58.456 12.919 1.856 1.00 0.00 H new ATOM 0 HB3 GLU B 89 58.220 13.776 0.346 1.00 0.00 H new ATOM 0 HG2 GLU B 89 60.648 13.456 -0.215 1.00 0.00 H new ATOM 0 HG3 GLU B 89 60.884 12.599 1.296 1.00 0.00 H new ATOM 2864 N HIS B 90 57.794 16.639 1.528 1.00 0.00 N ATOM 2865 CA HIS B 90 56.605 17.453 1.931 1.00 0.00 C ATOM 2866 C HIS B 90 56.813 18.024 3.333 1.00 0.00 C ATOM 2867 O HIS B 90 55.869 18.290 4.051 1.00 0.00 O ATOM 2868 CB HIS B 90 55.361 16.573 1.950 1.00 0.00 C ATOM 2869 CG HIS B 90 55.187 15.905 0.616 1.00 0.00 C ATOM 2870 ND1 HIS B 90 55.628 14.611 0.375 1.00 0.00 N ATOM 2871 CD2 HIS B 90 54.617 16.332 -0.557 1.00 0.00 C ATOM 2872 CE1 HIS B 90 55.319 14.307 -0.899 1.00 0.00 C ATOM 2873 NE2 HIS B 90 54.702 15.322 -1.508 1.00 0.00 N ATOM 0 H HIS B 90 58.237 16.929 0.656 1.00 0.00 H new ATOM 0 HA HIS B 90 56.481 18.265 1.214 1.00 0.00 H new ATOM 0 HB2 HIS B 90 55.449 15.821 2.734 1.00 0.00 H new ATOM 0 HB3 HIS B 90 54.483 17.175 2.182 1.00 0.00 H new ATOM 0 HD2 HIS B 90 54.171 17.303 -0.717 1.00 0.00 H new ATOM 0 HE1 HIS B 90 55.542 13.361 -1.370 1.00 0.00 H new ATOM 0 HE2 HIS B 90 54.364 15.350 -2.470 1.00 0.00 H new ATOM 2882 N GLU B 91 58.032 18.214 3.727 1.00 0.00 N ATOM 2883 CA GLU B 91 58.292 18.769 5.086 1.00 0.00 C ATOM 2884 C GLU B 91 57.569 20.110 5.235 1.00 0.00 C ATOM 2885 O GLU B 91 56.646 20.177 6.029 1.00 0.00 O ATOM 2886 CB GLU B 91 59.794 18.977 5.286 1.00 0.00 C ATOM 2887 CG GLU B 91 60.045 19.547 6.684 1.00 0.00 C ATOM 2888 CD GLU B 91 61.546 19.536 6.979 1.00 0.00 C ATOM 2889 OE1 GLU B 91 62.286 19.008 6.166 1.00 0.00 O ATOM 2890 OE2 GLU B 91 61.929 20.051 8.018 1.00 0.00 O ATOM 2891 OXT GLU B 91 57.951 21.045 4.550 1.00 0.00 O ATOM 0 H GLU B 91 58.864 18.011 3.172 1.00 0.00 H new ATOM 0 HA GLU B 91 57.924 18.068 5.835 1.00 0.00 H new ATOM 0 HB2 GLU B 91 60.323 18.031 5.166 1.00 0.00 H new ATOM 0 HB3 GLU B 91 60.182 19.658 4.528 1.00 0.00 H new ATOM 0 HG2 GLU B 91 59.659 20.564 6.748 1.00 0.00 H new ATOM 0 HG3 GLU B 91 59.513 18.956 7.430 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 58.578 -1.639 13.542 1.00 0.00 CA HETATM 2900 CA CA B 102 86.980 2.272 -10.991 1.00 0.00 CA HETATM 2901 CA CA A 103 71.082 -6.314 15.240 1.00 0.00 CA HETATM 2902 CA CA B 104 87.993 2.615 2.204 1.00 0.00 CA