USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1071 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 NoAdj-H: A 19 HIS HE2 : A 19 HIS NE2 : A 93 ZNZN :(H bumps) USER MOD NoAdj-H: A 42 HIS HE2 : A 42 HIS NE2 : A 94 ZNZN :(H bumps) USER MOD NoAdj-H: A 67 HIS HE2 : A 67 HIS NE2 : A 95 ZNZN :(H bumps) USER MOD Set 1.1: B 745 SER OG : rot 180:sc= 0.421 USER MOD Set 1.2: B 748 ASN : amide:sc= 0.396 X(o=0.82,f=0.64) USER MOD Set 2.1: A 83 ASN : amide:sc= 1.04 K(o=3.4,f=-4.4) USER MOD Set 2.2: A 87 LYS NZ :NH3+ -173:sc= 2.35 (180deg=1.13) USER MOD Set 3.1: A 41 GLN : amide:sc= 0.898 K(o=2,f=-3.3) USER MOD Set 3.2: A 44 LYS NZ :NH3+ -152:sc= 1.14 (180deg=0) USER MOD Set 4.1: A 16 SER OG : rot 76:sc= 1.04 USER MOD Set 4.2: A 32 SER OG : rot 168:sc= 0.547 USER MOD Single : A 1 SER N :NH3+ -97:sc= -0.194 (180deg=-1.69!) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00533 USER MOD Single : A 3 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.58) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 88:sc= 1.27 USER MOD Single : A 11 GLN : amide:sc= 0.682 K(o=0.68,f=0) USER MOD Single : A 13 CYS SG : rot 180:sc= 0.00143 USER MOD Single : A 15 GLN : amide:sc= 1.23 K(o=1.2,f=-6.9!) USER MOD Single : A 21 CYS SG : rot 80:sc= -0.249 USER MOD Single : A 22 GLN : amide:sc= 0.939 K(o=0.94,f=0) USER MOD Single : A 25 ASN : amide:sc= 1.35 K(o=1.4,f=-0.046) USER MOD Single : A 27 ASN : amide:sc= 0.973 K(o=0.97,f=-7.2!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.17 K(o=1.2,f=-0.34) USER MOD Single : A 35 LYS NZ :NH3+ 143:sc= 0.632 (180deg=0.0189) USER MOD Single : A 36 MET CE :methyl 172:sc= -0.219 (180deg=-0.278) USER MOD Single : A 37 LYS NZ :NH3+ 161:sc= 2.78 (180deg=2.21) USER MOD Single : A 43 THR OG1 : rot -83:sc= 1.32 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 153:sc= 0.046 (180deg=-2.79!) USER MOD Single : A 50 THR OG1 : rot 163:sc= 0.443 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.849 K(o=0.85,f=-1.2) USER MOD Single : A 64 CYS SG : rot 79:sc= 0.281 USER MOD Single : A 65 CYS SG : rot 158:sc= 0.386 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HE2:sc= 0.663 K(o=0.66,f=-2.2!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 178:sc= 1.19 (180deg=1.19) USER MOD Single : A 85 LYS NZ :NH3+ 176:sc= 2.95 (180deg=2.46) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 GLN : amide:sc= -0.0525 X(o=-0.052,f=-0.052) USER MOD Single : A 91 GLN : amide:sc= 0.743 K(o=0.74,f=-1.1) USER MOD Single : A 92 GLN : amide:sc= 0.168 K(o=0.17,f=-3!) USER MOD Single : B 707 SER OG : rot 180:sc= 0 USER MOD Single : B 708 HIS : no HE2:sc= 0.487 K(o=0.49,f=-1.6!) USER MOD Single : B 709 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 710 SER OG : rot 180:sc= 0 USER MOD Single : B 713 HIS : no HE2:sc= 0.247 K(o=0.25,f=-1.5) USER MOD Single : B 715 SER OG : rot 180:sc= 0 USER MOD Single : B 718 GLN : amide:sc= 1.51 K(o=1.5,f=-0.017) USER MOD Single : B 719 THR OG1 : rot 180:sc= 0.00601 USER MOD Single : B 720 THR OG1 : rot -150:sc= 0.785 USER MOD Single : B 722 ASN : amide:sc= 0.00682 X(o=0.0068,f=0) USER MOD Single : B 726 MET CE :methyl 175:sc=-0.00174 (180deg=-0.0409) USER MOD Single : B 727 SER OG : rot 180:sc= 0 USER MOD Single : B 735 SER OG : rot 180:sc= 0 USER MOD Single : B 740 SER OG : rot 180:sc= 0 USER MOD Single : B 746 MET CE :methyl 137:sc= -2 (180deg=-4.57!) USER MOD Single : B 747 MET CE :methyl -170:sc= -1.32 (180deg=-2.02) USER MOD Single : B 749 THR OG1 : rot 180:sc= 0.00131 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 50.293 -11.601 33.815 1.00 0.00 N ATOM 2 CA SER A 1 50.033 -12.182 32.492 1.00 0.00 C ATOM 3 C SER A 1 49.642 -11.122 31.435 1.00 0.00 C ATOM 4 O SER A 1 48.532 -11.183 30.899 1.00 0.00 O ATOM 5 CB SER A 1 48.966 -13.287 32.612 1.00 0.00 C ATOM 6 OG SER A 1 49.381 -14.294 33.526 1.00 0.00 O ATOM 0 H1 SER A 1 51.316 -11.460 33.937 1.00 0.00 H new ATOM 0 H2 SER A 1 49.805 -10.686 33.894 1.00 0.00 H new ATOM 0 H3 SER A 1 49.942 -12.245 34.552 1.00 0.00 H new ATOM 0 HA SER A 1 50.963 -12.622 32.134 1.00 0.00 H new ATOM 0 HB2 SER A 1 48.023 -12.853 32.945 1.00 0.00 H new ATOM 0 HB3 SER A 1 48.784 -13.731 31.633 1.00 0.00 H new ATOM 0 HG SER A 1 48.688 -14.985 33.588 1.00 0.00 H new ATOM 12 N PRO A 2 50.509 -10.131 31.122 1.00 0.00 N ATOM 13 CA PRO A 2 50.206 -9.046 30.179 1.00 0.00 C ATOM 14 C PRO A 2 50.088 -9.548 28.730 1.00 0.00 C ATOM 15 O PRO A 2 48.983 -9.754 28.225 1.00 0.00 O ATOM 16 CB PRO A 2 51.317 -8.007 30.398 1.00 0.00 C ATOM 17 CG PRO A 2 52.505 -8.838 30.890 1.00 0.00 C ATOM 18 CD PRO A 2 51.850 -9.974 31.670 1.00 0.00 C ATOM 0 HA PRO A 2 49.228 -8.600 30.360 1.00 0.00 H new ATOM 0 HB2 PRO A 2 51.555 -7.476 29.476 1.00 0.00 H new ATOM 0 HB3 PRO A 2 51.023 -7.256 31.132 1.00 0.00 H new ATOM 0 HG2 PRO A 2 53.102 -9.214 30.060 1.00 0.00 H new ATOM 0 HG3 PRO A 2 53.171 -8.250 31.521 1.00 0.00 H new ATOM 0 HD2 PRO A 2 52.422 -10.896 31.567 1.00 0.00 H new ATOM 0 HD3 PRO A 2 51.810 -9.741 32.734 1.00 0.00 H new ATOM 26 N GLN A 3 51.218 -9.801 28.064 1.00 0.00 N ATOM 27 CA GLN A 3 51.245 -10.373 26.711 1.00 0.00 C ATOM 28 C GLN A 3 50.791 -11.841 26.729 1.00 0.00 C ATOM 29 O GLN A 3 50.230 -12.325 25.748 1.00 0.00 O ATOM 30 CB GLN A 3 52.645 -10.249 26.087 1.00 0.00 C ATOM 31 CG GLN A 3 52.984 -8.832 25.588 1.00 0.00 C ATOM 32 CD GLN A 3 53.182 -7.798 26.698 1.00 0.00 C ATOM 33 OE1 GLN A 3 53.786 -8.053 27.731 1.00 0.00 O ATOM 34 NE2 GLN A 3 52.678 -6.593 26.537 1.00 0.00 N ATOM 0 H GLN A 3 52.145 -9.615 28.448 1.00 0.00 H new ATOM 0 HA GLN A 3 50.547 -9.806 26.095 1.00 0.00 H new ATOM 0 HB2 GLN A 3 53.389 -10.551 26.825 1.00 0.00 H new ATOM 0 HB3 GLN A 3 52.723 -10.946 25.252 1.00 0.00 H new ATOM 0 HG2 GLN A 3 53.892 -8.880 24.987 1.00 0.00 H new ATOM 0 HG3 GLN A 3 52.184 -8.491 24.930 1.00 0.00 H new ATOM 0 HE21 GLN A 3 52.171 -6.362 25.682 1.00 0.00 H new ATOM 0 HE22 GLN A 3 52.794 -5.890 27.267 1.00 0.00 H new ATOM 43 N GLU A 4 50.984 -12.551 27.849 1.00 0.00 N ATOM 44 CA GLU A 4 50.537 -13.944 28.005 1.00 0.00 C ATOM 45 C GLU A 4 49.025 -14.089 27.785 1.00 0.00 C ATOM 46 O GLU A 4 48.607 -15.006 27.081 1.00 0.00 O ATOM 47 CB GLU A 4 50.927 -14.481 29.390 1.00 0.00 C ATOM 48 CG GLU A 4 52.420 -14.812 29.468 1.00 0.00 C ATOM 49 CD GLU A 4 52.820 -15.282 30.879 1.00 0.00 C ATOM 50 OE1 GLU A 4 52.735 -16.500 31.167 1.00 0.00 O ATOM 51 OE2 GLU A 4 53.245 -14.436 31.703 1.00 0.00 O ATOM 0 H GLU A 4 51.454 -12.177 28.673 1.00 0.00 H new ATOM 0 HA GLU A 4 51.039 -14.534 27.239 1.00 0.00 H new ATOM 0 HB2 GLU A 4 50.678 -13.741 30.151 1.00 0.00 H new ATOM 0 HB3 GLU A 4 50.344 -15.375 29.611 1.00 0.00 H new ATOM 0 HG2 GLU A 4 52.660 -15.589 28.743 1.00 0.00 H new ATOM 0 HG3 GLU A 4 53.004 -13.932 29.197 1.00 0.00 H new ATOM 58 N SER A 5 48.203 -13.174 28.315 1.00 0.00 N ATOM 59 CA SER A 5 46.745 -13.204 28.115 1.00 0.00 C ATOM 60 C SER A 5 46.375 -13.203 26.624 1.00 0.00 C ATOM 61 O SER A 5 45.540 -14.003 26.192 1.00 0.00 O ATOM 62 CB SER A 5 46.095 -12.022 28.846 1.00 0.00 C ATOM 63 OG SER A 5 44.683 -12.059 28.714 1.00 0.00 O ATOM 0 H SER A 5 48.525 -12.396 28.891 1.00 0.00 H new ATOM 0 HA SER A 5 46.362 -14.134 28.536 1.00 0.00 H new ATOM 0 HB2 SER A 5 46.366 -12.048 29.901 1.00 0.00 H new ATOM 0 HB3 SER A 5 46.477 -11.085 28.442 1.00 0.00 H new ATOM 0 HG SER A 5 44.290 -11.297 29.189 1.00 0.00 H new ATOM 69 N ARG A 6 47.048 -12.373 25.810 1.00 0.00 N ATOM 70 CA ARG A 6 46.860 -12.320 24.348 1.00 0.00 C ATOM 71 C ARG A 6 47.264 -13.647 23.694 1.00 0.00 C ATOM 72 O ARG A 6 46.454 -14.278 23.018 1.00 0.00 O ATOM 73 CB ARG A 6 47.700 -11.180 23.736 1.00 0.00 C ATOM 74 CG ARG A 6 47.385 -9.750 24.211 1.00 0.00 C ATOM 75 CD ARG A 6 48.519 -8.858 23.685 1.00 0.00 C ATOM 76 NE ARG A 6 48.235 -7.416 23.723 1.00 0.00 N ATOM 77 CZ ARG A 6 48.792 -6.537 22.907 1.00 0.00 C ATOM 78 NH1 ARG A 6 49.787 -6.837 22.121 1.00 0.00 N ATOM 79 NH2 ARG A 6 48.348 -5.318 22.871 1.00 0.00 N ATOM 0 H ARG A 6 47.746 -11.712 26.151 1.00 0.00 H new ATOM 0 HA ARG A 6 45.802 -12.137 24.158 1.00 0.00 H new ATOM 0 HB2 ARG A 6 48.750 -11.383 23.945 1.00 0.00 H new ATOM 0 HB3 ARG A 6 47.578 -11.212 22.653 1.00 0.00 H new ATOM 0 HG2 ARG A 6 46.420 -9.417 23.828 1.00 0.00 H new ATOM 0 HG3 ARG A 6 47.329 -9.706 25.299 1.00 0.00 H new ATOM 0 HD2 ARG A 6 49.417 -9.053 24.271 1.00 0.00 H new ATOM 0 HD3 ARG A 6 48.740 -9.144 22.657 1.00 0.00 H new ATOM 0 HE ARG A 6 47.571 -7.074 24.418 1.00 0.00 H new ATOM 0 HH11 ARG A 6 50.168 -7.783 22.119 1.00 0.00 H new ATOM 0 HH12 ARG A 6 50.185 -6.126 21.508 1.00 0.00 H new ATOM 0 HH21 ARG A 6 47.571 -5.040 23.471 1.00 0.00 H new ATOM 0 HH22 ARG A 6 48.776 -4.638 22.243 1.00 0.00 H new ATOM 93 N ARG A 7 48.513 -14.081 23.922 1.00 0.00 N ATOM 94 CA ARG A 7 49.130 -15.308 23.368 1.00 0.00 C ATOM 95 C ARG A 7 48.302 -16.563 23.620 1.00 0.00 C ATOM 96 O ARG A 7 48.098 -17.371 22.714 1.00 0.00 O ATOM 97 CB ARG A 7 50.542 -15.474 23.949 1.00 0.00 C ATOM 98 CG ARG A 7 51.467 -14.358 23.453 1.00 0.00 C ATOM 99 CD ARG A 7 52.779 -14.333 24.225 1.00 0.00 C ATOM 100 NE ARG A 7 53.541 -13.132 23.841 1.00 0.00 N ATOM 101 CZ ARG A 7 54.780 -12.802 24.130 1.00 0.00 C ATOM 102 NH1 ARG A 7 55.574 -13.561 24.830 1.00 0.00 N ATOM 103 NH2 ARG A 7 55.213 -11.658 23.697 1.00 0.00 N ATOM 0 H ARG A 7 49.155 -13.566 24.525 1.00 0.00 H new ATOM 0 HA ARG A 7 49.178 -15.187 22.286 1.00 0.00 H new ATOM 0 HB2 ARG A 7 50.497 -15.458 25.038 1.00 0.00 H new ATOM 0 HB3 ARG A 7 50.947 -16.444 23.661 1.00 0.00 H new ATOM 0 HG2 ARG A 7 51.671 -14.499 22.392 1.00 0.00 H new ATOM 0 HG3 ARG A 7 50.965 -13.396 23.556 1.00 0.00 H new ATOM 0 HD2 ARG A 7 52.584 -14.328 25.297 1.00 0.00 H new ATOM 0 HD3 ARG A 7 53.359 -15.231 24.011 1.00 0.00 H new ATOM 0 HE ARG A 7 53.033 -12.459 23.267 1.00 0.00 H new ATOM 0 HH11 ARG A 7 55.242 -14.459 25.182 1.00 0.00 H new ATOM 0 HH12 ARG A 7 56.528 -13.257 25.026 1.00 0.00 H new ATOM 0 HH21 ARG A 7 54.598 -11.052 23.154 1.00 0.00 H new ATOM 0 HH22 ARG A 7 56.169 -11.365 23.900 1.00 0.00 H new ATOM 117 N LEU A 8 47.827 -16.713 24.854 1.00 0.00 N ATOM 118 CA LEU A 8 47.016 -17.844 25.308 1.00 0.00 C ATOM 119 C LEU A 8 45.569 -17.776 24.782 1.00 0.00 C ATOM 120 O LEU A 8 44.994 -18.817 24.461 1.00 0.00 O ATOM 121 CB LEU A 8 47.092 -17.909 26.848 1.00 0.00 C ATOM 122 CG LEU A 8 48.527 -18.140 27.383 1.00 0.00 C ATOM 123 CD1 LEU A 8 48.603 -17.870 28.886 1.00 0.00 C ATOM 124 CD2 LEU A 8 49.030 -19.559 27.118 1.00 0.00 C ATOM 0 H LEU A 8 48.001 -16.029 25.591 1.00 0.00 H new ATOM 0 HA LEU A 8 47.417 -18.769 24.894 1.00 0.00 H new ATOM 0 HB2 LEU A 8 46.702 -16.980 27.263 1.00 0.00 H new ATOM 0 HB3 LEU A 8 46.446 -18.712 27.203 1.00 0.00 H new ATOM 0 HG LEU A 8 49.164 -17.439 26.843 1.00 0.00 H new ATOM 0 HD11 LEU A 8 49.622 -18.040 29.235 1.00 0.00 H new ATOM 0 HD12 LEU A 8 48.319 -16.837 29.085 1.00 0.00 H new ATOM 0 HD13 LEU A 8 47.923 -18.541 29.411 1.00 0.00 H new ATOM 0 HD21 LEU A 8 50.040 -19.667 27.513 1.00 0.00 H new ATOM 0 HD22 LEU A 8 48.371 -20.276 27.607 1.00 0.00 H new ATOM 0 HD23 LEU A 8 49.038 -19.748 26.044 1.00 0.00 H new ATOM 136 N SER A 9 44.993 -16.577 24.624 1.00 0.00 N ATOM 137 CA SER A 9 43.648 -16.410 24.044 1.00 0.00 C ATOM 138 C SER A 9 43.619 -16.784 22.555 1.00 0.00 C ATOM 139 O SER A 9 42.672 -17.430 22.106 1.00 0.00 O ATOM 140 CB SER A 9 43.126 -14.980 24.214 1.00 0.00 C ATOM 141 OG SER A 9 42.966 -14.666 25.587 1.00 0.00 O ATOM 0 H SER A 9 45.440 -15.700 24.891 1.00 0.00 H new ATOM 0 HA SER A 9 42.996 -17.090 24.593 1.00 0.00 H new ATOM 0 HB2 SER A 9 43.820 -14.277 23.753 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.172 -14.872 23.697 1.00 0.00 H new ATOM 0 HG SER A 9 43.808 -14.310 25.941 1.00 0.00 H new ATOM 147 N ILE A 10 44.671 -16.451 21.793 1.00 0.00 N ATOM 148 CA ILE A 10 44.796 -16.802 20.364 1.00 0.00 C ATOM 149 C ILE A 10 44.714 -18.327 20.157 1.00 0.00 C ATOM 150 O ILE A 10 44.094 -18.785 19.196 1.00 0.00 O ATOM 151 CB ILE A 10 46.092 -16.197 19.774 1.00 0.00 C ATOM 152 CG1 ILE A 10 46.050 -14.652 19.791 1.00 0.00 C ATOM 153 CG2 ILE A 10 46.316 -16.637 18.316 1.00 0.00 C ATOM 154 CD1 ILE A 10 47.444 -14.017 19.827 1.00 0.00 C ATOM 0 H ILE A 10 45.468 -15.925 22.151 1.00 0.00 H new ATOM 0 HA ILE A 10 43.956 -16.369 19.821 1.00 0.00 H new ATOM 0 HB ILE A 10 46.905 -16.562 20.401 1.00 0.00 H new ATOM 0 HG12 ILE A 10 45.518 -14.298 18.908 1.00 0.00 H new ATOM 0 HG13 ILE A 10 45.482 -14.319 20.660 1.00 0.00 H new ATOM 0 HG21 ILE A 10 47.236 -16.191 17.939 1.00 0.00 H new ATOM 0 HG22 ILE A 10 46.395 -17.723 18.272 1.00 0.00 H new ATOM 0 HG23 ILE A 10 45.476 -16.309 17.704 1.00 0.00 H new ATOM 0 HD11 ILE A 10 47.349 -12.931 19.838 1.00 0.00 H new ATOM 0 HD12 ILE A 10 47.970 -14.344 20.724 1.00 0.00 H new ATOM 0 HD13 ILE A 10 48.006 -14.323 18.945 1.00 0.00 H new ATOM 166 N GLN A 11 45.271 -19.130 21.076 1.00 0.00 N ATOM 167 CA GLN A 11 45.185 -20.602 21.021 1.00 0.00 C ATOM 168 C GLN A 11 43.729 -21.109 20.978 1.00 0.00 C ATOM 169 O GLN A 11 43.432 -22.080 20.279 1.00 0.00 O ATOM 170 CB GLN A 11 45.897 -21.264 22.217 1.00 0.00 C ATOM 171 CG GLN A 11 47.305 -20.742 22.533 1.00 0.00 C ATOM 172 CD GLN A 11 48.263 -20.766 21.347 1.00 0.00 C ATOM 173 OE1 GLN A 11 48.427 -21.761 20.652 1.00 0.00 O ATOM 174 NE2 GLN A 11 48.926 -19.667 21.066 1.00 0.00 N ATOM 0 H GLN A 11 45.794 -18.780 21.879 1.00 0.00 H new ATOM 0 HA GLN A 11 45.685 -20.884 20.094 1.00 0.00 H new ATOM 0 HB2 GLN A 11 45.275 -21.133 23.103 1.00 0.00 H new ATOM 0 HB3 GLN A 11 45.962 -22.336 22.028 1.00 0.00 H new ATOM 0 HG2 GLN A 11 47.227 -19.719 22.901 1.00 0.00 H new ATOM 0 HG3 GLN A 11 47.729 -21.340 23.340 1.00 0.00 H new ATOM 0 HE21 GLN A 11 48.797 -18.833 21.639 1.00 0.00 H new ATOM 0 HE22 GLN A 11 49.570 -19.648 20.275 1.00 0.00 H new ATOM 183 N ARG A 12 42.806 -20.437 21.688 1.00 0.00 N ATOM 184 CA ARG A 12 41.368 -20.773 21.698 1.00 0.00 C ATOM 185 C ARG A 12 40.766 -20.586 20.304 1.00 0.00 C ATOM 186 O ARG A 12 40.034 -21.449 19.817 1.00 0.00 O ATOM 187 CB ARG A 12 40.596 -19.916 22.725 1.00 0.00 C ATOM 188 CG ARG A 12 41.177 -19.799 24.149 1.00 0.00 C ATOM 189 CD ARG A 12 41.247 -21.109 24.946 1.00 0.00 C ATOM 190 NE ARG A 12 42.469 -21.883 24.647 1.00 0.00 N ATOM 191 CZ ARG A 12 42.547 -23.092 24.121 1.00 0.00 C ATOM 192 NH1 ARG A 12 41.501 -23.787 23.784 1.00 0.00 N ATOM 193 NH2 ARG A 12 43.697 -23.656 23.904 1.00 0.00 N ATOM 0 H ARG A 12 43.038 -19.637 22.277 1.00 0.00 H new ATOM 0 HA ARG A 12 41.275 -21.819 21.990 1.00 0.00 H new ATOM 0 HB2 ARG A 12 40.503 -18.909 22.318 1.00 0.00 H new ATOM 0 HB3 ARG A 12 39.587 -20.321 22.808 1.00 0.00 H new ATOM 0 HG2 ARG A 12 42.182 -19.383 24.079 1.00 0.00 H new ATOM 0 HG3 ARG A 12 40.575 -19.085 24.710 1.00 0.00 H new ATOM 0 HD2 ARG A 12 41.213 -20.885 26.012 1.00 0.00 H new ATOM 0 HD3 ARG A 12 40.371 -21.716 24.720 1.00 0.00 H new ATOM 0 HE ARG A 12 43.355 -21.432 24.873 1.00 0.00 H new ATOM 0 HH11 ARG A 12 40.567 -23.402 23.923 1.00 0.00 H new ATOM 0 HH12 ARG A 12 41.615 -24.717 23.381 1.00 0.00 H new ATOM 0 HH21 ARG A 12 44.559 -23.164 24.141 1.00 0.00 H new ATOM 0 HH22 ARG A 12 43.738 -24.590 23.497 1.00 0.00 H new ATOM 207 N CYS A 13 41.120 -19.485 19.639 1.00 0.00 N ATOM 208 CA CYS A 13 40.693 -19.183 18.274 1.00 0.00 C ATOM 209 C CYS A 13 41.289 -20.186 17.272 1.00 0.00 C ATOM 210 O CYS A 13 40.584 -20.636 16.372 1.00 0.00 O ATOM 211 CB CYS A 13 41.070 -17.739 17.922 1.00 0.00 C ATOM 212 SG CYS A 13 40.275 -16.592 19.086 1.00 0.00 S ATOM 0 H CYS A 13 41.722 -18.767 20.042 1.00 0.00 H new ATOM 0 HA CYS A 13 39.609 -19.280 18.212 1.00 0.00 H new ATOM 0 HB2 CYS A 13 42.152 -17.617 17.960 1.00 0.00 H new ATOM 0 HB3 CYS A 13 40.759 -17.511 16.903 1.00 0.00 H new ATOM 0 HG CYS A 13 40.601 -15.371 18.783 1.00 0.00 H new ATOM 218 N ILE A 14 42.556 -20.585 17.437 1.00 0.00 N ATOM 219 CA ILE A 14 43.203 -21.596 16.585 1.00 0.00 C ATOM 220 C ILE A 14 42.440 -22.923 16.669 1.00 0.00 C ATOM 221 O ILE A 14 42.058 -23.469 15.635 1.00 0.00 O ATOM 222 CB ILE A 14 44.698 -21.732 16.954 1.00 0.00 C ATOM 223 CG1 ILE A 14 45.421 -20.460 16.471 1.00 0.00 C ATOM 224 CG2 ILE A 14 45.354 -22.976 16.326 1.00 0.00 C ATOM 225 CD1 ILE A 14 46.789 -20.212 17.094 1.00 0.00 C ATOM 0 H ILE A 14 43.165 -20.216 18.167 1.00 0.00 H new ATOM 0 HA ILE A 14 43.167 -21.277 15.543 1.00 0.00 H new ATOM 0 HB ILE A 14 44.779 -21.851 18.034 1.00 0.00 H new ATOM 0 HG12 ILE A 14 45.538 -20.517 15.389 1.00 0.00 H new ATOM 0 HG13 ILE A 14 44.785 -19.600 16.678 1.00 0.00 H new ATOM 0 HG21 ILE A 14 46.403 -23.021 16.619 1.00 0.00 H new ATOM 0 HG22 ILE A 14 44.841 -23.873 16.674 1.00 0.00 H new ATOM 0 HG23 ILE A 14 45.282 -22.916 15.240 1.00 0.00 H new ATOM 0 HD11 ILE A 14 47.213 -19.294 16.688 1.00 0.00 H new ATOM 0 HD12 ILE A 14 46.685 -20.116 18.175 1.00 0.00 H new ATOM 0 HD13 ILE A 14 47.450 -21.048 16.866 1.00 0.00 H new ATOM 237 N GLN A 15 42.145 -23.418 17.880 1.00 0.00 N ATOM 238 CA GLN A 15 41.347 -24.640 18.048 1.00 0.00 C ATOM 239 C GLN A 15 39.932 -24.491 17.460 1.00 0.00 C ATOM 240 O GLN A 15 39.430 -25.426 16.835 1.00 0.00 O ATOM 241 CB GLN A 15 41.288 -25.060 19.522 1.00 0.00 C ATOM 242 CG GLN A 15 42.635 -25.632 19.995 1.00 0.00 C ATOM 243 CD GLN A 15 42.494 -26.394 21.307 1.00 0.00 C ATOM 244 OE1 GLN A 15 42.778 -25.895 22.389 1.00 0.00 O ATOM 245 NE2 GLN A 15 42.031 -27.625 21.271 1.00 0.00 N ATOM 0 H GLN A 15 42.447 -22.991 18.756 1.00 0.00 H new ATOM 0 HA GLN A 15 41.847 -25.430 17.487 1.00 0.00 H new ATOM 0 HB2 GLN A 15 41.020 -24.201 20.137 1.00 0.00 H new ATOM 0 HB3 GLN A 15 40.506 -25.806 19.659 1.00 0.00 H new ATOM 0 HG2 GLN A 15 43.037 -26.296 19.230 1.00 0.00 H new ATOM 0 HG3 GLN A 15 43.351 -24.820 20.121 1.00 0.00 H new ATOM 0 HE21 GLN A 15 41.790 -28.053 20.377 1.00 0.00 H new ATOM 0 HE22 GLN A 15 41.913 -28.151 22.137 1.00 0.00 H new ATOM 254 N SER A 16 39.303 -23.321 17.607 1.00 0.00 N ATOM 255 CA SER A 16 37.979 -23.033 17.029 1.00 0.00 C ATOM 256 C SER A 16 37.989 -23.092 15.495 1.00 0.00 C ATOM 257 O SER A 16 37.095 -23.693 14.898 1.00 0.00 O ATOM 258 CB SER A 16 37.472 -21.659 17.471 1.00 0.00 C ATOM 259 OG SER A 16 37.242 -21.618 18.868 1.00 0.00 O ATOM 0 H SER A 16 39.697 -22.540 18.132 1.00 0.00 H new ATOM 0 HA SER A 16 37.309 -23.808 17.400 1.00 0.00 H new ATOM 0 HB2 SER A 16 38.201 -20.896 17.198 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.549 -21.422 16.942 1.00 0.00 H new ATOM 0 HG SER A 16 38.099 -21.561 19.339 1.00 0.00 H new ATOM 265 N LEU A 17 39.004 -22.512 14.837 1.00 0.00 N ATOM 266 CA LEU A 17 39.143 -22.565 13.377 1.00 0.00 C ATOM 267 C LEU A 17 39.448 -24.003 12.924 1.00 0.00 C ATOM 268 O LEU A 17 38.819 -24.494 11.992 1.00 0.00 O ATOM 269 CB LEU A 17 40.210 -21.555 12.913 1.00 0.00 C ATOM 270 CG LEU A 17 40.396 -21.472 11.381 1.00 0.00 C ATOM 271 CD1 LEU A 17 39.116 -21.145 10.601 1.00 0.00 C ATOM 272 CD2 LEU A 17 41.425 -20.391 11.050 1.00 0.00 C ATOM 0 H LEU A 17 39.749 -21.994 15.303 1.00 0.00 H new ATOM 0 HA LEU A 17 38.203 -22.278 12.906 1.00 0.00 H new ATOM 0 HB2 LEU A 17 39.943 -20.567 13.287 1.00 0.00 H new ATOM 0 HB3 LEU A 17 41.164 -21.820 13.368 1.00 0.00 H new ATOM 0 HG LEU A 17 40.719 -22.467 11.075 1.00 0.00 H new ATOM 0 HD11 LEU A 17 39.339 -21.107 9.535 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.369 -21.917 10.788 1.00 0.00 H new ATOM 0 HD13 LEU A 17 38.729 -20.179 10.926 1.00 0.00 H new ATOM 0 HD21 LEU A 17 41.556 -20.332 9.970 1.00 0.00 H new ATOM 0 HD22 LEU A 17 41.076 -19.429 11.426 1.00 0.00 H new ATOM 0 HD23 LEU A 17 42.377 -20.640 11.518 1.00 0.00 H new ATOM 284 N VAL A 18 40.350 -24.710 13.617 1.00 0.00 N ATOM 285 CA VAL A 18 40.669 -26.126 13.347 1.00 0.00 C ATOM 286 C VAL A 18 39.407 -26.996 13.433 1.00 0.00 C ATOM 287 O VAL A 18 39.176 -27.821 12.547 1.00 0.00 O ATOM 288 CB VAL A 18 41.781 -26.617 14.296 1.00 0.00 C ATOM 289 CG1 VAL A 18 41.903 -28.143 14.320 1.00 0.00 C ATOM 290 CG2 VAL A 18 43.142 -26.050 13.874 1.00 0.00 C ATOM 0 H VAL A 18 40.886 -24.315 14.389 1.00 0.00 H new ATOM 0 HA VAL A 18 41.047 -26.214 12.328 1.00 0.00 H new ATOM 0 HB VAL A 18 41.502 -26.267 15.290 1.00 0.00 H new ATOM 0 HG11 VAL A 18 42.700 -28.434 15.004 1.00 0.00 H new ATOM 0 HG12 VAL A 18 40.961 -28.578 14.655 1.00 0.00 H new ATOM 0 HG13 VAL A 18 42.134 -28.505 13.318 1.00 0.00 H new ATOM 0 HG21 VAL A 18 43.913 -26.408 14.556 1.00 0.00 H new ATOM 0 HG22 VAL A 18 43.374 -26.377 12.860 1.00 0.00 H new ATOM 0 HG23 VAL A 18 43.108 -24.961 13.905 1.00 0.00 H new ATOM 300 N HIS A 19 38.564 -26.799 14.456 1.00 0.00 N ATOM 301 CA HIS A 19 37.272 -27.485 14.588 1.00 0.00 C ATOM 302 C HIS A 19 36.391 -27.171 13.368 1.00 0.00 C ATOM 303 O HIS A 19 35.948 -28.089 12.681 1.00 0.00 O ATOM 304 CB HIS A 19 36.578 -27.071 15.903 1.00 0.00 C ATOM 305 CG HIS A 19 35.162 -27.593 16.058 1.00 0.00 C ATOM 306 ND1 HIS A 19 34.740 -28.610 16.888 1.00 0.00 N ATOM 307 CD2 HIS A 19 34.045 -27.137 15.402 1.00 0.00 C ATOM 308 CE1 HIS A 19 33.412 -28.767 16.717 1.00 0.00 C ATOM 309 NE2 HIS A 19 32.938 -27.897 15.805 1.00 0.00 N ATOM 0 H HIS A 19 38.762 -26.154 15.221 1.00 0.00 H new ATOM 0 HA HIS A 19 37.436 -28.562 14.624 1.00 0.00 H new ATOM 0 HB2 HIS A 19 37.176 -27.426 16.742 1.00 0.00 H new ATOM 0 HB3 HIS A 19 36.559 -25.983 15.962 1.00 0.00 H new ATOM 0 HD1 HIS A 19 35.330 -29.150 17.521 1.00 0.00 H new ATOM 0 HD2 HIS A 19 34.023 -26.325 14.691 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.809 -29.493 17.241 1.00 0.00 H new ATOM 317 N ALA A 20 36.173 -25.887 13.061 1.00 0.00 N ATOM 318 CA ALA A 20 35.359 -25.444 11.928 1.00 0.00 C ATOM 319 C ALA A 20 35.814 -26.014 10.570 1.00 0.00 C ATOM 320 O ALA A 20 34.975 -26.315 9.720 1.00 0.00 O ATOM 321 CB ALA A 20 35.358 -23.914 11.917 1.00 0.00 C ATOM 0 H ALA A 20 36.564 -25.116 13.602 1.00 0.00 H new ATOM 0 HA ALA A 20 34.350 -25.833 12.063 1.00 0.00 H new ATOM 0 HB1 ALA A 20 34.757 -23.557 11.081 1.00 0.00 H new ATOM 0 HB2 ALA A 20 34.936 -23.544 12.851 1.00 0.00 H new ATOM 0 HB3 ALA A 20 36.380 -23.550 11.811 1.00 0.00 H new ATOM 327 N CYS A 21 37.125 -26.203 10.370 1.00 0.00 N ATOM 328 CA CYS A 21 37.704 -26.789 9.157 1.00 0.00 C ATOM 329 C CYS A 21 37.401 -28.297 8.995 1.00 0.00 C ATOM 330 O CYS A 21 37.613 -28.851 7.915 1.00 0.00 O ATOM 331 CB CYS A 21 39.215 -26.514 9.154 1.00 0.00 C ATOM 332 SG CYS A 21 39.511 -24.746 8.848 1.00 0.00 S ATOM 0 H CYS A 21 37.827 -25.946 11.064 1.00 0.00 H new ATOM 0 HA CYS A 21 37.234 -26.315 8.295 1.00 0.00 H new ATOM 0 HB2 CYS A 21 39.650 -26.806 10.110 1.00 0.00 H new ATOM 0 HB3 CYS A 21 39.703 -27.113 8.385 1.00 0.00 H new ATOM 0 HG CYS A 21 39.339 -24.080 9.951 1.00 0.00 H new ATOM 338 N GLN A 22 36.895 -28.958 10.043 1.00 0.00 N ATOM 339 CA GLN A 22 36.514 -30.381 10.062 1.00 0.00 C ATOM 340 C GLN A 22 34.999 -30.582 10.272 1.00 0.00 C ATOM 341 O GLN A 22 34.454 -31.617 9.875 1.00 0.00 O ATOM 342 CB GLN A 22 37.279 -31.088 11.190 1.00 0.00 C ATOM 343 CG GLN A 22 38.801 -31.091 10.982 1.00 0.00 C ATOM 344 CD GLN A 22 39.519 -31.510 12.258 1.00 0.00 C ATOM 345 OE1 GLN A 22 39.840 -32.670 12.484 1.00 0.00 O ATOM 346 NE2 GLN A 22 39.790 -30.573 13.140 1.00 0.00 N ATOM 0 H GLN A 22 36.732 -28.500 10.940 1.00 0.00 H new ATOM 0 HA GLN A 22 36.769 -30.806 9.091 1.00 0.00 H new ATOM 0 HB2 GLN A 22 37.050 -30.600 12.137 1.00 0.00 H new ATOM 0 HB3 GLN A 22 36.928 -32.117 11.269 1.00 0.00 H new ATOM 0 HG2 GLN A 22 39.061 -31.773 10.172 1.00 0.00 H new ATOM 0 HG3 GLN A 22 39.134 -30.098 10.681 1.00 0.00 H new ATOM 0 HE21 GLN A 22 39.524 -29.606 12.955 1.00 0.00 H new ATOM 0 HE22 GLN A 22 40.266 -30.813 14.009 1.00 0.00 H new ATOM 355 N CYS A 23 34.327 -29.611 10.898 1.00 0.00 N ATOM 356 CA CYS A 23 32.900 -29.612 11.201 1.00 0.00 C ATOM 357 C CYS A 23 32.009 -29.605 9.937 1.00 0.00 C ATOM 358 O CYS A 23 32.449 -29.286 8.825 1.00 0.00 O ATOM 359 CB CYS A 23 32.636 -28.444 12.164 1.00 0.00 C ATOM 360 SG CYS A 23 31.006 -28.592 12.953 1.00 0.00 S ATOM 0 H CYS A 23 34.791 -28.762 11.222 1.00 0.00 H new ATOM 0 HA CYS A 23 32.619 -30.546 11.687 1.00 0.00 H new ATOM 0 HB2 CYS A 23 33.412 -28.419 12.929 1.00 0.00 H new ATOM 0 HB3 CYS A 23 32.694 -27.501 11.620 1.00 0.00 H new ATOM 365 N ARG A 24 30.736 -29.965 10.131 1.00 0.00 N ATOM 366 CA ARG A 24 29.696 -30.094 9.091 1.00 0.00 C ATOM 367 C ARG A 24 28.373 -29.399 9.433 1.00 0.00 C ATOM 368 O ARG A 24 27.551 -29.186 8.540 1.00 0.00 O ATOM 369 CB ARG A 24 29.443 -31.584 8.815 1.00 0.00 C ATOM 370 CG ARG A 24 30.683 -32.304 8.260 1.00 0.00 C ATOM 371 CD ARG A 24 30.327 -33.729 7.829 1.00 0.00 C ATOM 372 NE ARG A 24 31.511 -34.451 7.322 1.00 0.00 N ATOM 373 CZ ARG A 24 31.540 -35.683 6.844 1.00 0.00 C ATOM 374 NH1 ARG A 24 30.469 -36.423 6.767 1.00 0.00 N ATOM 375 NH2 ARG A 24 32.659 -36.201 6.426 1.00 0.00 N ATOM 0 H ARG A 24 30.380 -30.186 11.061 1.00 0.00 H new ATOM 0 HA ARG A 24 30.079 -29.586 8.206 1.00 0.00 H new ATOM 0 HB2 ARG A 24 29.127 -32.072 9.737 1.00 0.00 H new ATOM 0 HB3 ARG A 24 28.622 -31.683 8.105 1.00 0.00 H new ATOM 0 HG2 ARG A 24 31.083 -31.750 7.411 1.00 0.00 H new ATOM 0 HG3 ARG A 24 31.465 -32.332 9.019 1.00 0.00 H new ATOM 0 HD2 ARG A 24 29.903 -34.271 8.674 1.00 0.00 H new ATOM 0 HD3 ARG A 24 29.560 -33.696 7.055 1.00 0.00 H new ATOM 0 HE ARG A 24 32.398 -33.947 7.343 1.00 0.00 H new ATOM 0 HH11 ARG A 24 29.571 -36.055 7.081 1.00 0.00 H new ATOM 0 HH12 ARG A 24 30.529 -37.370 6.392 1.00 0.00 H new ATOM 0 HH21 ARG A 24 33.520 -35.656 6.466 1.00 0.00 H new ATOM 0 HH22 ARG A 24 32.675 -37.152 6.058 1.00 0.00 H new ATOM 389 N ASN A 25 28.160 -29.032 10.698 1.00 0.00 N ATOM 390 CA ASN A 25 26.953 -28.336 11.156 1.00 0.00 C ATOM 391 C ASN A 25 26.857 -26.937 10.519 1.00 0.00 C ATOM 392 O ASN A 25 27.807 -26.156 10.616 1.00 0.00 O ATOM 393 CB ASN A 25 27.001 -28.205 12.688 1.00 0.00 C ATOM 394 CG ASN A 25 27.037 -29.524 13.439 1.00 0.00 C ATOM 395 OD1 ASN A 25 26.339 -30.477 13.116 1.00 0.00 O ATOM 396 ND2 ASN A 25 27.845 -29.618 14.467 1.00 0.00 N ATOM 0 H ASN A 25 28.830 -29.212 11.445 1.00 0.00 H new ATOM 0 HA ASN A 25 26.076 -28.911 10.857 1.00 0.00 H new ATOM 0 HB2 ASN A 25 27.881 -27.623 12.961 1.00 0.00 H new ATOM 0 HB3 ASN A 25 26.130 -27.639 13.018 1.00 0.00 H new ATOM 0 HD21 ASN A 25 27.893 -30.486 15.000 1.00 0.00 H new ATOM 0 HD22 ASN A 25 28.425 -28.823 14.734 1.00 0.00 H new ATOM 403 N ALA A 26 25.722 -26.595 9.899 1.00 0.00 N ATOM 404 CA ALA A 26 25.505 -25.277 9.284 1.00 0.00 C ATOM 405 C ALA A 26 25.670 -24.117 10.284 1.00 0.00 C ATOM 406 O ALA A 26 26.235 -23.071 9.960 1.00 0.00 O ATOM 407 CB ALA A 26 24.107 -25.265 8.655 1.00 0.00 C ATOM 0 H ALA A 26 24.925 -27.225 9.808 1.00 0.00 H new ATOM 0 HA ALA A 26 26.268 -25.120 8.521 1.00 0.00 H new ATOM 0 HB1 ALA A 26 23.925 -24.295 8.192 1.00 0.00 H new ATOM 0 HB2 ALA A 26 24.042 -26.046 7.898 1.00 0.00 H new ATOM 0 HB3 ALA A 26 23.359 -25.445 9.427 1.00 0.00 H new ATOM 413 N ASN A 27 25.195 -24.335 11.513 1.00 0.00 N ATOM 414 CA ASN A 27 25.253 -23.414 12.645 1.00 0.00 C ATOM 415 C ASN A 27 25.475 -24.221 13.944 1.00 0.00 C ATOM 416 O ASN A 27 24.563 -24.401 14.754 1.00 0.00 O ATOM 417 CB ASN A 27 23.993 -22.527 12.671 1.00 0.00 C ATOM 418 CG ASN A 27 23.919 -21.586 11.478 1.00 0.00 C ATOM 419 OD1 ASN A 27 24.595 -20.565 11.417 1.00 0.00 O ATOM 420 ND2 ASN A 27 23.115 -21.900 10.487 1.00 0.00 N ATOM 0 H ASN A 27 24.733 -25.211 11.756 1.00 0.00 H new ATOM 0 HA ASN A 27 26.097 -22.731 12.548 1.00 0.00 H new ATOM 0 HB2 ASN A 27 23.106 -23.161 12.685 1.00 0.00 H new ATOM 0 HB3 ASN A 27 23.982 -21.943 13.591 1.00 0.00 H new ATOM 0 HD21 ASN A 27 23.054 -21.295 9.668 1.00 0.00 H new ATOM 0 HD22 ASN A 27 22.552 -22.749 10.536 1.00 0.00 H new ATOM 427 N CYS A 28 26.694 -24.756 14.075 1.00 0.00 N ATOM 428 CA CYS A 28 27.188 -25.591 15.178 1.00 0.00 C ATOM 429 C CYS A 28 26.904 -25.021 16.588 1.00 0.00 C ATOM 430 O CYS A 28 26.687 -23.818 16.763 1.00 0.00 O ATOM 431 CB CYS A 28 28.695 -25.773 14.933 1.00 0.00 C ATOM 432 SG CYS A 28 29.392 -27.211 15.797 1.00 0.00 S ATOM 0 H CYS A 28 27.411 -24.607 13.365 1.00 0.00 H new ATOM 0 HA CYS A 28 26.654 -26.541 15.177 1.00 0.00 H new ATOM 0 HB2 CYS A 28 28.872 -25.879 13.863 1.00 0.00 H new ATOM 0 HB3 CYS A 28 29.220 -24.874 15.255 1.00 0.00 H new ATOM 437 N SER A 29 26.927 -25.875 17.615 1.00 0.00 N ATOM 438 CA SER A 29 26.690 -25.477 19.013 1.00 0.00 C ATOM 439 C SER A 29 27.754 -24.522 19.580 1.00 0.00 C ATOM 440 O SER A 29 27.463 -23.785 20.528 1.00 0.00 O ATOM 441 CB SER A 29 26.542 -26.709 19.915 1.00 0.00 C ATOM 442 OG SER A 29 27.722 -27.498 19.919 1.00 0.00 O ATOM 0 H SER A 29 27.112 -26.872 17.503 1.00 0.00 H new ATOM 0 HA SER A 29 25.755 -24.917 19.004 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.313 -26.391 20.932 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.701 -27.312 19.573 1.00 0.00 H new ATOM 0 HG SER A 29 27.595 -28.274 20.504 1.00 0.00 H new ATOM 448 N LEU A 30 28.959 -24.479 18.997 1.00 0.00 N ATOM 449 CA LEU A 30 30.017 -23.544 19.393 1.00 0.00 C ATOM 450 C LEU A 30 29.765 -22.155 18.766 1.00 0.00 C ATOM 451 O LEU A 30 29.537 -22.064 17.556 1.00 0.00 O ATOM 452 CB LEU A 30 31.395 -24.077 18.959 1.00 0.00 C ATOM 453 CG LEU A 30 31.993 -25.159 19.876 1.00 0.00 C ATOM 454 CD1 LEU A 30 33.311 -25.655 19.280 1.00 0.00 C ATOM 455 CD2 LEU A 30 32.290 -24.627 21.285 1.00 0.00 C ATOM 0 H LEU A 30 29.228 -25.097 18.232 1.00 0.00 H new ATOM 0 HA LEU A 30 30.005 -23.448 20.479 1.00 0.00 H new ATOM 0 HB2 LEU A 30 31.310 -24.483 17.951 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.092 -23.240 18.908 1.00 0.00 H new ATOM 0 HG LEU A 30 31.257 -25.959 19.951 1.00 0.00 H new ATOM 0 HD11 LEU A 30 33.737 -26.422 19.927 1.00 0.00 H new ATOM 0 HD12 LEU A 30 33.128 -26.076 18.291 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.009 -24.822 19.196 1.00 0.00 H new ATOM 0 HD21 LEU A 30 32.710 -25.427 21.895 1.00 0.00 H new ATOM 0 HD22 LEU A 30 33.004 -23.806 21.221 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.367 -24.270 21.741 1.00 0.00 H new ATOM 467 N PRO A 31 29.832 -21.060 19.549 1.00 0.00 N ATOM 468 CA PRO A 31 29.611 -19.704 19.041 1.00 0.00 C ATOM 469 C PRO A 31 30.678 -19.273 18.022 1.00 0.00 C ATOM 470 O PRO A 31 30.378 -18.532 17.084 1.00 0.00 O ATOM 471 CB PRO A 31 29.597 -18.803 20.281 1.00 0.00 C ATOM 472 CG PRO A 31 30.428 -19.576 21.306 1.00 0.00 C ATOM 473 CD PRO A 31 30.119 -21.030 20.977 1.00 0.00 C ATOM 0 HA PRO A 31 28.674 -19.639 18.488 1.00 0.00 H new ATOM 0 HB2 PRO A 31 30.031 -17.826 20.070 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.582 -18.630 20.638 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.492 -19.358 21.209 1.00 0.00 H new ATOM 0 HG3 PRO A 31 30.143 -19.325 22.328 1.00 0.00 H new ATOM 0 HD2 PRO A 31 30.964 -21.674 21.220 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.268 -21.390 21.555 1.00 0.00 H new ATOM 481 N SER A 32 31.919 -19.748 18.179 1.00 0.00 N ATOM 482 CA SER A 32 33.028 -19.456 17.266 1.00 0.00 C ATOM 483 C SER A 32 32.929 -20.242 15.955 1.00 0.00 C ATOM 484 O SER A 32 33.092 -19.639 14.902 1.00 0.00 O ATOM 485 CB SER A 32 34.364 -19.724 17.959 1.00 0.00 C ATOM 486 OG SER A 32 34.372 -21.024 18.532 1.00 0.00 O ATOM 0 H SER A 32 32.184 -20.355 18.955 1.00 0.00 H new ATOM 0 HA SER A 32 32.965 -18.400 17.004 1.00 0.00 H new ATOM 0 HB2 SER A 32 35.179 -19.631 17.241 1.00 0.00 H new ATOM 0 HB3 SER A 32 34.535 -18.977 18.734 1.00 0.00 H new ATOM 0 HG SER A 32 35.286 -21.259 18.798 1.00 0.00 H new ATOM 492 N CYS A 33 32.628 -21.544 15.977 1.00 0.00 N ATOM 493 CA CYS A 33 32.457 -22.404 14.793 1.00 0.00 C ATOM 494 C CYS A 33 31.511 -21.771 13.744 1.00 0.00 C ATOM 495 O CYS A 33 31.852 -21.663 12.559 1.00 0.00 O ATOM 496 CB CYS A 33 31.981 -23.778 15.304 1.00 0.00 C ATOM 497 SG CYS A 33 31.800 -25.028 13.992 1.00 0.00 S ATOM 0 H CYS A 33 32.491 -22.051 16.851 1.00 0.00 H new ATOM 0 HA CYS A 33 33.399 -22.523 14.257 1.00 0.00 H new ATOM 0 HB2 CYS A 33 32.690 -24.144 16.047 1.00 0.00 H new ATOM 0 HB3 CYS A 33 31.024 -23.655 15.810 1.00 0.00 H new ATOM 502 N GLN A 34 30.360 -21.249 14.197 1.00 0.00 N ATOM 503 CA GLN A 34 29.381 -20.522 13.372 1.00 0.00 C ATOM 504 C GLN A 34 30.001 -19.341 12.600 1.00 0.00 C ATOM 505 O GLN A 34 29.610 -19.058 11.464 1.00 0.00 O ATOM 506 CB GLN A 34 28.267 -19.953 14.271 1.00 0.00 C ATOM 507 CG GLN A 34 27.388 -20.999 14.968 1.00 0.00 C ATOM 508 CD GLN A 34 26.398 -20.374 15.958 1.00 0.00 C ATOM 509 OE1 GLN A 34 26.027 -19.209 15.883 1.00 0.00 O ATOM 510 NE2 GLN A 34 25.920 -21.123 16.925 1.00 0.00 N ATOM 0 H GLN A 34 30.077 -21.323 15.174 1.00 0.00 H new ATOM 0 HA GLN A 34 28.995 -21.242 12.651 1.00 0.00 H new ATOM 0 HB2 GLN A 34 28.725 -19.322 15.033 1.00 0.00 H new ATOM 0 HB3 GLN A 34 27.628 -19.310 13.666 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.836 -21.563 14.216 1.00 0.00 H new ATOM 0 HG3 GLN A 34 28.025 -21.709 15.496 1.00 0.00 H new ATOM 0 HE21 GLN A 34 26.213 -22.096 17.009 1.00 0.00 H new ATOM 0 HE22 GLN A 34 25.255 -20.731 17.592 1.00 0.00 H new ATOM 519 N LYS A 35 30.961 -18.647 13.218 1.00 0.00 N ATOM 520 CA LYS A 35 31.666 -17.474 12.685 1.00 0.00 C ATOM 521 C LYS A 35 32.877 -17.874 11.838 1.00 0.00 C ATOM 522 O LYS A 35 33.060 -17.342 10.748 1.00 0.00 O ATOM 523 CB LYS A 35 32.048 -16.611 13.900 1.00 0.00 C ATOM 524 CG LYS A 35 32.673 -15.255 13.564 1.00 0.00 C ATOM 525 CD LYS A 35 32.920 -14.496 14.877 1.00 0.00 C ATOM 526 CE LYS A 35 33.540 -13.132 14.575 1.00 0.00 C ATOM 527 NZ LYS A 35 33.749 -12.326 15.806 1.00 0.00 N ATOM 0 H LYS A 35 31.285 -18.900 14.151 1.00 0.00 H new ATOM 0 HA LYS A 35 31.031 -16.907 12.004 1.00 0.00 H new ATOM 0 HB2 LYS A 35 31.155 -16.443 14.501 1.00 0.00 H new ATOM 0 HB3 LYS A 35 32.748 -17.172 14.519 1.00 0.00 H new ATOM 0 HG2 LYS A 35 33.610 -15.393 13.024 1.00 0.00 H new ATOM 0 HG3 LYS A 35 32.011 -14.683 12.914 1.00 0.00 H new ATOM 0 HD2 LYS A 35 31.982 -14.368 15.416 1.00 0.00 H new ATOM 0 HD3 LYS A 35 33.583 -15.073 15.522 1.00 0.00 H new ATOM 0 HE2 LYS A 35 34.495 -13.273 14.068 1.00 0.00 H new ATOM 0 HE3 LYS A 35 32.893 -12.584 13.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 34.635 -11.788 15.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 32.954 -11.667 15.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 33.804 -12.958 16.630 1.00 0.00 H new ATOM 541 N MET A 36 33.662 -18.852 12.287 1.00 0.00 N ATOM 542 CA MET A 36 34.829 -19.387 11.576 1.00 0.00 C ATOM 543 C MET A 36 34.454 -19.906 10.186 1.00 0.00 C ATOM 544 O MET A 36 35.139 -19.599 9.208 1.00 0.00 O ATOM 545 CB MET A 36 35.473 -20.502 12.411 1.00 0.00 C ATOM 546 CG MET A 36 36.160 -19.990 13.678 1.00 0.00 C ATOM 547 SD MET A 36 37.516 -18.831 13.344 1.00 0.00 S ATOM 548 CE MET A 36 38.316 -18.824 14.962 1.00 0.00 C ATOM 0 H MET A 36 33.501 -19.310 13.184 1.00 0.00 H new ATOM 0 HA MET A 36 35.546 -18.577 11.437 1.00 0.00 H new ATOM 0 HB2 MET A 36 34.707 -21.227 12.689 1.00 0.00 H new ATOM 0 HB3 MET A 36 36.204 -21.030 11.798 1.00 0.00 H new ATOM 0 HG2 MET A 36 35.420 -19.500 14.311 1.00 0.00 H new ATOM 0 HG3 MET A 36 36.548 -20.839 14.241 1.00 0.00 H new ATOM 0 HE1 MET A 36 39.255 -18.273 14.901 1.00 0.00 H new ATOM 0 HE2 MET A 36 37.661 -18.346 15.690 1.00 0.00 H new ATOM 0 HE3 MET A 36 38.517 -19.849 15.273 1.00 0.00 H new ATOM 558 N LYS A 37 33.334 -20.634 10.074 1.00 0.00 N ATOM 559 CA LYS A 37 32.807 -21.104 8.782 1.00 0.00 C ATOM 560 C LYS A 37 32.500 -19.925 7.856 1.00 0.00 C ATOM 561 O LYS A 37 32.926 -19.939 6.705 1.00 0.00 O ATOM 562 CB LYS A 37 31.567 -21.986 9.010 1.00 0.00 C ATOM 563 CG LYS A 37 31.979 -23.371 9.529 1.00 0.00 C ATOM 564 CD LYS A 37 30.784 -24.161 10.063 1.00 0.00 C ATOM 565 CE LYS A 37 31.260 -25.545 10.516 1.00 0.00 C ATOM 566 NZ LYS A 37 30.426 -26.049 11.616 1.00 0.00 N ATOM 0 H LYS A 37 32.767 -20.914 10.875 1.00 0.00 H new ATOM 0 HA LYS A 37 33.567 -21.710 8.289 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.900 -21.507 9.726 1.00 0.00 H new ATOM 0 HB3 LYS A 37 31.012 -22.091 8.078 1.00 0.00 H new ATOM 0 HG2 LYS A 37 32.455 -23.933 8.725 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.720 -23.256 10.320 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.324 -23.630 10.897 1.00 0.00 H new ATOM 0 HD3 LYS A 37 30.023 -24.260 9.289 1.00 0.00 H new ATOM 0 HE2 LYS A 37 31.223 -26.240 9.677 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.300 -25.490 10.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.540 -27.080 11.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.718 -25.600 12.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.428 -25.825 11.426 1.00 0.00 H new ATOM 580 N ARG A 38 31.834 -18.874 8.358 1.00 0.00 N ATOM 581 CA ARG A 38 31.518 -17.654 7.590 1.00 0.00 C ATOM 582 C ARG A 38 32.779 -16.902 7.146 1.00 0.00 C ATOM 583 O ARG A 38 32.807 -16.395 6.029 1.00 0.00 O ATOM 584 CB ARG A 38 30.566 -16.757 8.398 1.00 0.00 C ATOM 585 CG ARG A 38 29.157 -17.364 8.512 1.00 0.00 C ATOM 586 CD ARG A 38 28.293 -16.572 9.503 1.00 0.00 C ATOM 587 NE ARG A 38 26.866 -16.951 9.430 1.00 0.00 N ATOM 588 CZ ARG A 38 26.269 -17.987 9.993 1.00 0.00 C ATOM 589 NH1 ARG A 38 26.896 -18.901 10.673 1.00 0.00 N ATOM 590 NH2 ARG A 38 24.983 -18.151 9.894 1.00 0.00 N ATOM 0 H ARG A 38 31.495 -18.844 9.319 1.00 0.00 H new ATOM 0 HA ARG A 38 31.012 -17.954 6.672 1.00 0.00 H new ATOM 0 HB2 ARG A 38 30.975 -16.601 9.396 1.00 0.00 H new ATOM 0 HB3 ARG A 38 30.501 -15.778 7.924 1.00 0.00 H new ATOM 0 HG2 ARG A 38 28.680 -17.370 7.532 1.00 0.00 H new ATOM 0 HG3 ARG A 38 29.230 -18.402 8.837 1.00 0.00 H new ATOM 0 HD2 ARG A 38 28.660 -16.739 10.516 1.00 0.00 H new ATOM 0 HD3 ARG A 38 28.395 -15.506 9.299 1.00 0.00 H new ATOM 0 HE ARG A 38 26.268 -16.337 8.877 1.00 0.00 H new ATOM 0 HH11 ARG A 38 27.907 -18.842 10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 38 26.377 -19.677 11.083 1.00 0.00 H new ATOM 0 HH21 ARG A 38 24.421 -17.475 9.376 1.00 0.00 H new ATOM 0 HH22 ARG A 38 24.536 -18.956 10.334 1.00 0.00 H new ATOM 604 N VAL A 39 33.834 -16.868 7.968 1.00 0.00 N ATOM 605 CA VAL A 39 35.130 -16.241 7.637 1.00 0.00 C ATOM 606 C VAL A 39 35.810 -16.992 6.491 1.00 0.00 C ATOM 607 O VAL A 39 36.179 -16.382 5.488 1.00 0.00 O ATOM 608 CB VAL A 39 36.045 -16.209 8.879 1.00 0.00 C ATOM 609 CG1 VAL A 39 37.471 -15.752 8.573 1.00 0.00 C ATOM 610 CG2 VAL A 39 35.520 -15.238 9.930 1.00 0.00 C ATOM 0 H VAL A 39 33.816 -17.282 8.900 1.00 0.00 H new ATOM 0 HA VAL A 39 34.946 -15.216 7.316 1.00 0.00 H new ATOM 0 HB VAL A 39 36.050 -17.239 9.234 1.00 0.00 H new ATOM 0 HG11 VAL A 39 38.058 -15.753 9.491 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.924 -16.432 7.851 1.00 0.00 H new ATOM 0 HG13 VAL A 39 37.449 -14.744 8.158 1.00 0.00 H new ATOM 0 HG21 VAL A 39 36.187 -15.239 10.792 1.00 0.00 H new ATOM 0 HG22 VAL A 39 35.475 -14.234 9.508 1.00 0.00 H new ATOM 0 HG23 VAL A 39 34.522 -15.545 10.243 1.00 0.00 H new ATOM 620 N VAL A 40 35.921 -18.320 6.612 1.00 0.00 N ATOM 621 CA VAL A 40 36.469 -19.215 5.578 1.00 0.00 C ATOM 622 C VAL A 40 35.696 -19.003 4.265 1.00 0.00 C ATOM 623 O VAL A 40 36.281 -18.598 3.262 1.00 0.00 O ATOM 624 CB VAL A 40 36.402 -20.670 6.098 1.00 0.00 C ATOM 625 CG1 VAL A 40 36.311 -21.717 4.989 1.00 0.00 C ATOM 626 CG2 VAL A 40 37.616 -20.969 6.981 1.00 0.00 C ATOM 0 H VAL A 40 35.626 -18.818 7.452 1.00 0.00 H new ATOM 0 HA VAL A 40 37.515 -18.992 5.368 1.00 0.00 H new ATOM 0 HB VAL A 40 35.479 -20.741 6.674 1.00 0.00 H new ATOM 0 HG11 VAL A 40 36.268 -22.712 5.431 1.00 0.00 H new ATOM 0 HG12 VAL A 40 35.412 -21.543 4.397 1.00 0.00 H new ATOM 0 HG13 VAL A 40 37.188 -21.643 4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 40 37.559 -21.996 7.342 1.00 0.00 H new ATOM 0 HG22 VAL A 40 38.529 -20.838 6.400 1.00 0.00 H new ATOM 0 HG23 VAL A 40 37.625 -20.286 7.830 1.00 0.00 H new ATOM 636 N GLN A 41 34.379 -19.244 4.277 1.00 0.00 N ATOM 637 CA GLN A 41 33.452 -19.040 3.155 1.00 0.00 C ATOM 638 C GLN A 41 33.585 -17.658 2.500 1.00 0.00 C ATOM 639 O GLN A 41 33.628 -17.584 1.269 1.00 0.00 O ATOM 640 CB GLN A 41 32.001 -19.226 3.631 1.00 0.00 C ATOM 641 CG GLN A 41 31.617 -20.693 3.904 1.00 0.00 C ATOM 642 CD GLN A 41 31.712 -21.576 2.665 1.00 0.00 C ATOM 643 OE1 GLN A 41 32.693 -22.277 2.450 1.00 0.00 O ATOM 644 NE2 GLN A 41 30.722 -21.574 1.798 1.00 0.00 N ATOM 0 H GLN A 41 33.908 -19.603 5.107 1.00 0.00 H new ATOM 0 HA GLN A 41 33.715 -19.785 2.404 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.850 -18.646 4.541 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.327 -18.818 2.878 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.269 -21.095 4.680 1.00 0.00 H new ATOM 0 HG3 GLN A 41 30.599 -20.730 4.292 1.00 0.00 H new ATOM 0 HE21 GLN A 41 29.899 -20.995 1.965 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.778 -22.152 0.959 1.00 0.00 H new ATOM 653 N HIS A 42 33.675 -16.575 3.286 1.00 0.00 N ATOM 654 CA HIS A 42 33.874 -15.229 2.746 1.00 0.00 C ATOM 655 C HIS A 42 35.169 -15.181 1.922 1.00 0.00 C ATOM 656 O HIS A 42 35.146 -14.869 0.730 1.00 0.00 O ATOM 657 CB HIS A 42 33.902 -14.171 3.874 1.00 0.00 C ATOM 658 CG HIS A 42 34.581 -12.892 3.436 1.00 0.00 C ATOM 659 ND1 HIS A 42 34.075 -11.988 2.529 1.00 0.00 N ATOM 660 CD2 HIS A 42 35.933 -12.659 3.517 1.00 0.00 C ATOM 661 CE1 HIS A 42 35.105 -11.278 2.037 1.00 0.00 C ATOM 662 NE2 HIS A 42 36.266 -11.666 2.592 1.00 0.00 N ATOM 0 H HIS A 42 33.612 -16.610 4.303 1.00 0.00 H new ATOM 0 HA HIS A 42 33.033 -14.992 2.095 1.00 0.00 H new ATOM 0 HB2 HIS A 42 32.882 -13.950 4.189 1.00 0.00 H new ATOM 0 HB3 HIS A 42 34.422 -14.579 4.741 1.00 0.00 H new ATOM 0 HD1 HIS A 42 33.093 -11.877 2.276 1.00 0.00 H new ATOM 0 HD2 HIS A 42 36.621 -13.159 4.183 1.00 0.00 H new ATOM 0 HE1 HIS A 42 35.012 -10.499 1.294 1.00 0.00 H new ATOM 670 N THR A 43 36.295 -15.521 2.551 1.00 0.00 N ATOM 671 CA THR A 43 37.620 -15.465 1.933 1.00 0.00 C ATOM 672 C THR A 43 37.723 -16.333 0.683 1.00 0.00 C ATOM 673 O THR A 43 38.318 -15.900 -0.308 1.00 0.00 O ATOM 674 CB THR A 43 38.674 -15.827 2.984 1.00 0.00 C ATOM 675 OG1 THR A 43 38.822 -14.733 3.850 1.00 0.00 O ATOM 676 CG2 THR A 43 40.029 -16.186 2.387 1.00 0.00 C ATOM 0 H THR A 43 36.312 -15.847 3.517 1.00 0.00 H new ATOM 0 HA THR A 43 37.801 -14.448 1.585 1.00 0.00 H new ATOM 0 HB THR A 43 38.325 -16.716 3.509 1.00 0.00 H new ATOM 0 HG1 THR A 43 39.432 -14.079 3.449 1.00 0.00 H new ATOM 0 HG21 THR A 43 40.726 -16.431 3.188 1.00 0.00 H new ATOM 0 HG22 THR A 43 39.919 -17.046 1.726 1.00 0.00 H new ATOM 0 HG23 THR A 43 40.413 -15.338 1.819 1.00 0.00 H new ATOM 684 N LYS A 44 37.097 -17.517 0.707 1.00 0.00 N ATOM 685 CA LYS A 44 37.011 -18.486 -0.400 1.00 0.00 C ATOM 686 C LYS A 44 36.319 -17.940 -1.661 1.00 0.00 C ATOM 687 O LYS A 44 36.494 -18.516 -2.737 1.00 0.00 O ATOM 688 CB LYS A 44 36.293 -19.746 0.117 1.00 0.00 C ATOM 689 CG LYS A 44 37.260 -20.721 0.805 1.00 0.00 C ATOM 690 CD LYS A 44 36.510 -21.808 1.587 1.00 0.00 C ATOM 691 CE LYS A 44 35.547 -22.627 0.728 1.00 0.00 C ATOM 692 NZ LYS A 44 34.907 -23.727 1.495 1.00 0.00 N ATOM 0 H LYS A 44 36.611 -17.844 1.542 1.00 0.00 H new ATOM 0 HA LYS A 44 38.028 -18.716 -0.717 1.00 0.00 H new ATOM 0 HB2 LYS A 44 35.512 -19.455 0.819 1.00 0.00 H new ATOM 0 HB3 LYS A 44 35.802 -20.250 -0.715 1.00 0.00 H new ATOM 0 HG2 LYS A 44 37.900 -21.188 0.056 1.00 0.00 H new ATOM 0 HG3 LYS A 44 37.912 -20.170 1.483 1.00 0.00 H new ATOM 0 HD2 LYS A 44 37.236 -22.480 2.045 1.00 0.00 H new ATOM 0 HD3 LYS A 44 35.952 -21.340 2.398 1.00 0.00 H new ATOM 0 HE2 LYS A 44 34.776 -21.971 0.324 1.00 0.00 H new ATOM 0 HE3 LYS A 44 36.087 -23.045 -0.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 34.665 -24.505 0.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 35.566 -24.072 2.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 34.042 -23.374 1.951 1.00 0.00 H new ATOM 706 N GLY A 45 35.565 -16.844 -1.547 1.00 0.00 N ATOM 707 CA GLY A 45 34.860 -16.180 -2.652 1.00 0.00 C ATOM 708 C GLY A 45 35.226 -14.699 -2.841 1.00 0.00 C ATOM 709 O GLY A 45 34.757 -14.082 -3.801 1.00 0.00 O ATOM 0 H GLY A 45 35.422 -16.376 -0.652 1.00 0.00 H new ATOM 0 HA2 GLY A 45 35.074 -16.715 -3.577 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.786 -16.257 -2.480 1.00 0.00 H new ATOM 713 N CYS A 46 36.049 -14.123 -1.957 1.00 0.00 N ATOM 714 CA CYS A 46 36.477 -12.729 -2.013 1.00 0.00 C ATOM 715 C CYS A 46 37.500 -12.478 -3.137 1.00 0.00 C ATOM 716 O CYS A 46 38.220 -13.379 -3.581 1.00 0.00 O ATOM 717 CB CYS A 46 36.933 -12.362 -0.594 1.00 0.00 C ATOM 718 SG CYS A 46 38.014 -10.904 -0.447 1.00 0.00 S ATOM 0 H CYS A 46 36.443 -14.630 -1.165 1.00 0.00 H new ATOM 0 HA CYS A 46 35.666 -12.058 -2.296 1.00 0.00 H new ATOM 0 HB2 CYS A 46 36.047 -12.194 0.018 1.00 0.00 H new ATOM 0 HB3 CYS A 46 37.455 -13.220 -0.170 1.00 0.00 H new ATOM 723 N LYS A 47 37.547 -11.221 -3.588 1.00 0.00 N ATOM 724 CA LYS A 47 38.417 -10.698 -4.654 1.00 0.00 C ATOM 725 C LYS A 47 39.310 -9.546 -4.162 1.00 0.00 C ATOM 726 O LYS A 47 40.040 -8.961 -4.965 1.00 0.00 O ATOM 727 CB LYS A 47 37.548 -10.265 -5.855 1.00 0.00 C ATOM 728 CG LYS A 47 36.674 -11.374 -6.474 1.00 0.00 C ATOM 729 CD LYS A 47 37.439 -12.578 -7.049 1.00 0.00 C ATOM 730 CE LYS A 47 38.386 -12.175 -8.188 1.00 0.00 C ATOM 731 NZ LYS A 47 39.048 -13.360 -8.795 1.00 0.00 N ATOM 0 H LYS A 47 36.945 -10.496 -3.198 1.00 0.00 H new ATOM 0 HA LYS A 47 39.093 -11.493 -4.968 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.899 -9.450 -5.536 1.00 0.00 H new ATOM 0 HB3 LYS A 47 38.203 -9.867 -6.630 1.00 0.00 H new ATOM 0 HG2 LYS A 47 35.983 -11.735 -5.712 1.00 0.00 H new ATOM 0 HG3 LYS A 47 36.071 -10.936 -7.269 1.00 0.00 H new ATOM 0 HD2 LYS A 47 38.012 -13.055 -6.254 1.00 0.00 H new ATOM 0 HD3 LYS A 47 36.727 -13.317 -7.416 1.00 0.00 H new ATOM 0 HE2 LYS A 47 37.827 -11.638 -8.954 1.00 0.00 H new ATOM 0 HE3 LYS A 47 39.143 -11.490 -7.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 39.680 -13.050 -9.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 39.602 -13.858 -8.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 38.326 -14.002 -9.181 1.00 0.00 H new ATOM 745 N ARG A 48 39.279 -9.228 -2.860 1.00 0.00 N ATOM 746 CA ARG A 48 40.081 -8.172 -2.230 1.00 0.00 C ATOM 747 C ARG A 48 41.352 -8.761 -1.608 1.00 0.00 C ATOM 748 O ARG A 48 42.447 -8.419 -2.056 1.00 0.00 O ATOM 749 CB ARG A 48 39.241 -7.492 -1.138 1.00 0.00 C ATOM 750 CG ARG A 48 37.942 -6.817 -1.577 1.00 0.00 C ATOM 751 CD ARG A 48 37.223 -6.173 -0.381 1.00 0.00 C ATOM 752 NE ARG A 48 36.919 -7.144 0.693 1.00 0.00 N ATOM 753 CZ ARG A 48 35.772 -7.365 1.303 1.00 0.00 C ATOM 754 NH1 ARG A 48 34.669 -6.721 1.063 1.00 0.00 N ATOM 755 NH2 ARG A 48 35.707 -8.272 2.214 1.00 0.00 N ATOM 0 H ARG A 48 38.676 -9.714 -2.197 1.00 0.00 H new ATOM 0 HA ARG A 48 40.372 -7.444 -2.987 1.00 0.00 H new ATOM 0 HB2 ARG A 48 38.995 -8.241 -0.385 1.00 0.00 H new ATOM 0 HB3 ARG A 48 39.864 -6.742 -0.650 1.00 0.00 H new ATOM 0 HG2 ARG A 48 38.159 -6.057 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 48 37.287 -7.551 -2.047 1.00 0.00 H new ATOM 0 HD2 ARG A 48 37.844 -5.373 0.023 1.00 0.00 H new ATOM 0 HD3 ARG A 48 36.295 -5.715 -0.724 1.00 0.00 H new ATOM 0 HE ARG A 48 37.702 -7.719 1.003 1.00 0.00 H new ATOM 0 HH11 ARG A 48 34.652 -5.984 0.358 1.00 0.00 H new ATOM 0 HH12 ARG A 48 33.821 -6.952 1.580 1.00 0.00 H new ATOM 0 HH21 ARG A 48 36.538 -8.811 2.457 1.00 0.00 H new ATOM 0 HH22 ARG A 48 34.824 -8.452 2.693 1.00 0.00 H new ATOM 769 N LYS A 49 41.202 -9.644 -0.606 1.00 0.00 N ATOM 770 CA LYS A 49 42.271 -10.281 0.195 1.00 0.00 C ATOM 771 C LYS A 49 43.389 -9.339 0.695 1.00 0.00 C ATOM 772 O LYS A 49 43.289 -8.112 0.602 1.00 0.00 O ATOM 773 CB LYS A 49 42.716 -11.658 -0.361 1.00 0.00 C ATOM 774 CG LYS A 49 42.627 -11.933 -1.870 1.00 0.00 C ATOM 775 CD LYS A 49 41.234 -12.371 -2.363 1.00 0.00 C ATOM 776 CE LYS A 49 40.681 -13.630 -1.677 1.00 0.00 C ATOM 777 NZ LYS A 49 39.817 -13.327 -0.513 1.00 0.00 N ATOM 0 H LYS A 49 40.275 -9.954 -0.313 1.00 0.00 H new ATOM 0 HA LYS A 49 41.796 -10.531 1.144 1.00 0.00 H new ATOM 0 HB2 LYS A 49 43.753 -11.810 -0.063 1.00 0.00 H new ATOM 0 HB3 LYS A 49 42.124 -12.421 0.145 1.00 0.00 H new ATOM 0 HG2 LYS A 49 42.921 -11.032 -2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 49 43.349 -12.708 -2.128 1.00 0.00 H new ATOM 0 HD2 LYS A 49 40.533 -11.551 -2.208 1.00 0.00 H new ATOM 0 HD3 LYS A 49 41.282 -12.550 -3.437 1.00 0.00 H new ATOM 0 HE2 LYS A 49 40.112 -14.211 -2.403 1.00 0.00 H new ATOM 0 HE3 LYS A 49 41.513 -14.254 -1.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 39.135 -14.100 -0.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 40.405 -13.230 0.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 39.304 -12.438 -0.683 1.00 0.00 H new ATOM 791 N THR A 50 44.456 -9.895 1.276 1.00 0.00 N ATOM 792 CA THR A 50 45.600 -9.145 1.832 1.00 0.00 C ATOM 793 C THR A 50 46.303 -8.240 0.814 1.00 0.00 C ATOM 794 O THR A 50 46.841 -7.199 1.192 1.00 0.00 O ATOM 795 CB THR A 50 46.636 -10.092 2.457 1.00 0.00 C ATOM 796 OG1 THR A 50 47.113 -11.006 1.499 1.00 0.00 O ATOM 797 CG2 THR A 50 46.037 -10.920 3.590 1.00 0.00 C ATOM 0 H THR A 50 44.556 -10.905 1.378 1.00 0.00 H new ATOM 0 HA THR A 50 45.168 -8.500 2.597 1.00 0.00 H new ATOM 0 HB THR A 50 47.437 -9.458 2.837 1.00 0.00 H new ATOM 0 HG1 THR A 50 47.950 -11.405 1.816 1.00 0.00 H new ATOM 0 HG21 THR A 50 46.802 -11.576 4.005 1.00 0.00 H new ATOM 0 HG22 THR A 50 45.667 -10.255 4.371 1.00 0.00 H new ATOM 0 HG23 THR A 50 45.213 -11.521 3.205 1.00 0.00 H new ATOM 805 N ASN A 51 46.286 -8.605 -0.473 1.00 0.00 N ATOM 806 CA ASN A 51 46.893 -7.821 -1.552 1.00 0.00 C ATOM 807 C ASN A 51 46.093 -6.551 -1.922 1.00 0.00 C ATOM 808 O ASN A 51 46.679 -5.582 -2.407 1.00 0.00 O ATOM 809 CB ASN A 51 47.067 -8.733 -2.776 1.00 0.00 C ATOM 810 CG ASN A 51 48.052 -8.128 -3.764 1.00 0.00 C ATOM 811 OD1 ASN A 51 49.252 -8.071 -3.539 1.00 0.00 O ATOM 812 ND2 ASN A 51 47.584 -7.639 -4.886 1.00 0.00 N ATOM 0 H ASN A 51 45.844 -9.465 -0.798 1.00 0.00 H new ATOM 0 HA ASN A 51 47.858 -7.459 -1.198 1.00 0.00 H new ATOM 0 HB2 ASN A 51 47.421 -9.714 -2.457 1.00 0.00 H new ATOM 0 HB3 ASN A 51 46.103 -8.884 -3.263 1.00 0.00 H new ATOM 0 HD21 ASN A 51 48.220 -7.216 -5.562 1.00 0.00 H new ATOM 0 HD22 ASN A 51 46.584 -7.682 -5.083 1.00 0.00 H new ATOM 819 N GLY A 52 44.769 -6.550 -1.711 1.00 0.00 N ATOM 820 CA GLY A 52 43.866 -5.438 -2.043 1.00 0.00 C ATOM 821 C GLY A 52 43.393 -4.611 -0.840 1.00 0.00 C ATOM 822 O GLY A 52 43.042 -3.442 -1.017 1.00 0.00 O ATOM 0 H GLY A 52 44.283 -7.344 -1.293 1.00 0.00 H new ATOM 0 HA2 GLY A 52 44.372 -4.775 -2.745 1.00 0.00 H new ATOM 0 HA3 GLY A 52 42.992 -5.839 -2.556 1.00 0.00 H new ATOM 826 N GLY A 53 43.394 -5.185 0.371 1.00 0.00 N ATOM 827 CA GLY A 53 43.042 -4.484 1.617 1.00 0.00 C ATOM 828 C GLY A 53 41.950 -5.118 2.486 1.00 0.00 C ATOM 829 O GLY A 53 41.582 -4.510 3.493 1.00 0.00 O ATOM 0 H GLY A 53 43.643 -6.163 0.516 1.00 0.00 H new ATOM 0 HA2 GLY A 53 43.945 -4.392 2.221 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.726 -3.473 1.360 1.00 0.00 H new ATOM 833 N CYS A 54 41.418 -6.293 2.127 1.00 0.00 N ATOM 834 CA CYS A 54 40.359 -6.970 2.875 1.00 0.00 C ATOM 835 C CYS A 54 40.714 -7.186 4.363 1.00 0.00 C ATOM 836 O CYS A 54 41.729 -7.839 4.655 1.00 0.00 O ATOM 837 CB CYS A 54 40.109 -8.312 2.203 1.00 0.00 C ATOM 838 SG CYS A 54 38.542 -9.020 2.739 1.00 0.00 S ATOM 0 H CYS A 54 41.717 -6.805 1.297 1.00 0.00 H new ATOM 0 HA CYS A 54 39.469 -6.340 2.864 1.00 0.00 H new ATOM 0 HB2 CYS A 54 40.104 -8.185 1.120 1.00 0.00 H new ATOM 0 HB3 CYS A 54 40.922 -8.998 2.439 1.00 0.00 H new ATOM 843 N PRO A 55 39.921 -6.666 5.321 1.00 0.00 N ATOM 844 CA PRO A 55 40.206 -6.855 6.734 1.00 0.00 C ATOM 845 C PRO A 55 39.837 -8.270 7.198 1.00 0.00 C ATOM 846 O PRO A 55 40.454 -8.757 8.141 1.00 0.00 O ATOM 847 CB PRO A 55 39.367 -5.796 7.453 1.00 0.00 C ATOM 848 CG PRO A 55 38.133 -5.683 6.561 1.00 0.00 C ATOM 849 CD PRO A 55 38.706 -5.879 5.154 1.00 0.00 C ATOM 0 HA PRO A 55 41.269 -6.747 6.950 1.00 0.00 H new ATOM 0 HB2 PRO A 55 39.108 -6.104 8.466 1.00 0.00 H new ATOM 0 HB3 PRO A 55 39.896 -4.847 7.534 1.00 0.00 H new ATOM 0 HG2 PRO A 55 37.389 -6.442 6.803 1.00 0.00 H new ATOM 0 HG3 PRO A 55 37.646 -4.714 6.667 1.00 0.00 H new ATOM 0 HD2 PRO A 55 37.993 -6.394 4.511 1.00 0.00 H new ATOM 0 HD3 PRO A 55 38.924 -4.920 4.684 1.00 0.00 H new ATOM 857 N VAL A 56 38.870 -8.947 6.555 1.00 0.00 N ATOM 858 CA VAL A 56 38.450 -10.303 6.945 1.00 0.00 C ATOM 859 C VAL A 56 39.512 -11.324 6.563 1.00 0.00 C ATOM 860 O VAL A 56 39.976 -12.043 7.452 1.00 0.00 O ATOM 861 CB VAL A 56 37.089 -10.715 6.356 1.00 0.00 C ATOM 862 CG1 VAL A 56 36.685 -12.092 6.907 1.00 0.00 C ATOM 863 CG2 VAL A 56 35.983 -9.719 6.727 1.00 0.00 C ATOM 0 H VAL A 56 38.360 -8.572 5.755 1.00 0.00 H new ATOM 0 HA VAL A 56 38.331 -10.282 8.028 1.00 0.00 H new ATOM 0 HB VAL A 56 37.199 -10.738 5.272 1.00 0.00 H new ATOM 0 HG11 VAL A 56 35.721 -12.383 6.489 1.00 0.00 H new ATOM 0 HG12 VAL A 56 37.438 -12.830 6.630 1.00 0.00 H new ATOM 0 HG13 VAL A 56 36.609 -12.041 7.993 1.00 0.00 H new ATOM 0 HG21 VAL A 56 35.038 -10.046 6.292 1.00 0.00 H new ATOM 0 HG22 VAL A 56 35.886 -9.671 7.812 1.00 0.00 H new ATOM 0 HG23 VAL A 56 36.238 -8.732 6.341 1.00 0.00 H new ATOM 873 N CYS A 57 39.928 -11.365 5.291 1.00 0.00 N ATOM 874 CA CYS A 57 40.979 -12.256 4.820 1.00 0.00 C ATOM 875 C CYS A 57 42.240 -12.100 5.683 1.00 0.00 C ATOM 876 O CYS A 57 42.730 -13.065 6.270 1.00 0.00 O ATOM 877 CB CYS A 57 41.252 -11.969 3.343 1.00 0.00 C ATOM 878 SG CYS A 57 39.824 -12.396 2.291 1.00 0.00 S ATOM 0 H CYS A 57 39.537 -10.773 4.559 1.00 0.00 H new ATOM 0 HA CYS A 57 40.659 -13.294 4.913 1.00 0.00 H new ATOM 0 HB2 CYS A 57 41.493 -10.913 3.217 1.00 0.00 H new ATOM 0 HB3 CYS A 57 42.124 -12.536 3.018 1.00 0.00 H new ATOM 883 N LYS A 58 42.747 -10.871 5.829 1.00 0.00 N ATOM 884 CA LYS A 58 43.903 -10.574 6.664 1.00 0.00 C ATOM 885 C LYS A 58 43.752 -11.035 8.126 1.00 0.00 C ATOM 886 O LYS A 58 44.759 -11.365 8.753 1.00 0.00 O ATOM 887 CB LYS A 58 44.216 -9.077 6.520 1.00 0.00 C ATOM 888 CG LYS A 58 45.703 -8.828 6.755 1.00 0.00 C ATOM 889 CD LYS A 58 46.123 -7.426 6.292 1.00 0.00 C ATOM 890 CE LYS A 58 47.568 -7.132 6.713 1.00 0.00 C ATOM 891 NZ LYS A 58 47.996 -5.771 6.291 1.00 0.00 N ATOM 0 H LYS A 58 42.358 -10.051 5.364 1.00 0.00 H new ATOM 0 HA LYS A 58 44.755 -11.158 6.315 1.00 0.00 H new ATOM 0 HB2 LYS A 58 43.934 -8.733 5.525 1.00 0.00 H new ATOM 0 HB3 LYS A 58 43.626 -8.504 7.235 1.00 0.00 H new ATOM 0 HG2 LYS A 58 45.929 -8.944 7.815 1.00 0.00 H new ATOM 0 HG3 LYS A 58 46.287 -9.578 6.221 1.00 0.00 H new ATOM 0 HD2 LYS A 58 46.031 -7.352 5.208 1.00 0.00 H new ATOM 0 HD3 LYS A 58 45.454 -6.680 6.720 1.00 0.00 H new ATOM 0 HE2 LYS A 58 47.658 -7.223 7.796 1.00 0.00 H new ATOM 0 HE3 LYS A 58 48.234 -7.876 6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 48.978 -5.607 6.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 47.934 -5.693 5.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 47.376 -5.061 6.730 1.00 0.00 H new ATOM 905 N GLN A 59 42.526 -11.129 8.659 1.00 0.00 N ATOM 906 CA GLN A 59 42.278 -11.602 10.024 1.00 0.00 C ATOM 907 C GLN A 59 42.539 -13.108 10.162 1.00 0.00 C ATOM 908 O GLN A 59 43.353 -13.482 11.011 1.00 0.00 O ATOM 909 CB GLN A 59 40.860 -11.227 10.505 1.00 0.00 C ATOM 910 CG GLN A 59 40.847 -10.804 11.987 1.00 0.00 C ATOM 911 CD GLN A 59 41.464 -9.422 12.254 1.00 0.00 C ATOM 912 OE1 GLN A 59 42.112 -8.806 11.422 1.00 0.00 O ATOM 913 NE2 GLN A 59 41.286 -8.865 13.433 1.00 0.00 N ATOM 0 H GLN A 59 41.677 -10.878 8.152 1.00 0.00 H new ATOM 0 HA GLN A 59 42.989 -11.092 10.674 1.00 0.00 H new ATOM 0 HB2 GLN A 59 40.473 -10.413 9.892 1.00 0.00 H new ATOM 0 HB3 GLN A 59 40.193 -12.077 10.365 1.00 0.00 H new ATOM 0 HG2 GLN A 59 39.817 -10.805 12.344 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.387 -11.549 12.571 1.00 0.00 H new ATOM 0 HE21 GLN A 59 40.750 -9.352 14.151 1.00 0.00 H new ATOM 0 HE22 GLN A 59 41.684 -7.946 13.628 1.00 0.00 H new ATOM 922 N LEU A 60 41.936 -13.976 9.325 1.00 0.00 N ATOM 923 CA LEU A 60 42.274 -15.410 9.389 1.00 0.00 C ATOM 924 C LEU A 60 43.716 -15.646 8.955 1.00 0.00 C ATOM 925 O LEU A 60 44.349 -16.550 9.480 1.00 0.00 O ATOM 926 CB LEU A 60 41.341 -16.386 8.636 1.00 0.00 C ATOM 927 CG LEU A 60 41.411 -16.465 7.101 1.00 0.00 C ATOM 928 CD1 LEU A 60 40.897 -17.819 6.601 1.00 0.00 C ATOM 929 CD2 LEU A 60 40.561 -15.392 6.455 1.00 0.00 C ATOM 0 H LEU A 60 41.240 -13.723 8.624 1.00 0.00 H new ATOM 0 HA LEU A 60 42.128 -15.651 10.442 1.00 0.00 H new ATOM 0 HB2 LEU A 60 41.532 -17.386 9.024 1.00 0.00 H new ATOM 0 HB3 LEU A 60 40.316 -16.131 8.904 1.00 0.00 H new ATOM 0 HG LEU A 60 42.458 -16.328 6.829 1.00 0.00 H new ATOM 0 HD11 LEU A 60 40.956 -17.851 5.513 1.00 0.00 H new ATOM 0 HD12 LEU A 60 41.508 -18.618 7.022 1.00 0.00 H new ATOM 0 HD13 LEU A 60 39.861 -17.952 6.912 1.00 0.00 H new ATOM 0 HD21 LEU A 60 40.632 -15.475 5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 60 39.522 -15.517 6.761 1.00 0.00 H new ATOM 0 HD23 LEU A 60 40.915 -14.410 6.768 1.00 0.00 H new ATOM 941 N ILE A 61 44.250 -14.854 8.024 1.00 0.00 N ATOM 942 CA ILE A 61 45.628 -14.996 7.557 1.00 0.00 C ATOM 943 C ILE A 61 46.636 -14.777 8.682 1.00 0.00 C ATOM 944 O ILE A 61 47.547 -15.591 8.823 1.00 0.00 O ATOM 945 CB ILE A 61 45.834 -14.113 6.311 1.00 0.00 C ATOM 946 CG1 ILE A 61 45.175 -14.729 5.065 1.00 0.00 C ATOM 947 CG2 ILE A 61 47.297 -13.811 5.983 1.00 0.00 C ATOM 948 CD1 ILE A 61 45.512 -16.196 4.859 1.00 0.00 C ATOM 0 H ILE A 61 43.738 -14.096 7.573 1.00 0.00 H new ATOM 0 HA ILE A 61 45.815 -16.023 7.244 1.00 0.00 H new ATOM 0 HB ILE A 61 45.355 -13.170 6.573 1.00 0.00 H new ATOM 0 HG12 ILE A 61 44.093 -14.622 5.146 1.00 0.00 H new ATOM 0 HG13 ILE A 61 45.486 -14.167 4.185 1.00 0.00 H new ATOM 0 HG21 ILE A 61 47.348 -13.185 5.092 1.00 0.00 H new ATOM 0 HG22 ILE A 61 47.757 -13.288 6.821 1.00 0.00 H new ATOM 0 HG23 ILE A 61 47.829 -14.745 5.801 1.00 0.00 H new ATOM 0 HD11 ILE A 61 45.012 -16.562 3.962 1.00 0.00 H new ATOM 0 HD12 ILE A 61 46.590 -16.309 4.745 1.00 0.00 H new ATOM 0 HD13 ILE A 61 45.176 -16.771 5.722 1.00 0.00 H new ATOM 960 N ALA A 62 46.442 -13.775 9.545 1.00 0.00 N ATOM 961 CA ALA A 62 47.279 -13.609 10.733 1.00 0.00 C ATOM 962 C ALA A 62 47.190 -14.865 11.618 1.00 0.00 C ATOM 963 O ALA A 62 48.200 -15.484 11.964 1.00 0.00 O ATOM 964 CB ALA A 62 46.812 -12.348 11.479 1.00 0.00 C ATOM 0 H ALA A 62 45.713 -13.069 9.442 1.00 0.00 H new ATOM 0 HA ALA A 62 48.326 -13.486 10.455 1.00 0.00 H new ATOM 0 HB1 ALA A 62 47.424 -12.205 12.370 1.00 0.00 H new ATOM 0 HB2 ALA A 62 46.913 -11.481 10.826 1.00 0.00 H new ATOM 0 HB3 ALA A 62 45.768 -12.463 11.770 1.00 0.00 H new ATOM 970 N LEU A 63 45.957 -15.257 11.940 1.00 0.00 N ATOM 971 CA LEU A 63 45.619 -16.407 12.782 1.00 0.00 C ATOM 972 C LEU A 63 46.242 -17.723 12.266 1.00 0.00 C ATOM 973 O LEU A 63 46.827 -18.490 13.033 1.00 0.00 O ATOM 974 CB LEU A 63 44.077 -16.442 12.872 1.00 0.00 C ATOM 975 CG LEU A 63 43.541 -16.734 14.278 1.00 0.00 C ATOM 976 CD1 LEU A 63 42.103 -16.226 14.396 1.00 0.00 C ATOM 977 CD2 LEU A 63 43.567 -18.226 14.569 1.00 0.00 C ATOM 0 H LEU A 63 45.130 -14.761 11.607 1.00 0.00 H new ATOM 0 HA LEU A 63 46.046 -16.302 13.779 1.00 0.00 H new ATOM 0 HB2 LEU A 63 43.682 -15.484 12.535 1.00 0.00 H new ATOM 0 HB3 LEU A 63 43.700 -17.201 12.186 1.00 0.00 H new ATOM 0 HG LEU A 63 44.179 -16.224 15.000 1.00 0.00 H new ATOM 0 HD11 LEU A 63 41.724 -16.435 15.397 1.00 0.00 H new ATOM 0 HD12 LEU A 63 42.081 -15.151 14.217 1.00 0.00 H new ATOM 0 HD13 LEU A 63 41.478 -16.730 13.659 1.00 0.00 H new ATOM 0 HD21 LEU A 63 43.182 -18.408 15.572 1.00 0.00 H new ATOM 0 HD22 LEU A 63 42.946 -18.749 13.842 1.00 0.00 H new ATOM 0 HD23 LEU A 63 44.592 -18.592 14.502 1.00 0.00 H new ATOM 989 N CYS A 64 46.166 -17.955 10.955 1.00 0.00 N ATOM 990 CA CYS A 64 46.744 -19.105 10.269 1.00 0.00 C ATOM 991 C CYS A 64 48.276 -19.029 10.253 1.00 0.00 C ATOM 992 O CYS A 64 48.908 -20.031 10.559 1.00 0.00 O ATOM 993 CB CYS A 64 46.192 -19.213 8.842 1.00 0.00 C ATOM 994 SG CYS A 64 44.420 -19.606 8.873 1.00 0.00 S ATOM 0 H CYS A 64 45.681 -17.321 10.320 1.00 0.00 H new ATOM 0 HA CYS A 64 46.460 -20.002 10.819 1.00 0.00 H new ATOM 0 HB2 CYS A 64 46.353 -18.274 8.312 1.00 0.00 H new ATOM 0 HB3 CYS A 64 46.732 -19.985 8.294 1.00 0.00 H new ATOM 0 HG CYS A 64 43.741 -18.528 9.130 1.00 0.00 H new ATOM 1000 N CYS A 65 48.894 -17.877 9.960 1.00 0.00 N ATOM 1001 CA CYS A 65 50.356 -17.722 9.995 1.00 0.00 C ATOM 1002 C CYS A 65 50.933 -18.039 11.385 1.00 0.00 C ATOM 1003 O CYS A 65 51.953 -18.722 11.478 1.00 0.00 O ATOM 1004 CB CYS A 65 50.748 -16.303 9.566 1.00 0.00 C ATOM 1005 SG CYS A 65 50.705 -16.131 7.759 1.00 0.00 S ATOM 0 H CYS A 65 48.397 -17.028 9.693 1.00 0.00 H new ATOM 0 HA CYS A 65 50.781 -18.440 9.293 1.00 0.00 H new ATOM 0 HB2 CYS A 65 50.068 -15.582 10.019 1.00 0.00 H new ATOM 0 HB3 CYS A 65 51.748 -16.072 9.933 1.00 0.00 H new ATOM 0 HG CYS A 65 50.573 -14.876 7.446 1.00 0.00 H new ATOM 1011 N TYR A 66 50.266 -17.589 12.456 1.00 0.00 N ATOM 1012 CA TYR A 66 50.650 -17.843 13.852 1.00 0.00 C ATOM 1013 C TYR A 66 50.713 -19.347 14.177 1.00 0.00 C ATOM 1014 O TYR A 66 51.568 -19.791 14.945 1.00 0.00 O ATOM 1015 CB TYR A 66 49.630 -17.145 14.761 1.00 0.00 C ATOM 1016 CG TYR A 66 50.099 -16.814 16.164 1.00 0.00 C ATOM 1017 CD1 TYR A 66 50.878 -15.662 16.388 1.00 0.00 C ATOM 1018 CD2 TYR A 66 49.642 -17.570 17.259 1.00 0.00 C ATOM 1019 CE1 TYR A 66 51.120 -15.222 17.703 1.00 0.00 C ATOM 1020 CE2 TYR A 66 49.891 -17.138 18.574 1.00 0.00 C ATOM 1021 CZ TYR A 66 50.620 -15.954 18.800 1.00 0.00 C ATOM 1022 OH TYR A 66 50.825 -15.518 20.071 1.00 0.00 O ATOM 0 H TYR A 66 49.422 -17.023 12.374 1.00 0.00 H new ATOM 0 HA TYR A 66 51.652 -17.448 14.018 1.00 0.00 H new ATOM 0 HB2 TYR A 66 49.317 -16.220 14.277 1.00 0.00 H new ATOM 0 HB3 TYR A 66 48.747 -17.780 14.836 1.00 0.00 H new ATOM 0 HD1 TYR A 66 51.289 -15.117 15.551 1.00 0.00 H new ATOM 0 HD2 TYR A 66 49.097 -18.487 17.089 1.00 0.00 H new ATOM 0 HE1 TYR A 66 51.691 -14.321 17.873 1.00 0.00 H new ATOM 0 HE2 TYR A 66 49.523 -17.714 19.410 1.00 0.00 H new ATOM 0 HH TYR A 66 50.411 -16.143 20.702 1.00 0.00 H new ATOM 1032 N HIS A 67 49.823 -20.133 13.561 1.00 0.00 N ATOM 1033 CA HIS A 67 49.757 -21.587 13.684 1.00 0.00 C ATOM 1034 C HIS A 67 50.748 -22.280 12.720 1.00 0.00 C ATOM 1035 O HIS A 67 51.639 -23.007 13.161 1.00 0.00 O ATOM 1036 CB HIS A 67 48.298 -22.016 13.418 1.00 0.00 C ATOM 1037 CG HIS A 67 48.134 -23.504 13.241 1.00 0.00 C ATOM 1038 ND1 HIS A 67 48.018 -24.444 14.243 1.00 0.00 N ATOM 1039 CD2 HIS A 67 48.267 -24.186 12.059 1.00 0.00 C ATOM 1040 CE1 HIS A 67 48.131 -25.663 13.682 1.00 0.00 C ATOM 1041 NE2 HIS A 67 48.296 -25.551 12.354 1.00 0.00 N ATOM 0 H HIS A 67 49.105 -19.757 12.942 1.00 0.00 H new ATOM 0 HA HIS A 67 50.052 -21.894 14.687 1.00 0.00 H new ATOM 0 HB2 HIS A 67 47.673 -21.685 14.247 1.00 0.00 H new ATOM 0 HB3 HIS A 67 47.935 -21.509 12.524 1.00 0.00 H new ATOM 0 HD1 HIS A 67 47.872 -24.250 15.234 1.00 0.00 H new ATOM 0 HD2 HIS A 67 48.337 -23.746 11.075 1.00 0.00 H new ATOM 0 HE1 HIS A 67 48.094 -26.597 14.223 1.00 0.00 H new ATOM 1049 N ALA A 68 50.607 -22.038 11.412 1.00 0.00 N ATOM 1050 CA ALA A 68 51.354 -22.639 10.306 1.00 0.00 C ATOM 1051 C ALA A 68 52.880 -22.631 10.455 1.00 0.00 C ATOM 1052 O ALA A 68 53.540 -23.587 10.040 1.00 0.00 O ATOM 1053 CB ALA A 68 50.938 -21.928 9.014 1.00 0.00 C ATOM 0 H ALA A 68 49.916 -21.367 11.076 1.00 0.00 H new ATOM 0 HA ALA A 68 51.097 -23.698 10.294 1.00 0.00 H new ATOM 0 HB1 ALA A 68 51.481 -22.357 8.172 1.00 0.00 H new ATOM 0 HB2 ALA A 68 49.867 -22.055 8.858 1.00 0.00 H new ATOM 0 HB3 ALA A 68 51.170 -20.866 9.092 1.00 0.00 H new ATOM 1059 N LYS A 69 53.453 -21.571 11.043 1.00 0.00 N ATOM 1060 CA LYS A 69 54.904 -21.465 11.258 1.00 0.00 C ATOM 1061 C LYS A 69 55.459 -22.586 12.135 1.00 0.00 C ATOM 1062 O LYS A 69 56.368 -23.313 11.733 1.00 0.00 O ATOM 1063 CB LYS A 69 55.259 -20.082 11.820 1.00 0.00 C ATOM 1064 CG LYS A 69 54.616 -19.604 13.139 1.00 0.00 C ATOM 1065 CD LYS A 69 54.789 -18.087 13.372 1.00 0.00 C ATOM 1066 CE LYS A 69 56.249 -17.599 13.342 1.00 0.00 C ATOM 1067 NZ LYS A 69 57.066 -18.148 14.461 1.00 0.00 N ATOM 0 H LYS A 69 52.926 -20.766 11.382 1.00 0.00 H new ATOM 0 HA LYS A 69 55.384 -21.582 10.286 1.00 0.00 H new ATOM 0 HB2 LYS A 69 56.340 -20.054 11.956 1.00 0.00 H new ATOM 0 HB3 LYS A 69 55.015 -19.347 11.053 1.00 0.00 H new ATOM 0 HG2 LYS A 69 53.553 -19.847 13.129 1.00 0.00 H new ATOM 0 HG3 LYS A 69 55.060 -20.148 13.973 1.00 0.00 H new ATOM 0 HD2 LYS A 69 54.224 -17.549 12.611 1.00 0.00 H new ATOM 0 HD3 LYS A 69 54.352 -17.828 14.337 1.00 0.00 H new ATOM 0 HE2 LYS A 69 56.703 -17.884 12.393 1.00 0.00 H new ATOM 0 HE3 LYS A 69 56.264 -16.510 13.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 58.039 -17.786 14.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 56.652 -17.855 15.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 57.078 -19.186 14.405 1.00 0.00 H new ATOM 1081 N HIS A 70 54.869 -22.707 13.319 1.00 0.00 N ATOM 1082 CA HIS A 70 55.188 -23.702 14.345 1.00 0.00 C ATOM 1083 C HIS A 70 54.654 -25.099 13.969 1.00 0.00 C ATOM 1084 O HIS A 70 55.193 -26.111 14.430 1.00 0.00 O ATOM 1085 CB HIS A 70 54.603 -23.213 15.684 1.00 0.00 C ATOM 1086 CG HIS A 70 55.174 -23.867 16.923 1.00 0.00 C ATOM 1087 ND1 HIS A 70 55.578 -25.177 17.063 1.00 0.00 N ATOM 1088 CD2 HIS A 70 55.375 -23.263 18.138 1.00 0.00 C ATOM 1089 CE1 HIS A 70 56.016 -25.360 18.320 1.00 0.00 C ATOM 1090 NE2 HIS A 70 55.910 -24.214 19.018 1.00 0.00 N ATOM 0 H HIS A 70 54.116 -22.083 13.607 1.00 0.00 H new ATOM 0 HA HIS A 70 56.270 -23.806 14.431 1.00 0.00 H new ATOM 0 HB2 HIS A 70 54.760 -22.137 15.757 1.00 0.00 H new ATOM 0 HB3 HIS A 70 53.526 -23.378 15.671 1.00 0.00 H new ATOM 0 HD1 HIS A 70 55.549 -25.889 16.334 1.00 0.00 H new ATOM 0 HD2 HIS A 70 55.158 -22.232 18.376 1.00 0.00 H new ATOM 0 HE1 HIS A 70 56.397 -26.291 18.713 1.00 0.00 H new ATOM 1098 N CYS A 71 53.622 -25.163 13.119 1.00 0.00 N ATOM 1099 CA CYS A 71 53.050 -26.429 12.646 1.00 0.00 C ATOM 1100 C CYS A 71 54.063 -27.168 11.748 1.00 0.00 C ATOM 1101 O CYS A 71 54.906 -26.547 11.089 1.00 0.00 O ATOM 1102 CB CYS A 71 51.728 -26.157 11.916 1.00 0.00 C ATOM 1103 SG CYS A 71 50.784 -27.695 11.607 1.00 0.00 S ATOM 0 H CYS A 71 53.159 -24.337 12.739 1.00 0.00 H new ATOM 0 HA CYS A 71 52.836 -27.077 13.496 1.00 0.00 H new ATOM 0 HB2 CYS A 71 51.121 -25.472 12.509 1.00 0.00 H new ATOM 0 HB3 CYS A 71 51.933 -25.661 10.967 1.00 0.00 H new ATOM 1108 N GLN A 72 53.974 -28.499 11.707 1.00 0.00 N ATOM 1109 CA GLN A 72 54.855 -29.366 10.912 1.00 0.00 C ATOM 1110 C GLN A 72 54.106 -30.473 10.144 1.00 0.00 C ATOM 1111 O GLN A 72 54.728 -31.239 9.405 1.00 0.00 O ATOM 1112 CB GLN A 72 55.947 -29.977 11.817 1.00 0.00 C ATOM 1113 CG GLN A 72 56.862 -28.935 12.481 1.00 0.00 C ATOM 1114 CD GLN A 72 57.976 -29.597 13.289 1.00 0.00 C ATOM 1115 OE1 GLN A 72 57.758 -30.195 14.336 1.00 0.00 O ATOM 1116 NE2 GLN A 72 59.214 -29.528 12.843 1.00 0.00 N ATOM 0 H GLN A 72 53.273 -29.018 12.236 1.00 0.00 H new ATOM 0 HA GLN A 72 55.312 -28.733 10.152 1.00 0.00 H new ATOM 0 HB2 GLN A 72 55.469 -30.574 12.594 1.00 0.00 H new ATOM 0 HB3 GLN A 72 56.558 -30.657 11.224 1.00 0.00 H new ATOM 0 HG2 GLN A 72 57.299 -28.294 11.716 1.00 0.00 H new ATOM 0 HG3 GLN A 72 56.270 -28.294 13.134 1.00 0.00 H new ATOM 0 HE21 GLN A 72 59.416 -29.035 11.973 1.00 0.00 H new ATOM 0 HE22 GLN A 72 59.970 -29.968 13.367 1.00 0.00 H new ATOM 1125 N GLU A 73 52.780 -30.567 10.281 1.00 0.00 N ATOM 1126 CA GLU A 73 51.960 -31.555 9.570 1.00 0.00 C ATOM 1127 C GLU A 73 51.781 -31.170 8.088 1.00 0.00 C ATOM 1128 O GLU A 73 51.821 -29.989 7.724 1.00 0.00 O ATOM 1129 CB GLU A 73 50.611 -31.690 10.302 1.00 0.00 C ATOM 1130 CG GLU A 73 49.701 -32.844 9.863 1.00 0.00 C ATOM 1131 CD GLU A 73 50.416 -34.202 9.872 1.00 0.00 C ATOM 1132 OE1 GLU A 73 51.103 -34.504 8.868 1.00 0.00 O ATOM 1133 OE2 GLU A 73 50.276 -34.985 10.841 1.00 0.00 O ATOM 0 H GLU A 73 52.240 -29.955 10.893 1.00 0.00 H new ATOM 0 HA GLU A 73 52.462 -32.523 9.572 1.00 0.00 H new ATOM 0 HB2 GLU A 73 50.812 -31.802 11.368 1.00 0.00 H new ATOM 0 HB3 GLU A 73 50.061 -30.757 10.177 1.00 0.00 H new ATOM 0 HG2 GLU A 73 48.836 -32.890 10.524 1.00 0.00 H new ATOM 0 HG3 GLU A 73 49.325 -32.643 8.860 1.00 0.00 H new ATOM 1140 N ASN A 74 51.558 -32.172 7.234 1.00 0.00 N ATOM 1141 CA ASN A 74 51.384 -32.021 5.777 1.00 0.00 C ATOM 1142 C ASN A 74 49.936 -32.281 5.307 1.00 0.00 C ATOM 1143 O ASN A 74 49.606 -32.086 4.136 1.00 0.00 O ATOM 1144 CB ASN A 74 52.397 -32.937 5.066 1.00 0.00 C ATOM 1145 CG ASN A 74 53.837 -32.514 5.318 1.00 0.00 C ATOM 1146 OD1 ASN A 74 54.280 -31.454 4.898 1.00 0.00 O ATOM 1147 ND2 ASN A 74 54.618 -33.323 5.998 1.00 0.00 N ATOM 0 H ASN A 74 51.491 -33.142 7.541 1.00 0.00 H new ATOM 0 HA ASN A 74 51.578 -30.982 5.511 1.00 0.00 H new ATOM 0 HB2 ASN A 74 52.257 -33.963 5.407 1.00 0.00 H new ATOM 0 HB3 ASN A 74 52.201 -32.928 3.994 1.00 0.00 H new ATOM 0 HD21 ASN A 74 55.589 -33.066 6.174 1.00 0.00 H new ATOM 0 HD22 ASN A 74 54.253 -34.208 6.350 1.00 0.00 H new ATOM 1154 N LYS A 75 49.081 -32.724 6.236 1.00 0.00 N ATOM 1155 CA LYS A 75 47.663 -33.086 6.074 1.00 0.00 C ATOM 1156 C LYS A 75 46.731 -32.306 7.028 1.00 0.00 C ATOM 1157 O LYS A 75 45.603 -32.733 7.284 1.00 0.00 O ATOM 1158 CB LYS A 75 47.523 -34.612 6.272 1.00 0.00 C ATOM 1159 CG LYS A 75 48.518 -35.445 5.435 1.00 0.00 C ATOM 1160 CD LYS A 75 49.754 -35.967 6.183 1.00 0.00 C ATOM 1161 CE LYS A 75 49.425 -36.931 7.332 1.00 0.00 C ATOM 1162 NZ LYS A 75 50.623 -37.168 8.178 1.00 0.00 N ATOM 0 H LYS A 75 49.386 -32.850 7.201 1.00 0.00 H new ATOM 0 HA LYS A 75 47.347 -32.808 5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 75 47.665 -34.846 7.327 1.00 0.00 H new ATOM 0 HB3 LYS A 75 46.507 -34.910 6.014 1.00 0.00 H new ATOM 0 HG2 LYS A 75 47.984 -36.298 5.016 1.00 0.00 H new ATOM 0 HG3 LYS A 75 48.856 -34.836 4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 75 50.409 -36.473 5.474 1.00 0.00 H new ATOM 0 HD3 LYS A 75 50.310 -35.119 6.582 1.00 0.00 H new ATOM 0 HE2 LYS A 75 48.620 -36.518 7.940 1.00 0.00 H new ATOM 0 HE3 LYS A 75 49.066 -37.878 6.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 50.371 -37.795 8.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 51.369 -37.613 7.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 50.969 -36.261 8.552 1.00 0.00 H new ATOM 1176 N CYS A 76 47.218 -31.184 7.568 1.00 0.00 N ATOM 1177 CA CYS A 76 46.521 -30.298 8.506 1.00 0.00 C ATOM 1178 C CYS A 76 45.139 -29.865 7.928 1.00 0.00 C ATOM 1179 O CYS A 76 45.052 -29.573 6.728 1.00 0.00 O ATOM 1180 CB CYS A 76 47.484 -29.123 8.787 1.00 0.00 C ATOM 1181 SG CYS A 76 47.283 -28.408 10.450 1.00 0.00 S ATOM 0 H CYS A 76 48.158 -30.852 7.351 1.00 0.00 H new ATOM 0 HA CYS A 76 46.280 -30.791 9.448 1.00 0.00 H new ATOM 0 HB2 CYS A 76 48.511 -29.468 8.669 1.00 0.00 H new ATOM 0 HB3 CYS A 76 47.322 -28.344 8.042 1.00 0.00 H new ATOM 1186 N PRO A 77 44.037 -29.850 8.712 1.00 0.00 N ATOM 1187 CA PRO A 77 42.697 -29.555 8.194 1.00 0.00 C ATOM 1188 C PRO A 77 42.470 -28.107 7.730 1.00 0.00 C ATOM 1189 O PRO A 77 41.609 -27.875 6.878 1.00 0.00 O ATOM 1190 CB PRO A 77 41.734 -29.928 9.325 1.00 0.00 C ATOM 1191 CG PRO A 77 42.578 -29.761 10.587 1.00 0.00 C ATOM 1192 CD PRO A 77 43.968 -30.189 10.124 1.00 0.00 C ATOM 0 HA PRO A 77 42.538 -30.129 7.281 1.00 0.00 H new ATOM 0 HB2 PRO A 77 40.860 -29.277 9.338 1.00 0.00 H new ATOM 0 HB3 PRO A 77 41.369 -30.950 9.220 1.00 0.00 H new ATOM 0 HG2 PRO A 77 42.570 -28.732 10.945 1.00 0.00 H new ATOM 0 HG3 PRO A 77 42.213 -30.385 11.403 1.00 0.00 H new ATOM 0 HD2 PRO A 77 44.744 -29.673 10.688 1.00 0.00 H new ATOM 0 HD3 PRO A 77 44.120 -31.257 10.277 1.00 0.00 H new ATOM 1200 N VAL A 78 43.212 -27.130 8.263 1.00 0.00 N ATOM 1201 CA VAL A 78 43.087 -25.709 7.891 1.00 0.00 C ATOM 1202 C VAL A 78 43.505 -25.519 6.421 1.00 0.00 C ATOM 1203 O VAL A 78 44.601 -25.953 6.054 1.00 0.00 O ATOM 1204 CB VAL A 78 43.940 -24.828 8.823 1.00 0.00 C ATOM 1205 CG1 VAL A 78 43.747 -23.336 8.531 1.00 0.00 C ATOM 1206 CG2 VAL A 78 43.570 -25.047 10.298 1.00 0.00 C ATOM 0 H VAL A 78 43.925 -27.301 8.972 1.00 0.00 H new ATOM 0 HA VAL A 78 42.047 -25.402 8.002 1.00 0.00 H new ATOM 0 HB VAL A 78 44.974 -25.119 8.638 1.00 0.00 H new ATOM 0 HG11 VAL A 78 44.366 -22.749 9.210 1.00 0.00 H new ATOM 0 HG12 VAL A 78 44.038 -23.126 7.502 1.00 0.00 H new ATOM 0 HG13 VAL A 78 42.700 -23.070 8.673 1.00 0.00 H new ATOM 0 HG21 VAL A 78 44.191 -24.410 10.927 1.00 0.00 H new ATOM 0 HG22 VAL A 78 42.520 -24.796 10.451 1.00 0.00 H new ATOM 0 HG23 VAL A 78 43.736 -26.091 10.563 1.00 0.00 H new ATOM 1216 N PRO A 79 42.688 -24.878 5.556 1.00 0.00 N ATOM 1217 CA PRO A 79 43.027 -24.727 4.135 1.00 0.00 C ATOM 1218 C PRO A 79 44.264 -23.850 3.883 1.00 0.00 C ATOM 1219 O PRO A 79 44.972 -24.048 2.893 1.00 0.00 O ATOM 1220 CB PRO A 79 41.768 -24.155 3.470 1.00 0.00 C ATOM 1221 CG PRO A 79 41.043 -23.437 4.607 1.00 0.00 C ATOM 1222 CD PRO A 79 41.380 -24.288 5.830 1.00 0.00 C ATOM 0 HA PRO A 79 43.310 -25.690 3.711 1.00 0.00 H new ATOM 0 HB2 PRO A 79 42.020 -23.469 2.661 1.00 0.00 H new ATOM 0 HB3 PRO A 79 41.151 -24.943 3.038 1.00 0.00 H new ATOM 0 HG2 PRO A 79 41.392 -22.411 4.722 1.00 0.00 H new ATOM 0 HG3 PRO A 79 39.968 -23.390 4.433 1.00 0.00 H new ATOM 0 HD2 PRO A 79 41.407 -23.680 6.734 1.00 0.00 H new ATOM 0 HD3 PRO A 79 40.628 -25.061 5.988 1.00 0.00 H new ATOM 1230 N PHE A 80 44.538 -22.888 4.770 1.00 0.00 N ATOM 1231 CA PHE A 80 45.673 -21.970 4.647 1.00 0.00 C ATOM 1232 C PHE A 80 46.978 -22.431 5.301 1.00 0.00 C ATOM 1233 O PHE A 80 48.028 -21.977 4.856 1.00 0.00 O ATOM 1234 CB PHE A 80 45.271 -20.592 5.175 1.00 0.00 C ATOM 1235 CG PHE A 80 44.615 -19.761 4.098 1.00 0.00 C ATOM 1236 CD1 PHE A 80 45.419 -19.145 3.121 1.00 0.00 C ATOM 1237 CD2 PHE A 80 43.217 -19.660 4.030 1.00 0.00 C ATOM 1238 CE1 PHE A 80 44.823 -18.410 2.082 1.00 0.00 C ATOM 1239 CE2 PHE A 80 42.619 -18.925 2.990 1.00 0.00 C ATOM 1240 CZ PHE A 80 43.422 -18.297 2.019 1.00 0.00 C ATOM 0 H PHE A 80 43.971 -22.724 5.602 1.00 0.00 H new ATOM 0 HA PHE A 80 45.903 -21.937 3.582 1.00 0.00 H new ATOM 0 HB2 PHE A 80 44.587 -20.708 6.015 1.00 0.00 H new ATOM 0 HB3 PHE A 80 46.153 -20.073 5.551 1.00 0.00 H new ATOM 0 HD1 PHE A 80 46.494 -19.237 3.170 1.00 0.00 H new ATOM 0 HD2 PHE A 80 42.602 -20.145 4.774 1.00 0.00 H new ATOM 0 HE1 PHE A 80 45.439 -17.933 1.334 1.00 0.00 H new ATOM 0 HE2 PHE A 80 41.543 -18.843 2.937 1.00 0.00 H new ATOM 0 HZ PHE A 80 42.962 -17.728 1.225 1.00 0.00 H new ATOM 1250 N CYS A 81 46.956 -23.308 6.309 1.00 0.00 N ATOM 1251 CA CYS A 81 48.167 -23.794 6.988 1.00 0.00 C ATOM 1252 C CYS A 81 49.235 -24.288 5.985 1.00 0.00 C ATOM 1253 O CYS A 81 50.363 -23.782 5.948 1.00 0.00 O ATOM 1254 CB CYS A 81 47.738 -24.851 8.021 1.00 0.00 C ATOM 1255 SG CYS A 81 49.136 -25.589 8.926 1.00 0.00 S ATOM 0 H CYS A 81 46.093 -23.705 6.681 1.00 0.00 H new ATOM 0 HA CYS A 81 48.662 -22.980 7.517 1.00 0.00 H new ATOM 0 HB2 CYS A 81 47.054 -24.393 8.735 1.00 0.00 H new ATOM 0 HB3 CYS A 81 47.186 -25.642 7.513 1.00 0.00 H new ATOM 1260 N LEU A 82 48.850 -25.211 5.094 1.00 0.00 N ATOM 1261 CA LEU A 82 49.734 -25.729 4.039 1.00 0.00 C ATOM 1262 C LEU A 82 50.115 -24.641 3.020 1.00 0.00 C ATOM 1263 O LEU A 82 51.286 -24.504 2.665 1.00 0.00 O ATOM 1264 CB LEU A 82 49.089 -26.933 3.321 1.00 0.00 C ATOM 1265 CG LEU A 82 48.817 -28.209 4.147 1.00 0.00 C ATOM 1266 CD1 LEU A 82 49.949 -28.567 5.112 1.00 0.00 C ATOM 1267 CD2 LEU A 82 47.515 -28.145 4.943 1.00 0.00 C ATOM 0 H LEU A 82 47.916 -25.621 5.083 1.00 0.00 H new ATOM 0 HA LEU A 82 50.651 -26.061 4.526 1.00 0.00 H new ATOM 0 HB2 LEU A 82 48.141 -26.601 2.898 1.00 0.00 H new ATOM 0 HB3 LEU A 82 49.733 -27.207 2.485 1.00 0.00 H new ATOM 0 HG LEU A 82 48.739 -28.988 3.389 1.00 0.00 H new ATOM 0 HD11 LEU A 82 49.688 -29.474 5.658 1.00 0.00 H new ATOM 0 HD12 LEU A 82 50.868 -28.734 4.549 1.00 0.00 H new ATOM 0 HD13 LEU A 82 50.098 -27.749 5.817 1.00 0.00 H new ATOM 0 HD21 LEU A 82 47.384 -29.072 5.501 1.00 0.00 H new ATOM 0 HD22 LEU A 82 47.554 -27.306 5.638 1.00 0.00 H new ATOM 0 HD23 LEU A 82 46.677 -28.011 4.259 1.00 0.00 H new ATOM 1279 N ASN A 83 49.137 -23.842 2.581 1.00 0.00 N ATOM 1280 CA ASN A 83 49.320 -22.738 1.631 1.00 0.00 C ATOM 1281 C ASN A 83 50.395 -21.738 2.108 1.00 0.00 C ATOM 1282 O ASN A 83 51.254 -21.306 1.335 1.00 0.00 O ATOM 1283 CB ASN A 83 47.947 -22.073 1.422 1.00 0.00 C ATOM 1284 CG ASN A 83 47.852 -21.236 0.160 1.00 0.00 C ATOM 1285 OD1 ASN A 83 48.819 -20.964 -0.537 1.00 0.00 O ATOM 1286 ND2 ASN A 83 46.660 -20.822 -0.189 1.00 0.00 N ATOM 0 H ASN A 83 48.169 -23.948 2.885 1.00 0.00 H new ATOM 0 HA ASN A 83 49.691 -23.118 0.679 1.00 0.00 H new ATOM 0 HB2 ASN A 83 47.181 -22.848 1.390 1.00 0.00 H new ATOM 0 HB3 ASN A 83 47.726 -21.441 2.282 1.00 0.00 H new ATOM 0 HD21 ASN A 83 46.540 -20.274 -1.041 1.00 0.00 H new ATOM 0 HD22 ASN A 83 45.852 -21.048 0.391 1.00 0.00 H new ATOM 1293 N ILE A 84 50.368 -21.393 3.400 1.00 0.00 N ATOM 1294 CA ILE A 84 51.323 -20.500 4.059 1.00 0.00 C ATOM 1295 C ILE A 84 52.681 -21.193 4.210 1.00 0.00 C ATOM 1296 O ILE A 84 53.687 -20.610 3.806 1.00 0.00 O ATOM 1297 CB ILE A 84 50.718 -20.014 5.397 1.00 0.00 C ATOM 1298 CG1 ILE A 84 49.498 -19.109 5.111 1.00 0.00 C ATOM 1299 CG2 ILE A 84 51.708 -19.251 6.296 1.00 0.00 C ATOM 1300 CD1 ILE A 84 48.595 -18.933 6.328 1.00 0.00 C ATOM 0 H ILE A 84 49.653 -21.742 4.038 1.00 0.00 H new ATOM 0 HA ILE A 84 51.509 -19.615 3.451 1.00 0.00 H new ATOM 0 HB ILE A 84 50.431 -20.913 5.943 1.00 0.00 H new ATOM 0 HG12 ILE A 84 49.847 -18.131 4.778 1.00 0.00 H new ATOM 0 HG13 ILE A 84 48.918 -19.536 4.293 1.00 0.00 H new ATOM 0 HG21 ILE A 84 51.205 -18.945 7.213 1.00 0.00 H new ATOM 0 HG22 ILE A 84 52.550 -19.899 6.542 1.00 0.00 H new ATOM 0 HG23 ILE A 84 52.071 -18.368 5.770 1.00 0.00 H new ATOM 0 HD11 ILE A 84 47.755 -18.288 6.068 1.00 0.00 H new ATOM 0 HD12 ILE A 84 48.220 -19.906 6.647 1.00 0.00 H new ATOM 0 HD13 ILE A 84 49.163 -18.479 7.140 1.00 0.00 H new ATOM 1312 N LYS A 85 52.741 -22.438 4.714 1.00 0.00 N ATOM 1313 CA LYS A 85 54.000 -23.206 4.853 1.00 0.00 C ATOM 1314 C LYS A 85 54.809 -23.218 3.563 1.00 0.00 C ATOM 1315 O LYS A 85 55.998 -22.921 3.583 1.00 0.00 O ATOM 1316 CB LYS A 85 53.706 -24.662 5.253 1.00 0.00 C ATOM 1317 CG LYS A 85 53.422 -24.818 6.745 1.00 0.00 C ATOM 1318 CD LYS A 85 52.768 -26.179 7.003 1.00 0.00 C ATOM 1319 CE LYS A 85 52.590 -26.397 8.501 1.00 0.00 C ATOM 1320 NZ LYS A 85 51.496 -27.341 8.776 1.00 0.00 N ATOM 0 H LYS A 85 51.918 -22.945 5.039 1.00 0.00 H new ATOM 0 HA LYS A 85 54.581 -22.709 5.630 1.00 0.00 H new ATOM 0 HB2 LYS A 85 52.850 -25.025 4.685 1.00 0.00 H new ATOM 0 HB3 LYS A 85 54.556 -25.288 4.982 1.00 0.00 H new ATOM 0 HG2 LYS A 85 54.349 -24.735 7.313 1.00 0.00 H new ATOM 0 HG3 LYS A 85 52.766 -24.017 7.087 1.00 0.00 H new ATOM 0 HD2 LYS A 85 51.801 -26.227 6.503 1.00 0.00 H new ATOM 0 HD3 LYS A 85 53.385 -26.973 6.582 1.00 0.00 H new ATOM 0 HE2 LYS A 85 53.518 -26.777 8.928 1.00 0.00 H new ATOM 0 HE3 LYS A 85 52.382 -25.444 8.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 51.442 -27.522 9.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 50.596 -26.935 8.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 51.675 -28.235 8.275 1.00 0.00 H new ATOM 1334 N HIS A 86 54.163 -23.520 2.441 1.00 0.00 N ATOM 1335 CA HIS A 86 54.798 -23.560 1.119 1.00 0.00 C ATOM 1336 C HIS A 86 55.544 -22.264 0.740 1.00 0.00 C ATOM 1337 O HIS A 86 56.557 -22.324 0.043 1.00 0.00 O ATOM 1338 CB HIS A 86 53.723 -23.865 0.069 1.00 0.00 C ATOM 1339 CG HIS A 86 53.065 -25.225 0.160 1.00 0.00 C ATOM 1340 ND1 HIS A 86 51.936 -25.613 -0.529 1.00 0.00 N ATOM 1341 CD2 HIS A 86 53.460 -26.305 0.910 1.00 0.00 C ATOM 1342 CE1 HIS A 86 51.654 -26.886 -0.201 1.00 0.00 C ATOM 1343 NE2 HIS A 86 52.560 -27.356 0.675 1.00 0.00 N ATOM 0 H HIS A 86 53.169 -23.748 2.420 1.00 0.00 H new ATOM 0 HA HIS A 86 55.558 -24.341 1.153 1.00 0.00 H new ATOM 0 HB2 HIS A 86 52.947 -23.103 0.143 1.00 0.00 H new ATOM 0 HB3 HIS A 86 54.172 -23.768 -0.919 1.00 0.00 H new ATOM 0 HD2 HIS A 86 54.316 -26.340 1.568 1.00 0.00 H new ATOM 0 HE1 HIS A 86 50.818 -27.451 -0.586 1.00 0.00 H new ATOM 0 HE2 HIS A 86 52.587 -28.289 1.086 1.00 0.00 H new ATOM 1351 N LYS A 87 55.081 -21.100 1.217 1.00 0.00 N ATOM 1352 CA LYS A 87 55.725 -19.794 0.997 1.00 0.00 C ATOM 1353 C LYS A 87 56.744 -19.465 2.095 1.00 0.00 C ATOM 1354 O LYS A 87 57.828 -18.971 1.789 1.00 0.00 O ATOM 1355 CB LYS A 87 54.636 -18.711 0.890 1.00 0.00 C ATOM 1356 CG LYS A 87 54.079 -18.644 -0.542 1.00 0.00 C ATOM 1357 CD LYS A 87 52.827 -17.758 -0.655 1.00 0.00 C ATOM 1358 CE LYS A 87 51.539 -18.464 -0.215 1.00 0.00 C ATOM 1359 NZ LYS A 87 51.129 -19.518 -1.173 1.00 0.00 N ATOM 0 H LYS A 87 54.231 -21.037 1.778 1.00 0.00 H new ATOM 0 HA LYS A 87 56.288 -19.830 0.064 1.00 0.00 H new ATOM 0 HB2 LYS A 87 53.829 -18.928 1.590 1.00 0.00 H new ATOM 0 HB3 LYS A 87 55.050 -17.742 1.171 1.00 0.00 H new ATOM 0 HG2 LYS A 87 54.851 -18.261 -1.209 1.00 0.00 H new ATOM 0 HG3 LYS A 87 53.837 -19.652 -0.880 1.00 0.00 H new ATOM 0 HD2 LYS A 87 52.968 -16.864 -0.048 1.00 0.00 H new ATOM 0 HD3 LYS A 87 52.717 -17.428 -1.688 1.00 0.00 H new ATOM 0 HE2 LYS A 87 51.687 -18.907 0.770 1.00 0.00 H new ATOM 0 HE3 LYS A 87 50.738 -17.731 -0.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 50.195 -19.888 -0.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 51.078 -19.116 -2.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 51.825 -20.290 -1.158 1.00 0.00 H new ATOM 1373 N LEU A 88 56.428 -19.759 3.359 1.00 0.00 N ATOM 1374 CA LEU A 88 57.320 -19.496 4.503 1.00 0.00 C ATOM 1375 C LEU A 88 58.584 -20.372 4.522 1.00 0.00 C ATOM 1376 O LEU A 88 59.673 -19.862 4.792 1.00 0.00 O ATOM 1377 CB LEU A 88 56.543 -19.667 5.824 1.00 0.00 C ATOM 1378 CG LEU A 88 55.867 -18.384 6.335 1.00 0.00 C ATOM 1379 CD1 LEU A 88 54.864 -17.780 5.350 1.00 0.00 C ATOM 1380 CD2 LEU A 88 55.171 -18.700 7.660 1.00 0.00 C ATOM 0 H LEU A 88 55.542 -20.189 3.624 1.00 0.00 H new ATOM 0 HA LEU A 88 57.664 -18.468 4.392 1.00 0.00 H new ATOM 0 HB2 LEU A 88 55.781 -20.434 5.686 1.00 0.00 H new ATOM 0 HB3 LEU A 88 57.228 -20.032 6.589 1.00 0.00 H new ATOM 0 HG LEU A 88 56.647 -17.633 6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 88 54.429 -16.878 5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 88 55.374 -17.528 4.420 1.00 0.00 H new ATOM 0 HD13 LEU A 88 54.074 -18.503 5.146 1.00 0.00 H new ATOM 0 HD21 LEU A 88 54.685 -17.801 8.039 1.00 0.00 H new ATOM 0 HD22 LEU A 88 54.424 -19.478 7.502 1.00 0.00 H new ATOM 0 HD23 LEU A 88 55.908 -19.047 8.384 1.00 0.00 H new ATOM 1392 N ARG A 89 58.461 -21.674 4.240 1.00 0.00 N ATOM 1393 CA ARG A 89 59.574 -22.647 4.234 1.00 0.00 C ATOM 1394 C ARG A 89 60.611 -22.384 3.135 1.00 0.00 C ATOM 1395 O ARG A 89 61.786 -22.707 3.306 1.00 0.00 O ATOM 1396 CB ARG A 89 59.004 -24.072 4.084 1.00 0.00 C ATOM 1397 CG ARG A 89 58.168 -24.554 5.282 1.00 0.00 C ATOM 1398 CD ARG A 89 58.964 -24.701 6.588 1.00 0.00 C ATOM 1399 NE ARG A 89 58.276 -25.619 7.521 1.00 0.00 N ATOM 1400 CZ ARG A 89 57.549 -25.341 8.590 1.00 0.00 C ATOM 1401 NH1 ARG A 89 57.361 -24.133 9.040 1.00 0.00 N ATOM 1402 NH2 ARG A 89 56.983 -26.314 9.238 1.00 0.00 N ATOM 0 H ARG A 89 57.564 -22.097 4.003 1.00 0.00 H new ATOM 0 HA ARG A 89 60.097 -22.536 5.184 1.00 0.00 H new ATOM 0 HB2 ARG A 89 58.386 -24.110 3.187 1.00 0.00 H new ATOM 0 HB3 ARG A 89 59.830 -24.766 3.931 1.00 0.00 H new ATOM 0 HG2 ARG A 89 57.350 -23.852 5.445 1.00 0.00 H new ATOM 0 HG3 ARG A 89 57.719 -25.515 5.034 1.00 0.00 H new ATOM 0 HD2 ARG A 89 59.963 -25.078 6.370 1.00 0.00 H new ATOM 0 HD3 ARG A 89 59.087 -23.724 7.056 1.00 0.00 H new ATOM 0 HE ARG A 89 58.377 -26.612 7.309 1.00 0.00 H new ATOM 0 HH11 ARG A 89 57.786 -23.339 8.561 1.00 0.00 H new ATOM 0 HH12 ARG A 89 56.789 -23.982 9.871 1.00 0.00 H new ATOM 0 HH21 ARG A 89 57.103 -27.276 8.920 1.00 0.00 H new ATOM 0 HH22 ARG A 89 56.419 -26.116 10.065 1.00 0.00 H new ATOM 1416 N GLN A 90 60.178 -21.793 2.020 1.00 0.00 N ATOM 1417 CA GLN A 90 61.023 -21.460 0.861 1.00 0.00 C ATOM 1418 C GLN A 90 61.859 -20.171 1.022 1.00 0.00 C ATOM 1419 O GLN A 90 62.669 -19.861 0.145 1.00 0.00 O ATOM 1420 CB GLN A 90 60.141 -21.390 -0.402 1.00 0.00 C ATOM 1421 CG GLN A 90 59.595 -22.762 -0.837 1.00 0.00 C ATOM 1422 CD GLN A 90 60.689 -23.709 -1.330 1.00 0.00 C ATOM 1423 OE1 GLN A 90 61.207 -24.544 -0.597 1.00 0.00 O ATOM 1424 NE2 GLN A 90 61.090 -23.621 -2.581 1.00 0.00 N ATOM 0 H GLN A 90 59.203 -21.523 1.890 1.00 0.00 H new ATOM 0 HA GLN A 90 61.761 -22.258 0.773 1.00 0.00 H new ATOM 0 HB2 GLN A 90 59.305 -20.716 -0.217 1.00 0.00 H new ATOM 0 HB3 GLN A 90 60.721 -20.961 -1.219 1.00 0.00 H new ATOM 0 HG2 GLN A 90 59.074 -23.223 0.002 1.00 0.00 H new ATOM 0 HG3 GLN A 90 58.860 -22.620 -1.629 1.00 0.00 H new ATOM 0 HE21 GLN A 90 60.669 -22.932 -3.204 1.00 0.00 H new ATOM 0 HE22 GLN A 90 61.821 -24.242 -2.927 1.00 0.00 H new ATOM 1433 N GLN A 91 61.700 -19.416 2.118 1.00 0.00 N ATOM 1434 CA GLN A 91 62.474 -18.192 2.384 1.00 0.00 C ATOM 1435 C GLN A 91 63.986 -18.470 2.514 1.00 0.00 C ATOM 1436 O GLN A 91 64.409 -19.534 2.978 1.00 0.00 O ATOM 1437 CB GLN A 91 61.960 -17.513 3.663 1.00 0.00 C ATOM 1438 CG GLN A 91 60.557 -16.910 3.499 1.00 0.00 C ATOM 1439 CD GLN A 91 60.066 -16.305 4.811 1.00 0.00 C ATOM 1440 OE1 GLN A 91 60.015 -15.097 4.999 1.00 0.00 O ATOM 1441 NE2 GLN A 91 59.711 -17.123 5.780 1.00 0.00 N ATOM 0 H GLN A 91 61.026 -19.638 2.851 1.00 0.00 H new ATOM 0 HA GLN A 91 62.335 -17.530 1.529 1.00 0.00 H new ATOM 0 HB2 GLN A 91 61.944 -18.242 4.473 1.00 0.00 H new ATOM 0 HB3 GLN A 91 62.656 -16.726 3.955 1.00 0.00 H new ATOM 0 HG2 GLN A 91 60.575 -16.143 2.725 1.00 0.00 H new ATOM 0 HG3 GLN A 91 59.862 -17.681 3.167 1.00 0.00 H new ATOM 0 HE21 GLN A 91 59.749 -18.132 5.635 1.00 0.00 H new ATOM 0 HE22 GLN A 91 59.398 -16.748 6.675 1.00 0.00 H new ATOM 1450 N GLN A 92 64.810 -17.492 2.124 1.00 0.00 N ATOM 1451 CA GLN A 92 66.278 -17.547 2.178 1.00 0.00 C ATOM 1452 C GLN A 92 66.798 -17.755 3.613 1.00 0.00 C ATOM 1453 O GLN A 92 66.498 -16.975 4.528 1.00 0.00 O ATOM 1454 CB GLN A 92 66.884 -16.272 1.553 1.00 0.00 C ATOM 1455 CG GLN A 92 66.697 -16.153 0.026 1.00 0.00 C ATOM 1456 CD GLN A 92 65.271 -15.844 -0.442 1.00 0.00 C ATOM 1457 OE1 GLN A 92 64.434 -15.308 0.275 1.00 0.00 O ATOM 1458 NE2 GLN A 92 64.927 -16.179 -1.669 1.00 0.00 N ATOM 0 H GLN A 92 64.463 -16.609 1.749 1.00 0.00 H new ATOM 0 HA GLN A 92 66.597 -18.412 1.596 1.00 0.00 H new ATOM 0 HB2 GLN A 92 66.435 -15.401 2.030 1.00 0.00 H new ATOM 0 HB3 GLN A 92 67.950 -16.244 1.778 1.00 0.00 H new ATOM 0 HG2 GLN A 92 67.360 -15.370 -0.344 1.00 0.00 H new ATOM 0 HG3 GLN A 92 67.018 -17.087 -0.436 1.00 0.00 H new ATOM 0 HE21 GLN A 92 65.606 -16.626 -2.285 1.00 0.00 H new ATOM 0 HE22 GLN A 92 63.982 -15.991 -2.003 1.00 0.00 H new TER 1467 GLN A 92 ATOM 1468 N GLY B 706 62.349 -2.016 3.485 1.00 0.00 N ATOM 1469 CA GLY B 706 61.268 -1.884 2.503 1.00 0.00 C ATOM 1470 C GLY B 706 60.725 -3.216 1.962 1.00 0.00 C ATOM 1471 O GLY B 706 59.759 -3.220 1.196 1.00 0.00 O ATOM 0 HA2 GLY B 706 60.447 -1.331 2.959 1.00 0.00 H new ATOM 0 HA3 GLY B 706 61.628 -1.287 1.665 1.00 0.00 H new ATOM 1475 N SER B 707 61.316 -4.348 2.361 1.00 0.00 N ATOM 1476 CA SER B 707 60.957 -5.719 1.940 1.00 0.00 C ATOM 1477 C SER B 707 59.505 -6.152 2.225 1.00 0.00 C ATOM 1478 O SER B 707 59.054 -7.164 1.686 1.00 0.00 O ATOM 1479 CB SER B 707 61.911 -6.727 2.600 1.00 0.00 C ATOM 1480 OG SER B 707 63.271 -6.387 2.359 1.00 0.00 O ATOM 0 H SER B 707 62.096 -4.339 3.018 1.00 0.00 H new ATOM 0 HA SER B 707 61.051 -5.708 0.854 1.00 0.00 H new ATOM 0 HB2 SER B 707 61.726 -6.756 3.674 1.00 0.00 H new ATOM 0 HB3 SER B 707 61.710 -7.727 2.215 1.00 0.00 H new ATOM 0 HG SER B 707 63.854 -7.045 2.792 1.00 0.00 H new ATOM 1486 N HIS B 708 58.768 -5.397 3.051 1.00 0.00 N ATOM 1487 CA HIS B 708 57.371 -5.657 3.439 1.00 0.00 C ATOM 1488 C HIS B 708 56.453 -4.431 3.211 1.00 0.00 C ATOM 1489 O HIS B 708 55.338 -4.377 3.736 1.00 0.00 O ATOM 1490 CB HIS B 708 57.339 -6.142 4.903 1.00 0.00 C ATOM 1491 CG HIS B 708 58.256 -7.311 5.189 1.00 0.00 C ATOM 1492 ND1 HIS B 708 57.952 -8.648 5.063 1.00 0.00 N ATOM 1493 CD2 HIS B 708 59.561 -7.235 5.600 1.00 0.00 C ATOM 1494 CE1 HIS B 708 59.048 -9.358 5.376 1.00 0.00 C ATOM 1495 NE2 HIS B 708 60.062 -8.539 5.708 1.00 0.00 N ATOM 0 H HIS B 708 59.142 -4.554 3.486 1.00 0.00 H new ATOM 0 HA HIS B 708 56.970 -6.440 2.795 1.00 0.00 H new ATOM 0 HB2 HIS B 708 57.612 -5.312 5.555 1.00 0.00 H new ATOM 0 HB3 HIS B 708 56.318 -6.425 5.158 1.00 0.00 H new ATOM 0 HD1 HIS B 708 57.050 -9.033 4.781 1.00 0.00 H new ATOM 0 HD2 HIS B 708 60.109 -6.327 5.805 1.00 0.00 H new ATOM 0 HE1 HIS B 708 59.107 -10.436 5.363 1.00 0.00 H new ATOM 1503 N MET B 709 56.912 -3.431 2.442 1.00 0.00 N ATOM 1504 CA MET B 709 56.165 -2.203 2.132 1.00 0.00 C ATOM 1505 C MET B 709 54.877 -2.480 1.331 1.00 0.00 C ATOM 1506 O MET B 709 54.835 -3.372 0.479 1.00 0.00 O ATOM 1507 CB MET B 709 57.100 -1.239 1.374 1.00 0.00 C ATOM 1508 CG MET B 709 56.487 0.140 1.093 1.00 0.00 C ATOM 1509 SD MET B 709 55.961 1.059 2.568 1.00 0.00 S ATOM 1510 CE MET B 709 55.267 2.532 1.768 1.00 0.00 C ATOM 0 H MET B 709 57.835 -3.455 2.008 1.00 0.00 H new ATOM 0 HA MET B 709 55.839 -1.748 3.067 1.00 0.00 H new ATOM 0 HB2 MET B 709 58.014 -1.107 1.953 1.00 0.00 H new ATOM 0 HB3 MET B 709 57.386 -1.697 0.427 1.00 0.00 H new ATOM 0 HG2 MET B 709 57.216 0.741 0.549 1.00 0.00 H new ATOM 0 HG3 MET B 709 55.626 0.012 0.437 1.00 0.00 H new ATOM 0 HE1 MET B 709 54.891 3.216 2.529 1.00 0.00 H new ATOM 0 HE2 MET B 709 56.042 3.028 1.184 1.00 0.00 H new ATOM 0 HE3 MET B 709 54.450 2.237 1.109 1.00 0.00 H new ATOM 1520 N SER B 710 53.829 -1.691 1.587 1.00 0.00 N ATOM 1521 CA SER B 710 52.518 -1.759 0.919 1.00 0.00 C ATOM 1522 C SER B 710 51.787 -0.404 0.959 1.00 0.00 C ATOM 1523 O SER B 710 52.250 0.545 1.600 1.00 0.00 O ATOM 1524 CB SER B 710 51.658 -2.867 1.553 1.00 0.00 C ATOM 1525 OG SER B 710 51.407 -2.629 2.931 1.00 0.00 O ATOM 0 H SER B 710 53.869 -0.956 2.293 1.00 0.00 H new ATOM 0 HA SER B 710 52.687 -2.002 -0.130 1.00 0.00 H new ATOM 0 HB2 SER B 710 50.710 -2.939 1.020 1.00 0.00 H new ATOM 0 HB3 SER B 710 52.162 -3.827 1.438 1.00 0.00 H new ATOM 0 HG SER B 710 50.857 -3.355 3.293 1.00 0.00 H new ATOM 1531 N GLU B 711 50.653 -0.290 0.257 1.00 0.00 N ATOM 1532 CA GLU B 711 49.847 0.944 0.200 1.00 0.00 C ATOM 1533 C GLU B 711 49.253 1.352 1.569 1.00 0.00 C ATOM 1534 O GLU B 711 49.186 0.560 2.514 1.00 0.00 O ATOM 1535 CB GLU B 711 48.730 0.808 -0.854 1.00 0.00 C ATOM 1536 CG GLU B 711 49.234 0.535 -2.281 1.00 0.00 C ATOM 1537 CD GLU B 711 50.160 1.653 -2.803 1.00 0.00 C ATOM 1538 OE1 GLU B 711 49.683 2.797 -3.008 1.00 0.00 O ATOM 1539 OE2 GLU B 711 51.370 1.398 -3.013 1.00 0.00 O ATOM 0 H GLU B 711 50.263 -1.055 -0.293 1.00 0.00 H new ATOM 0 HA GLU B 711 50.527 1.744 -0.090 1.00 0.00 H new ATOM 0 HB2 GLU B 711 48.063 -0.001 -0.556 1.00 0.00 H new ATOM 0 HB3 GLU B 711 48.139 1.724 -0.859 1.00 0.00 H new ATOM 0 HG2 GLU B 711 49.770 -0.414 -2.299 1.00 0.00 H new ATOM 0 HG3 GLU B 711 48.381 0.432 -2.951 1.00 0.00 H new ATOM 1546 N VAL B 712 48.805 2.609 1.676 1.00 0.00 N ATOM 1547 CA VAL B 712 48.244 3.213 2.905 1.00 0.00 C ATOM 1548 C VAL B 712 46.947 2.594 3.452 1.00 0.00 C ATOM 1549 O VAL B 712 46.639 2.809 4.625 1.00 0.00 O ATOM 1550 CB VAL B 712 48.076 4.741 2.745 1.00 0.00 C ATOM 1551 CG1 VAL B 712 49.440 5.440 2.758 1.00 0.00 C ATOM 1552 CG2 VAL B 712 47.343 5.143 1.456 1.00 0.00 C ATOM 0 H VAL B 712 48.821 3.259 0.890 1.00 0.00 H new ATOM 0 HA VAL B 712 48.994 2.980 3.661 1.00 0.00 H new ATOM 0 HB VAL B 712 47.468 5.057 3.593 1.00 0.00 H new ATOM 0 HG11 VAL B 712 49.299 6.515 2.644 1.00 0.00 H new ATOM 0 HG12 VAL B 712 49.943 5.238 3.704 1.00 0.00 H new ATOM 0 HG13 VAL B 712 50.049 5.065 1.936 1.00 0.00 H new ATOM 0 HG21 VAL B 712 47.260 6.229 1.408 1.00 0.00 H new ATOM 0 HG22 VAL B 712 47.902 4.783 0.592 1.00 0.00 H new ATOM 0 HG23 VAL B 712 46.346 4.702 1.452 1.00 0.00 H new ATOM 1562 N HIS B 713 46.214 1.820 2.641 1.00 0.00 N ATOM 1563 CA HIS B 713 44.956 1.107 2.965 1.00 0.00 C ATOM 1564 C HIS B 713 44.072 1.773 4.064 1.00 0.00 C ATOM 1565 O HIS B 713 43.913 1.216 5.158 1.00 0.00 O ATOM 1566 CB HIS B 713 45.279 -0.361 3.292 1.00 0.00 C ATOM 1567 CG HIS B 713 45.890 -1.146 2.156 1.00 0.00 C ATOM 1568 ND1 HIS B 713 47.224 -1.441 1.989 1.00 0.00 N ATOM 1569 CD2 HIS B 713 45.215 -1.759 1.133 1.00 0.00 C ATOM 1570 CE1 HIS B 713 47.351 -2.224 0.906 1.00 0.00 C ATOM 1571 NE2 HIS B 713 46.149 -2.442 0.344 1.00 0.00 N ATOM 0 H HIS B 713 46.497 1.660 1.674 1.00 0.00 H new ATOM 0 HA HIS B 713 44.329 1.166 2.075 1.00 0.00 H new ATOM 0 HB2 HIS B 713 45.962 -0.387 4.141 1.00 0.00 H new ATOM 0 HB3 HIS B 713 44.361 -0.858 3.606 1.00 0.00 H new ATOM 0 HD1 HIS B 713 47.986 -1.120 2.586 1.00 0.00 H new ATOM 0 HD2 HIS B 713 44.149 -1.722 0.965 1.00 0.00 H new ATOM 0 HE1 HIS B 713 48.285 -2.622 0.539 1.00 0.00 H new ATOM 1579 N PRO B 714 43.514 2.977 3.812 1.00 0.00 N ATOM 1580 CA PRO B 714 42.711 3.729 4.782 1.00 0.00 C ATOM 1581 C PRO B 714 41.307 3.145 5.034 1.00 0.00 C ATOM 1582 O PRO B 714 40.887 2.150 4.437 1.00 0.00 O ATOM 1583 CB PRO B 714 42.637 5.150 4.211 1.00 0.00 C ATOM 1584 CG PRO B 714 42.660 4.908 2.705 1.00 0.00 C ATOM 1585 CD PRO B 714 43.629 3.734 2.574 1.00 0.00 C ATOM 0 HA PRO B 714 43.177 3.689 5.767 1.00 0.00 H new ATOM 0 HB2 PRO B 714 41.729 5.666 4.524 1.00 0.00 H new ATOM 0 HB3 PRO B 714 43.479 5.761 4.536 1.00 0.00 H new ATOM 0 HG2 PRO B 714 41.671 4.663 2.318 1.00 0.00 H new ATOM 0 HG3 PRO B 714 43.008 5.784 2.158 1.00 0.00 H new ATOM 0 HD2 PRO B 714 43.377 3.115 1.713 1.00 0.00 H new ATOM 0 HD3 PRO B 714 44.650 4.086 2.425 1.00 0.00 H new ATOM 1593 N SER B 715 40.569 3.807 5.928 1.00 0.00 N ATOM 1594 CA SER B 715 39.202 3.492 6.391 1.00 0.00 C ATOM 1595 C SER B 715 38.101 3.742 5.335 1.00 0.00 C ATOM 1596 O SER B 715 37.152 4.494 5.571 1.00 0.00 O ATOM 1597 CB SER B 715 38.909 4.278 7.683 1.00 0.00 C ATOM 1598 OG SER B 715 39.917 4.056 8.663 1.00 0.00 O ATOM 0 H SER B 715 40.933 4.642 6.386 1.00 0.00 H new ATOM 0 HA SER B 715 39.174 2.419 6.582 1.00 0.00 H new ATOM 0 HB2 SER B 715 38.846 5.343 7.457 1.00 0.00 H new ATOM 0 HB3 SER B 715 37.939 3.979 8.081 1.00 0.00 H new ATOM 0 HG SER B 715 39.706 4.568 9.471 1.00 0.00 H new ATOM 1604 N ARG B 716 38.230 3.126 4.151 1.00 0.00 N ATOM 1605 CA ARG B 716 37.312 3.258 2.994 1.00 0.00 C ATOM 1606 C ARG B 716 36.714 1.915 2.533 1.00 0.00 C ATOM 1607 O ARG B 716 36.283 1.780 1.386 1.00 0.00 O ATOM 1608 CB ARG B 716 38.023 4.010 1.847 1.00 0.00 C ATOM 1609 CG ARG B 716 38.523 5.407 2.259 1.00 0.00 C ATOM 1610 CD ARG B 716 38.963 6.260 1.060 1.00 0.00 C ATOM 1611 NE ARG B 716 40.069 5.645 0.295 1.00 0.00 N ATOM 1612 CZ ARG B 716 40.865 6.250 -0.570 1.00 0.00 C ATOM 1613 NH1 ARG B 716 40.754 7.519 -0.847 1.00 0.00 N ATOM 1614 NH2 ARG B 716 41.801 5.584 -1.182 1.00 0.00 N ATOM 0 H ARG B 716 39.007 2.494 3.958 1.00 0.00 H new ATOM 0 HA ARG B 716 36.454 3.846 3.319 1.00 0.00 H new ATOM 0 HB2 ARG B 716 38.868 3.416 1.500 1.00 0.00 H new ATOM 0 HB3 ARG B 716 37.337 4.110 1.006 1.00 0.00 H new ATOM 0 HG2 ARG B 716 37.731 5.927 2.798 1.00 0.00 H new ATOM 0 HG3 ARG B 716 39.360 5.299 2.949 1.00 0.00 H new ATOM 0 HD2 ARG B 716 38.111 6.415 0.398 1.00 0.00 H new ATOM 0 HD3 ARG B 716 39.274 7.243 1.414 1.00 0.00 H new ATOM 0 HE ARG B 716 40.235 4.651 0.451 1.00 0.00 H new ATOM 0 HH11 ARG B 716 40.034 8.080 -0.390 1.00 0.00 H new ATOM 0 HH12 ARG B 716 41.387 7.951 -1.520 1.00 0.00 H new ATOM 0 HH21 ARG B 716 41.924 4.589 -0.995 1.00 0.00 H new ATOM 0 HH22 ARG B 716 42.411 6.057 -1.848 1.00 0.00 H new ATOM 1628 N LEU B 717 36.687 0.920 3.425 1.00 0.00 N ATOM 1629 CA LEU B 717 36.172 -0.436 3.189 1.00 0.00 C ATOM 1630 C LEU B 717 35.383 -0.928 4.415 1.00 0.00 C ATOM 1631 O LEU B 717 35.950 -1.107 5.495 1.00 0.00 O ATOM 1632 CB LEU B 717 37.370 -1.345 2.843 1.00 0.00 C ATOM 1633 CG LEU B 717 37.035 -2.836 2.651 1.00 0.00 C ATOM 1634 CD1 LEU B 717 35.992 -3.078 1.560 1.00 0.00 C ATOM 1635 CD2 LEU B 717 38.304 -3.591 2.260 1.00 0.00 C ATOM 0 H LEU B 717 37.039 1.041 4.375 1.00 0.00 H new ATOM 0 HA LEU B 717 35.472 -0.452 2.353 1.00 0.00 H new ATOM 0 HB2 LEU B 717 37.834 -0.974 1.929 1.00 0.00 H new ATOM 0 HB3 LEU B 717 38.113 -1.256 3.636 1.00 0.00 H new ATOM 0 HG LEU B 717 36.625 -3.189 3.597 1.00 0.00 H new ATOM 0 HD11 LEU B 717 35.798 -4.147 1.472 1.00 0.00 H new ATOM 0 HD12 LEU B 717 35.068 -2.562 1.819 1.00 0.00 H new ATOM 0 HD13 LEU B 717 36.365 -2.698 0.609 1.00 0.00 H new ATOM 0 HD21 LEU B 717 38.071 -4.647 2.123 1.00 0.00 H new ATOM 0 HD22 LEU B 717 38.698 -3.183 1.329 1.00 0.00 H new ATOM 0 HD23 LEU B 717 39.049 -3.483 3.048 1.00 0.00 H new ATOM 1647 N GLN B 718 34.066 -1.108 4.255 1.00 0.00 N ATOM 1648 CA GLN B 718 33.129 -1.513 5.321 1.00 0.00 C ATOM 1649 C GLN B 718 32.068 -2.552 4.885 1.00 0.00 C ATOM 1650 O GLN B 718 31.200 -2.912 5.681 1.00 0.00 O ATOM 1651 CB GLN B 718 32.456 -0.245 5.899 1.00 0.00 C ATOM 1652 CG GLN B 718 33.371 0.628 6.774 1.00 0.00 C ATOM 1653 CD GLN B 718 33.734 -0.063 8.089 1.00 0.00 C ATOM 1654 OE1 GLN B 718 33.035 0.043 9.089 1.00 0.00 O ATOM 1655 NE2 GLN B 718 34.824 -0.797 8.141 1.00 0.00 N ATOM 0 H GLN B 718 33.605 -0.973 3.355 1.00 0.00 H new ATOM 0 HA GLN B 718 33.716 -2.024 6.084 1.00 0.00 H new ATOM 0 HB2 GLN B 718 32.082 0.360 5.073 1.00 0.00 H new ATOM 0 HB3 GLN B 718 31.591 -0.547 6.490 1.00 0.00 H new ATOM 0 HG2 GLN B 718 34.282 0.863 6.224 1.00 0.00 H new ATOM 0 HG3 GLN B 718 32.874 1.575 6.987 1.00 0.00 H new ATOM 0 HE21 GLN B 718 35.414 -0.893 7.315 1.00 0.00 H new ATOM 0 HE22 GLN B 718 35.079 -1.270 9.008 1.00 0.00 H new ATOM 1664 N THR B 719 32.124 -3.070 3.651 1.00 0.00 N ATOM 1665 CA THR B 719 31.176 -4.087 3.137 1.00 0.00 C ATOM 1666 C THR B 719 31.288 -5.454 3.834 1.00 0.00 C ATOM 1667 O THR B 719 30.330 -6.230 3.829 1.00 0.00 O ATOM 1668 CB THR B 719 31.321 -4.259 1.616 1.00 0.00 C ATOM 1669 OG1 THR B 719 32.679 -4.404 1.259 1.00 0.00 O ATOM 1670 CG2 THR B 719 30.791 -3.037 0.867 1.00 0.00 C ATOM 0 H THR B 719 32.832 -2.797 2.970 1.00 0.00 H new ATOM 0 HA THR B 719 30.184 -3.700 3.370 1.00 0.00 H new ATOM 0 HB THR B 719 30.749 -5.147 1.346 1.00 0.00 H new ATOM 0 HG1 THR B 719 32.752 -4.514 0.288 1.00 0.00 H new ATOM 0 HG21 THR B 719 30.908 -3.189 -0.206 1.00 0.00 H new ATOM 0 HG22 THR B 719 29.736 -2.896 1.101 1.00 0.00 H new ATOM 0 HG23 THR B 719 31.351 -2.153 1.171 1.00 0.00 H new ATOM 1678 N THR B 720 32.425 -5.739 4.478 1.00 0.00 N ATOM 1679 CA THR B 720 32.692 -6.949 5.280 1.00 0.00 C ATOM 1680 C THR B 720 33.728 -6.580 6.349 1.00 0.00 C ATOM 1681 O THR B 720 34.901 -6.394 6.032 1.00 0.00 O ATOM 1682 CB THR B 720 33.203 -8.151 4.452 1.00 0.00 C ATOM 1683 OG1 THR B 720 32.920 -8.057 3.068 1.00 0.00 O ATOM 1684 CG2 THR B 720 32.568 -9.446 4.950 1.00 0.00 C ATOM 0 H THR B 720 33.225 -5.106 4.456 1.00 0.00 H new ATOM 0 HA THR B 720 31.748 -7.273 5.717 1.00 0.00 H new ATOM 0 HB THR B 720 34.285 -8.145 4.584 1.00 0.00 H new ATOM 0 HG1 THR B 720 32.814 -8.957 2.694 1.00 0.00 H new ATOM 0 HG21 THR B 720 32.937 -10.283 4.358 1.00 0.00 H new ATOM 0 HG22 THR B 720 32.828 -9.600 5.997 1.00 0.00 H new ATOM 0 HG23 THR B 720 31.484 -9.381 4.851 1.00 0.00 H new ATOM 1692 N ASP B 721 33.299 -6.392 7.602 1.00 0.00 N ATOM 1693 CA ASP B 721 34.183 -5.946 8.701 1.00 0.00 C ATOM 1694 C ASP B 721 33.790 -6.486 10.097 1.00 0.00 C ATOM 1695 O ASP B 721 34.272 -5.991 11.114 1.00 0.00 O ATOM 1696 CB ASP B 721 34.220 -4.403 8.684 1.00 0.00 C ATOM 1697 CG ASP B 721 35.384 -3.792 9.490 1.00 0.00 C ATOM 1698 OD1 ASP B 721 36.534 -4.278 9.372 1.00 0.00 O ATOM 1699 OD2 ASP B 721 35.163 -2.767 10.182 1.00 0.00 O ATOM 0 H ASP B 721 32.332 -6.543 7.889 1.00 0.00 H new ATOM 0 HA ASP B 721 35.174 -6.364 8.524 1.00 0.00 H new ATOM 0 HB2 ASP B 721 34.290 -4.063 7.651 1.00 0.00 H new ATOM 0 HB3 ASP B 721 33.279 -4.023 9.081 1.00 0.00 H new ATOM 1704 N ASN B 722 32.899 -7.486 10.185 1.00 0.00 N ATOM 1705 CA ASN B 722 32.426 -8.066 11.461 1.00 0.00 C ATOM 1706 C ASN B 722 32.611 -9.588 11.590 1.00 0.00 C ATOM 1707 O ASN B 722 32.525 -10.125 12.696 1.00 0.00 O ATOM 1708 CB ASN B 722 30.969 -7.638 11.716 1.00 0.00 C ATOM 1709 CG ASN B 722 30.774 -6.230 12.276 1.00 0.00 C ATOM 1710 OD1 ASN B 722 29.672 -5.849 12.645 1.00 0.00 O ATOM 1711 ND2 ASN B 722 31.795 -5.408 12.376 1.00 0.00 N ATOM 0 H ASN B 722 32.479 -7.923 9.365 1.00 0.00 H new ATOM 0 HA ASN B 722 33.070 -7.660 12.241 1.00 0.00 H new ATOM 0 HB2 ASN B 722 30.419 -7.714 10.778 1.00 0.00 H new ATOM 0 HB3 ASN B 722 30.518 -8.349 12.408 1.00 0.00 H new ATOM 0 HD21 ASN B 722 31.660 -4.471 12.756 1.00 0.00 H new ATOM 0 HD22 ASN B 722 32.722 -5.707 12.074 1.00 0.00 H new ATOM 1718 N LEU B 723 32.948 -10.281 10.497 1.00 0.00 N ATOM 1719 CA LEU B 723 33.312 -11.704 10.515 1.00 0.00 C ATOM 1720 C LEU B 723 34.600 -11.945 11.335 1.00 0.00 C ATOM 1721 O LEU B 723 34.834 -13.060 11.784 1.00 0.00 O ATOM 1722 CB LEU B 723 33.466 -12.207 9.063 1.00 0.00 C ATOM 1723 CG LEU B 723 32.209 -12.091 8.181 1.00 0.00 C ATOM 1724 CD1 LEU B 723 32.476 -12.676 6.796 1.00 0.00 C ATOM 1725 CD2 LEU B 723 31.016 -12.823 8.792 1.00 0.00 C ATOM 0 H LEU B 723 32.976 -9.867 9.565 1.00 0.00 H new ATOM 0 HA LEU B 723 32.518 -12.268 11.004 1.00 0.00 H new ATOM 0 HB2 LEU B 723 34.274 -11.650 8.588 1.00 0.00 H new ATOM 0 HB3 LEU B 723 33.773 -13.252 9.090 1.00 0.00 H new ATOM 0 HG LEU B 723 31.971 -11.030 8.107 1.00 0.00 H new ATOM 0 HD11 LEU B 723 31.578 -12.587 6.184 1.00 0.00 H new ATOM 0 HD12 LEU B 723 33.293 -12.132 6.323 1.00 0.00 H new ATOM 0 HD13 LEU B 723 32.747 -13.727 6.891 1.00 0.00 H new ATOM 0 HD21 LEU B 723 30.150 -12.716 8.139 1.00 0.00 H new ATOM 0 HD22 LEU B 723 31.257 -13.880 8.906 1.00 0.00 H new ATOM 0 HD23 LEU B 723 30.788 -12.396 9.769 1.00 0.00 H new ATOM 1737 N LEU B 724 35.402 -10.893 11.555 1.00 0.00 N ATOM 1738 CA LEU B 724 36.686 -10.851 12.278 1.00 0.00 C ATOM 1739 C LEU B 724 36.738 -11.788 13.515 1.00 0.00 C ATOM 1740 O LEU B 724 36.174 -11.441 14.557 1.00 0.00 O ATOM 1741 CB LEU B 724 37.020 -9.387 12.658 1.00 0.00 C ATOM 1742 CG LEU B 724 36.861 -8.310 11.560 1.00 0.00 C ATOM 1743 CD1 LEU B 724 37.462 -6.996 12.050 1.00 0.00 C ATOM 1744 CD2 LEU B 724 37.547 -8.684 10.243 1.00 0.00 C ATOM 0 H LEU B 724 35.149 -9.970 11.202 1.00 0.00 H new ATOM 0 HA LEU B 724 37.449 -11.235 11.601 1.00 0.00 H new ATOM 0 HB2 LEU B 724 36.387 -9.105 13.500 1.00 0.00 H new ATOM 0 HB3 LEU B 724 38.051 -9.358 13.011 1.00 0.00 H new ATOM 0 HG LEU B 724 35.792 -8.220 11.366 1.00 0.00 H new ATOM 0 HD11 LEU B 724 37.351 -6.235 11.278 1.00 0.00 H new ATOM 0 HD12 LEU B 724 36.945 -6.674 12.954 1.00 0.00 H new ATOM 0 HD13 LEU B 724 38.520 -7.139 12.269 1.00 0.00 H new ATOM 0 HD21 LEU B 724 37.397 -7.886 9.515 1.00 0.00 H new ATOM 0 HD22 LEU B 724 38.614 -8.823 10.415 1.00 0.00 H new ATOM 0 HD23 LEU B 724 37.118 -9.610 9.860 1.00 0.00 H new ATOM 1756 N PRO B 725 37.381 -12.975 13.438 1.00 0.00 N ATOM 1757 CA PRO B 725 37.424 -13.957 14.531 1.00 0.00 C ATOM 1758 C PRO B 725 38.458 -13.660 15.637 1.00 0.00 C ATOM 1759 O PRO B 725 38.582 -14.438 16.583 1.00 0.00 O ATOM 1760 CB PRO B 725 37.734 -15.283 13.828 1.00 0.00 C ATOM 1761 CG PRO B 725 38.651 -14.862 12.685 1.00 0.00 C ATOM 1762 CD PRO B 725 38.070 -13.511 12.267 1.00 0.00 C ATOM 0 HA PRO B 725 36.479 -13.952 15.075 1.00 0.00 H new ATOM 0 HB2 PRO B 725 38.223 -15.990 14.498 1.00 0.00 H new ATOM 0 HB3 PRO B 725 36.828 -15.766 13.461 1.00 0.00 H new ATOM 0 HG2 PRO B 725 39.688 -14.774 13.009 1.00 0.00 H new ATOM 0 HG3 PRO B 725 38.633 -15.581 11.866 1.00 0.00 H new ATOM 0 HD2 PRO B 725 38.859 -12.835 11.938 1.00 0.00 H new ATOM 0 HD3 PRO B 725 37.381 -13.627 11.431 1.00 0.00 H new ATOM 1770 N MET B 726 39.208 -12.558 15.528 1.00 0.00 N ATOM 1771 CA MET B 726 40.265 -12.150 16.463 1.00 0.00 C ATOM 1772 C MET B 726 40.255 -10.629 16.674 1.00 0.00 C ATOM 1773 O MET B 726 39.945 -9.872 15.749 1.00 0.00 O ATOM 1774 CB MET B 726 41.586 -12.661 15.878 1.00 0.00 C ATOM 1775 CG MET B 726 42.826 -12.370 16.716 1.00 0.00 C ATOM 1776 SD MET B 726 44.307 -13.303 16.231 1.00 0.00 S ATOM 1777 CE MET B 726 44.490 -12.812 14.495 1.00 0.00 C ATOM 0 H MET B 726 39.092 -11.900 14.757 1.00 0.00 H new ATOM 0 HA MET B 726 40.112 -12.577 17.454 1.00 0.00 H new ATOM 0 HB2 MET B 726 41.508 -13.739 15.736 1.00 0.00 H new ATOM 0 HB3 MET B 726 41.723 -12.219 14.891 1.00 0.00 H new ATOM 0 HG2 MET B 726 43.048 -11.305 16.654 1.00 0.00 H new ATOM 0 HG3 MET B 726 42.602 -12.588 17.760 1.00 0.00 H new ATOM 0 HE1 MET B 726 45.409 -13.237 14.092 1.00 0.00 H new ATOM 0 HE2 MET B 726 43.638 -13.178 13.922 1.00 0.00 H new ATOM 0 HE3 MET B 726 44.533 -11.725 14.427 1.00 0.00 H new ATOM 1787 N SER B 727 40.581 -10.188 17.889 1.00 0.00 N ATOM 1788 CA SER B 727 40.561 -8.777 18.321 1.00 0.00 C ATOM 1789 C SER B 727 41.852 -8.011 17.986 1.00 0.00 C ATOM 1790 O SER B 727 42.894 -8.641 17.806 1.00 0.00 O ATOM 1791 CB SER B 727 40.319 -8.718 19.838 1.00 0.00 C ATOM 1792 OG SER B 727 39.008 -9.168 20.143 1.00 0.00 O ATOM 0 H SER B 727 40.878 -10.821 18.632 1.00 0.00 H new ATOM 0 HA SER B 727 39.756 -8.291 17.770 1.00 0.00 H new ATOM 0 HB2 SER B 727 41.053 -9.336 20.355 1.00 0.00 H new ATOM 0 HB3 SER B 727 40.453 -7.697 20.196 1.00 0.00 H new ATOM 0 HG SER B 727 38.865 -9.128 21.112 1.00 0.00 H new ATOM 1798 N PRO B 728 41.831 -6.661 17.919 1.00 0.00 N ATOM 1799 CA PRO B 728 43.009 -5.839 17.615 1.00 0.00 C ATOM 1800 C PRO B 728 44.259 -6.134 18.460 1.00 0.00 C ATOM 1801 O PRO B 728 45.361 -6.178 17.918 1.00 0.00 O ATOM 1802 CB PRO B 728 42.562 -4.384 17.791 1.00 0.00 C ATOM 1803 CG PRO B 728 41.062 -4.442 17.522 1.00 0.00 C ATOM 1804 CD PRO B 728 40.665 -5.800 18.095 1.00 0.00 C ATOM 0 HA PRO B 728 43.336 -6.069 16.601 1.00 0.00 H new ATOM 0 HB2 PRO B 728 42.777 -4.016 18.794 1.00 0.00 H new ATOM 0 HB3 PRO B 728 43.070 -3.720 17.092 1.00 0.00 H new ATOM 0 HG2 PRO B 728 40.532 -3.626 18.013 1.00 0.00 H new ATOM 0 HG3 PRO B 728 40.840 -4.372 16.457 1.00 0.00 H new ATOM 0 HD2 PRO B 728 40.396 -5.717 19.148 1.00 0.00 H new ATOM 0 HD3 PRO B 728 39.797 -6.206 17.575 1.00 0.00 H new ATOM 1812 N GLU B 729 44.121 -6.357 19.774 1.00 0.00 N ATOM 1813 CA GLU B 729 45.271 -6.669 20.648 1.00 0.00 C ATOM 1814 C GLU B 729 45.844 -8.074 20.408 1.00 0.00 C ATOM 1815 O GLU B 729 47.053 -8.283 20.506 1.00 0.00 O ATOM 1816 CB GLU B 729 44.893 -6.519 22.128 1.00 0.00 C ATOM 1817 CG GLU B 729 44.774 -5.046 22.537 1.00 0.00 C ATOM 1818 CD GLU B 729 44.957 -4.887 24.057 1.00 0.00 C ATOM 1819 OE1 GLU B 729 46.123 -4.967 24.516 1.00 0.00 O ATOM 1820 OE2 GLU B 729 43.957 -4.682 24.787 1.00 0.00 O ATOM 0 H GLU B 729 43.225 -6.328 20.260 1.00 0.00 H new ATOM 0 HA GLU B 729 46.047 -5.948 20.390 1.00 0.00 H new ATOM 0 HB2 GLU B 729 43.946 -7.026 22.315 1.00 0.00 H new ATOM 0 HB3 GLU B 729 45.645 -7.009 22.747 1.00 0.00 H new ATOM 0 HG2 GLU B 729 45.525 -4.456 22.012 1.00 0.00 H new ATOM 0 HG3 GLU B 729 43.799 -4.659 22.241 1.00 0.00 H new ATOM 1827 N GLU B 730 44.994 -9.033 20.042 1.00 0.00 N ATOM 1828 CA GLU B 730 45.422 -10.386 19.680 1.00 0.00 C ATOM 1829 C GLU B 730 46.137 -10.330 18.321 1.00 0.00 C ATOM 1830 O GLU B 730 47.256 -10.818 18.183 1.00 0.00 O ATOM 1831 CB GLU B 730 44.204 -11.310 19.605 1.00 0.00 C ATOM 1832 CG GLU B 730 43.493 -11.515 20.945 1.00 0.00 C ATOM 1833 CD GLU B 730 42.261 -12.423 20.766 1.00 0.00 C ATOM 1834 OE1 GLU B 730 41.348 -12.054 19.988 1.00 0.00 O ATOM 1835 OE2 GLU B 730 42.201 -13.495 21.413 1.00 0.00 O ATOM 0 H GLU B 730 43.985 -8.894 19.988 1.00 0.00 H new ATOM 0 HA GLU B 730 46.106 -10.778 20.433 1.00 0.00 H new ATOM 0 HB2 GLU B 730 43.493 -10.900 18.888 1.00 0.00 H new ATOM 0 HB3 GLU B 730 44.520 -12.280 19.221 1.00 0.00 H new ATOM 0 HG2 GLU B 730 44.180 -11.961 21.664 1.00 0.00 H new ATOM 0 HG3 GLU B 730 43.187 -10.552 21.352 1.00 0.00 H new ATOM 1842 N PHE B 731 45.524 -9.664 17.336 1.00 0.00 N ATOM 1843 CA PHE B 731 46.106 -9.429 16.010 1.00 0.00 C ATOM 1844 C PHE B 731 47.467 -8.708 16.103 1.00 0.00 C ATOM 1845 O PHE B 731 48.398 -9.062 15.379 1.00 0.00 O ATOM 1846 CB PHE B 731 45.098 -8.643 15.158 1.00 0.00 C ATOM 1847 CG PHE B 731 45.567 -8.324 13.749 1.00 0.00 C ATOM 1848 CD1 PHE B 731 46.330 -7.164 13.505 1.00 0.00 C ATOM 1849 CD2 PHE B 731 45.234 -9.173 12.676 1.00 0.00 C ATOM 1850 CE1 PHE B 731 46.769 -6.864 12.203 1.00 0.00 C ATOM 1851 CE2 PHE B 731 45.663 -8.867 11.372 1.00 0.00 C ATOM 1852 CZ PHE B 731 46.435 -7.715 11.135 1.00 0.00 C ATOM 0 H PHE B 731 44.591 -9.265 17.440 1.00 0.00 H new ATOM 0 HA PHE B 731 46.306 -10.387 15.531 1.00 0.00 H new ATOM 0 HB2 PHE B 731 44.172 -9.214 15.097 1.00 0.00 H new ATOM 0 HB3 PHE B 731 44.863 -7.709 15.668 1.00 0.00 H new ATOM 0 HD1 PHE B 731 46.579 -6.503 14.322 1.00 0.00 H new ATOM 0 HD2 PHE B 731 44.647 -10.062 12.855 1.00 0.00 H new ATOM 0 HE1 PHE B 731 47.363 -5.980 12.024 1.00 0.00 H new ATOM 0 HE2 PHE B 731 45.399 -9.517 10.551 1.00 0.00 H new ATOM 0 HZ PHE B 731 46.770 -7.485 10.135 1.00 0.00 H new ATOM 1862 N ASP B 732 47.622 -7.736 17.011 1.00 0.00 N ATOM 1863 CA ASP B 732 48.893 -7.042 17.263 1.00 0.00 C ATOM 1864 C ASP B 732 49.974 -8.029 17.744 1.00 0.00 C ATOM 1865 O ASP B 732 51.087 -8.037 17.222 1.00 0.00 O ATOM 1866 CB ASP B 732 48.667 -5.918 18.288 1.00 0.00 C ATOM 1867 CG ASP B 732 49.968 -5.208 18.685 1.00 0.00 C ATOM 1868 OD1 ASP B 732 50.553 -4.484 17.848 1.00 0.00 O ATOM 1869 OD2 ASP B 732 50.406 -5.356 19.853 1.00 0.00 O ATOM 0 H ASP B 732 46.858 -7.404 17.600 1.00 0.00 H new ATOM 0 HA ASP B 732 49.251 -6.602 16.332 1.00 0.00 H new ATOM 0 HB2 ASP B 732 47.972 -5.188 17.873 1.00 0.00 H new ATOM 0 HB3 ASP B 732 48.198 -6.334 19.180 1.00 0.00 H new ATOM 1874 N GLU B 733 49.641 -8.915 18.688 1.00 0.00 N ATOM 1875 CA GLU B 733 50.549 -9.964 19.173 1.00 0.00 C ATOM 1876 C GLU B 733 50.934 -10.953 18.067 1.00 0.00 C ATOM 1877 O GLU B 733 52.083 -11.390 17.992 1.00 0.00 O ATOM 1878 CB GLU B 733 49.877 -10.712 20.336 1.00 0.00 C ATOM 1879 CG GLU B 733 50.865 -11.357 21.312 1.00 0.00 C ATOM 1880 CD GLU B 733 51.761 -10.345 22.050 1.00 0.00 C ATOM 1881 OE1 GLU B 733 51.341 -9.179 22.249 1.00 0.00 O ATOM 1882 OE2 GLU B 733 52.883 -10.739 22.450 1.00 0.00 O ATOM 0 H GLU B 733 48.727 -8.926 19.142 1.00 0.00 H new ATOM 0 HA GLU B 733 51.468 -9.486 19.511 1.00 0.00 H new ATOM 0 HB2 GLU B 733 49.242 -10.016 20.884 1.00 0.00 H new ATOM 0 HB3 GLU B 733 49.226 -11.486 19.929 1.00 0.00 H new ATOM 0 HG2 GLU B 733 50.308 -11.938 22.047 1.00 0.00 H new ATOM 0 HG3 GLU B 733 51.497 -12.056 20.765 1.00 0.00 H new ATOM 1889 N VAL B 734 49.996 -11.268 17.171 1.00 0.00 N ATOM 1890 CA VAL B 734 50.250 -12.128 16.013 1.00 0.00 C ATOM 1891 C VAL B 734 51.209 -11.424 15.053 1.00 0.00 C ATOM 1892 O VAL B 734 52.206 -12.014 14.643 1.00 0.00 O ATOM 1893 CB VAL B 734 48.938 -12.529 15.310 1.00 0.00 C ATOM 1894 CG1 VAL B 734 49.228 -13.246 13.996 1.00 0.00 C ATOM 1895 CG2 VAL B 734 48.055 -13.465 16.150 1.00 0.00 C ATOM 0 H VAL B 734 49.035 -10.932 17.229 1.00 0.00 H new ATOM 0 HA VAL B 734 50.716 -13.052 16.357 1.00 0.00 H new ATOM 0 HB VAL B 734 48.404 -11.592 15.149 1.00 0.00 H new ATOM 0 HG11 VAL B 734 48.289 -13.520 13.516 1.00 0.00 H new ATOM 0 HG12 VAL B 734 49.792 -12.585 13.338 1.00 0.00 H new ATOM 0 HG13 VAL B 734 49.811 -14.146 14.193 1.00 0.00 H new ATOM 0 HG21 VAL B 734 47.149 -13.706 15.594 1.00 0.00 H new ATOM 0 HG22 VAL B 734 48.602 -14.382 16.368 1.00 0.00 H new ATOM 0 HG23 VAL B 734 47.787 -12.971 17.084 1.00 0.00 H new ATOM 1905 N SER B 735 50.953 -10.151 14.734 1.00 0.00 N ATOM 1906 CA SER B 735 51.799 -9.326 13.865 1.00 0.00 C ATOM 1907 C SER B 735 53.247 -9.250 14.370 1.00 0.00 C ATOM 1908 O SER B 735 54.183 -9.369 13.574 1.00 0.00 O ATOM 1909 CB SER B 735 51.185 -7.927 13.740 1.00 0.00 C ATOM 1910 OG SER B 735 51.890 -7.154 12.784 1.00 0.00 O ATOM 0 H SER B 735 50.133 -9.654 15.081 1.00 0.00 H new ATOM 0 HA SER B 735 51.839 -9.794 12.881 1.00 0.00 H new ATOM 0 HB2 SER B 735 50.138 -8.009 13.448 1.00 0.00 H new ATOM 0 HB3 SER B 735 51.208 -7.427 14.708 1.00 0.00 H new ATOM 0 HG SER B 735 51.483 -6.265 12.717 1.00 0.00 H new ATOM 1916 N ARG B 736 53.451 -9.124 15.693 1.00 0.00 N ATOM 1917 CA ARG B 736 54.793 -9.093 16.318 1.00 0.00 C ATOM 1918 C ARG B 736 55.613 -10.356 16.030 1.00 0.00 C ATOM 1919 O ARG B 736 56.817 -10.262 15.788 1.00 0.00 O ATOM 1920 CB ARG B 736 54.678 -8.897 17.840 1.00 0.00 C ATOM 1921 CG ARG B 736 54.239 -7.480 18.229 1.00 0.00 C ATOM 1922 CD ARG B 736 53.864 -7.420 19.716 1.00 0.00 C ATOM 1923 NE ARG B 736 53.130 -6.180 20.022 1.00 0.00 N ATOM 1924 CZ ARG B 736 53.601 -5.023 20.442 1.00 0.00 C ATOM 1925 NH1 ARG B 736 54.860 -4.821 20.714 1.00 0.00 N ATOM 1926 NH2 ARG B 736 52.767 -4.040 20.585 1.00 0.00 N ATOM 0 H ARG B 736 52.689 -9.040 16.365 1.00 0.00 H new ATOM 0 HA ARG B 736 55.318 -8.249 15.872 1.00 0.00 H new ATOM 0 HB2 ARG B 736 53.963 -9.616 18.241 1.00 0.00 H new ATOM 0 HB3 ARG B 736 55.641 -9.113 18.303 1.00 0.00 H new ATOM 0 HG2 ARG B 736 55.044 -6.775 18.023 1.00 0.00 H new ATOM 0 HG3 ARG B 736 53.386 -7.178 17.621 1.00 0.00 H new ATOM 0 HD2 ARG B 736 53.252 -8.284 19.976 1.00 0.00 H new ATOM 0 HD3 ARG B 736 54.766 -7.473 20.325 1.00 0.00 H new ATOM 0 HE ARG B 736 52.119 -6.223 19.891 1.00 0.00 H new ATOM 0 HH11 ARG B 736 55.533 -5.579 20.605 1.00 0.00 H new ATOM 0 HH12 ARG B 736 55.172 -3.905 21.036 1.00 0.00 H new ATOM 0 HH21 ARG B 736 51.778 -4.175 20.374 1.00 0.00 H new ATOM 0 HH22 ARG B 736 53.100 -3.132 20.908 1.00 0.00 H new ATOM 1940 N ILE B 737 54.972 -11.527 16.062 1.00 0.00 N ATOM 1941 CA ILE B 737 55.628 -12.831 15.835 1.00 0.00 C ATOM 1942 C ILE B 737 55.741 -13.191 14.345 1.00 0.00 C ATOM 1943 O ILE B 737 56.801 -13.626 13.894 1.00 0.00 O ATOM 1944 CB ILE B 737 54.885 -13.937 16.620 1.00 0.00 C ATOM 1945 CG1 ILE B 737 54.901 -13.579 18.125 1.00 0.00 C ATOM 1946 CG2 ILE B 737 55.502 -15.326 16.367 1.00 0.00 C ATOM 1947 CD1 ILE B 737 54.435 -14.678 19.081 1.00 0.00 C ATOM 0 H ILE B 737 53.972 -11.605 16.248 1.00 0.00 H new ATOM 0 HA ILE B 737 56.650 -12.751 16.205 1.00 0.00 H new ATOM 0 HB ILE B 737 53.853 -13.989 16.272 1.00 0.00 H new ATOM 0 HG12 ILE B 737 55.916 -13.293 18.399 1.00 0.00 H new ATOM 0 HG13 ILE B 737 54.271 -12.702 18.276 1.00 0.00 H new ATOM 0 HG21 ILE B 737 54.953 -16.077 16.935 1.00 0.00 H new ATOM 0 HG22 ILE B 737 55.444 -15.562 15.304 1.00 0.00 H new ATOM 0 HG23 ILE B 737 56.545 -15.323 16.682 1.00 0.00 H new ATOM 0 HD11 ILE B 737 54.489 -14.314 20.107 1.00 0.00 H new ATOM 0 HD12 ILE B 737 53.406 -14.952 18.847 1.00 0.00 H new ATOM 0 HD13 ILE B 737 55.077 -15.552 18.972 1.00 0.00 H new ATOM 1959 N VAL B 738 54.660 -13.029 13.575 1.00 0.00 N ATOM 1960 CA VAL B 738 54.612 -13.361 12.135 1.00 0.00 C ATOM 1961 C VAL B 738 55.488 -12.420 11.297 1.00 0.00 C ATOM 1962 O VAL B 738 56.062 -12.840 10.293 1.00 0.00 O ATOM 1963 CB VAL B 738 53.154 -13.367 11.628 1.00 0.00 C ATOM 1964 CG1 VAL B 738 53.049 -13.676 10.131 1.00 0.00 C ATOM 1965 CG2 VAL B 738 52.344 -14.450 12.355 1.00 0.00 C ATOM 0 H VAL B 738 53.779 -12.659 13.933 1.00 0.00 H new ATOM 0 HA VAL B 738 55.022 -14.364 12.015 1.00 0.00 H new ATOM 0 HB VAL B 738 52.768 -12.366 11.822 1.00 0.00 H new ATOM 0 HG11 VAL B 738 52.001 -13.667 9.830 1.00 0.00 H new ATOM 0 HG12 VAL B 738 53.596 -12.922 9.565 1.00 0.00 H new ATOM 0 HG13 VAL B 738 53.475 -14.659 9.932 1.00 0.00 H new ATOM 0 HG21 VAL B 738 51.317 -14.444 11.989 1.00 0.00 H new ATOM 0 HG22 VAL B 738 52.791 -15.426 12.167 1.00 0.00 H new ATOM 0 HG23 VAL B 738 52.348 -14.250 13.426 1.00 0.00 H new ATOM 1975 N GLY B 739 55.620 -11.157 11.710 1.00 0.00 N ATOM 1976 CA GLY B 739 56.462 -10.140 11.056 1.00 0.00 C ATOM 1977 C GLY B 739 56.227 -9.928 9.548 1.00 0.00 C ATOM 1978 O GLY B 739 57.157 -9.551 8.832 1.00 0.00 O ATOM 0 H GLY B 739 55.132 -10.799 12.531 1.00 0.00 H new ATOM 0 HA2 GLY B 739 56.306 -9.188 11.564 1.00 0.00 H new ATOM 0 HA3 GLY B 739 57.507 -10.413 11.205 1.00 0.00 H new ATOM 1982 N SER B 740 55.004 -10.166 9.061 1.00 0.00 N ATOM 1983 CA SER B 740 54.570 -10.010 7.657 1.00 0.00 C ATOM 1984 C SER B 740 55.446 -10.703 6.587 1.00 0.00 C ATOM 1985 O SER B 740 55.561 -10.208 5.464 1.00 0.00 O ATOM 1986 CB SER B 740 54.343 -8.524 7.329 1.00 0.00 C ATOM 1987 OG SER B 740 53.413 -7.947 8.236 1.00 0.00 O ATOM 0 H SER B 740 54.246 -10.490 9.662 1.00 0.00 H new ATOM 0 HA SER B 740 53.628 -10.555 7.597 1.00 0.00 H new ATOM 0 HB2 SER B 740 55.290 -7.986 7.380 1.00 0.00 H new ATOM 0 HB3 SER B 740 53.974 -8.424 6.308 1.00 0.00 H new ATOM 0 HG SER B 740 53.282 -7.002 8.013 1.00 0.00 H new ATOM 1993 N VAL B 741 56.061 -11.847 6.922 1.00 0.00 N ATOM 1994 CA VAL B 741 56.964 -12.685 6.089 1.00 0.00 C ATOM 1995 C VAL B 741 56.732 -12.653 4.563 1.00 0.00 C ATOM 1996 O VAL B 741 57.604 -12.204 3.823 1.00 0.00 O ATOM 1997 CB VAL B 741 56.997 -14.144 6.608 1.00 0.00 C ATOM 1998 CG1 VAL B 741 58.011 -14.281 7.748 1.00 0.00 C ATOM 1999 CG2 VAL B 741 55.637 -14.667 7.111 1.00 0.00 C ATOM 0 H VAL B 741 55.937 -12.249 7.851 1.00 0.00 H new ATOM 0 HA VAL B 741 57.938 -12.212 6.212 1.00 0.00 H new ATOM 0 HB VAL B 741 57.281 -14.746 5.745 1.00 0.00 H new ATOM 0 HG11 VAL B 741 58.023 -15.312 8.102 1.00 0.00 H new ATOM 0 HG12 VAL B 741 59.003 -14.010 7.387 1.00 0.00 H new ATOM 0 HG13 VAL B 741 57.729 -13.619 8.567 1.00 0.00 H new ATOM 0 HG21 VAL B 741 55.748 -15.695 7.456 1.00 0.00 H new ATOM 0 HG22 VAL B 741 55.289 -14.043 7.934 1.00 0.00 H new ATOM 0 HG23 VAL B 741 54.911 -14.633 6.298 1.00 0.00 H new ATOM 2009 N GLU B 742 55.561 -13.089 4.087 1.00 0.00 N ATOM 2010 CA GLU B 742 55.137 -13.105 2.662 1.00 0.00 C ATOM 2011 C GLU B 742 53.630 -12.758 2.544 1.00 0.00 C ATOM 2012 O GLU B 742 52.958 -13.034 1.550 1.00 0.00 O ATOM 2013 CB GLU B 742 55.404 -14.504 2.058 1.00 0.00 C ATOM 2014 CG GLU B 742 56.880 -14.937 1.984 1.00 0.00 C ATOM 2015 CD GLU B 742 57.757 -14.076 1.045 1.00 0.00 C ATOM 2016 OE1 GLU B 742 57.225 -13.325 0.190 1.00 0.00 O ATOM 2017 OE2 GLU B 742 59.005 -14.189 1.119 1.00 0.00 O ATOM 0 H GLU B 742 54.840 -13.461 4.706 1.00 0.00 H new ATOM 0 HA GLU B 742 55.710 -12.358 2.113 1.00 0.00 H new ATOM 0 HB2 GLU B 742 54.859 -15.242 2.646 1.00 0.00 H new ATOM 0 HB3 GLU B 742 54.988 -14.528 1.051 1.00 0.00 H new ATOM 0 HG2 GLU B 742 57.305 -14.905 2.987 1.00 0.00 H new ATOM 0 HG3 GLU B 742 56.925 -15.974 1.652 1.00 0.00 H new ATOM 2024 N PHE B 743 53.103 -12.203 3.637 1.00 0.00 N ATOM 2025 CA PHE B 743 51.713 -11.919 3.990 1.00 0.00 C ATOM 2026 C PHE B 743 50.750 -11.439 2.892 1.00 0.00 C ATOM 2027 O PHE B 743 49.664 -12.001 2.731 1.00 0.00 O ATOM 2028 CB PHE B 743 51.779 -10.973 5.192 1.00 0.00 C ATOM 2029 CG PHE B 743 50.774 -11.213 6.291 1.00 0.00 C ATOM 2030 CD1 PHE B 743 50.516 -12.511 6.794 1.00 0.00 C ATOM 2031 CD2 PHE B 743 50.162 -10.092 6.878 1.00 0.00 C ATOM 2032 CE1 PHE B 743 49.636 -12.670 7.874 1.00 0.00 C ATOM 2033 CE2 PHE B 743 49.289 -10.254 7.962 1.00 0.00 C ATOM 2034 CZ PHE B 743 49.026 -11.541 8.454 1.00 0.00 C ATOM 0 H PHE B 743 53.722 -11.905 4.391 1.00 0.00 H new ATOM 0 HA PHE B 743 51.236 -12.874 4.211 1.00 0.00 H new ATOM 0 HB2 PHE B 743 52.778 -11.037 5.623 1.00 0.00 H new ATOM 0 HB3 PHE B 743 51.653 -9.952 4.831 1.00 0.00 H new ATOM 0 HD1 PHE B 743 50.993 -13.372 6.349 1.00 0.00 H new ATOM 0 HD2 PHE B 743 50.365 -9.104 6.493 1.00 0.00 H new ATOM 0 HE1 PHE B 743 49.426 -13.657 8.260 1.00 0.00 H new ATOM 0 HE2 PHE B 743 48.821 -9.393 8.416 1.00 0.00 H new ATOM 0 HZ PHE B 743 48.349 -11.667 9.286 1.00 0.00 H new ATOM 2044 N ASP B 744 51.133 -10.431 2.108 1.00 0.00 N ATOM 2045 CA ASP B 744 50.329 -9.910 0.984 1.00 0.00 C ATOM 2046 C ASP B 744 50.162 -10.904 -0.192 1.00 0.00 C ATOM 2047 O ASP B 744 49.453 -10.610 -1.154 1.00 0.00 O ATOM 2048 CB ASP B 744 50.888 -8.561 0.514 1.00 0.00 C ATOM 2049 CG ASP B 744 52.346 -8.674 0.034 1.00 0.00 C ATOM 2050 OD1 ASP B 744 53.263 -8.532 0.878 1.00 0.00 O ATOM 2051 OD2 ASP B 744 52.579 -8.910 -1.175 1.00 0.00 O ATOM 0 H ASP B 744 52.020 -9.942 2.231 1.00 0.00 H new ATOM 0 HA ASP B 744 49.319 -9.765 1.368 1.00 0.00 H new ATOM 0 HB2 ASP B 744 50.269 -8.175 -0.296 1.00 0.00 H new ATOM 0 HB3 ASP B 744 50.830 -7.841 1.330 1.00 0.00 H new ATOM 2056 N SER B 745 50.787 -12.085 -0.116 1.00 0.00 N ATOM 2057 CA SER B 745 50.739 -13.154 -1.121 1.00 0.00 C ATOM 2058 C SER B 745 50.313 -14.519 -0.561 1.00 0.00 C ATOM 2059 O SER B 745 50.507 -15.535 -1.228 1.00 0.00 O ATOM 2060 CB SER B 745 52.078 -13.232 -1.874 1.00 0.00 C ATOM 2061 OG SER B 745 52.117 -12.229 -2.880 1.00 0.00 O ATOM 0 H SER B 745 51.367 -12.333 0.685 1.00 0.00 H new ATOM 0 HA SER B 745 49.951 -12.888 -1.826 1.00 0.00 H new ATOM 0 HB2 SER B 745 52.906 -13.097 -1.179 1.00 0.00 H new ATOM 0 HB3 SER B 745 52.197 -14.218 -2.324 1.00 0.00 H new ATOM 0 HG SER B 745 52.971 -12.278 -3.358 1.00 0.00 H new ATOM 2067 N MET B 746 49.684 -14.592 0.624 1.00 0.00 N ATOM 2068 CA MET B 746 49.187 -15.871 1.177 1.00 0.00 C ATOM 2069 C MET B 746 48.173 -16.587 0.258 1.00 0.00 C ATOM 2070 O MET B 746 48.022 -17.804 0.354 1.00 0.00 O ATOM 2071 CB MET B 746 48.629 -15.712 2.599 1.00 0.00 C ATOM 2072 CG MET B 746 49.660 -15.339 3.681 1.00 0.00 C ATOM 2073 SD MET B 746 51.436 -15.303 3.266 1.00 0.00 S ATOM 2074 CE MET B 746 51.890 -17.040 3.099 1.00 0.00 C ATOM 0 H MET B 746 49.506 -13.783 1.220 1.00 0.00 H new ATOM 0 HA MET B 746 50.063 -16.517 1.232 1.00 0.00 H new ATOM 0 HB2 MET B 746 47.854 -14.946 2.582 1.00 0.00 H new ATOM 0 HB3 MET B 746 48.148 -16.646 2.888 1.00 0.00 H new ATOM 0 HG2 MET B 746 49.394 -14.351 4.057 1.00 0.00 H new ATOM 0 HG3 MET B 746 49.533 -16.039 4.507 1.00 0.00 H new ATOM 0 HE1 MET B 746 52.529 -17.167 2.225 1.00 0.00 H new ATOM 0 HE2 MET B 746 52.427 -17.363 3.991 1.00 0.00 H new ATOM 0 HE3 MET B 746 50.989 -17.642 2.980 1.00 0.00 H new ATOM 2084 N MET B 747 47.529 -15.857 -0.662 1.00 0.00 N ATOM 2085 CA MET B 747 46.578 -16.368 -1.662 1.00 0.00 C ATOM 2086 C MET B 747 47.201 -16.515 -3.075 1.00 0.00 C ATOM 2087 O MET B 747 46.489 -16.844 -4.025 1.00 0.00 O ATOM 2088 CB MET B 747 45.349 -15.439 -1.731 1.00 0.00 C ATOM 2089 CG MET B 747 44.562 -15.308 -0.420 1.00 0.00 C ATOM 2090 SD MET B 747 45.244 -14.159 0.808 1.00 0.00 S ATOM 2091 CE MET B 747 43.900 -14.204 2.021 1.00 0.00 C ATOM 0 H MET B 747 47.662 -14.848 -0.734 1.00 0.00 H new ATOM 0 HA MET B 747 46.285 -17.367 -1.339 1.00 0.00 H new ATOM 0 HB2 MET B 747 45.679 -14.447 -2.040 1.00 0.00 H new ATOM 0 HB3 MET B 747 44.677 -15.807 -2.506 1.00 0.00 H new ATOM 0 HG2 MET B 747 43.547 -14.992 -0.659 1.00 0.00 H new ATOM 0 HG3 MET B 747 44.489 -16.295 0.037 1.00 0.00 H new ATOM 0 HE1 MET B 747 44.056 -13.424 2.766 1.00 0.00 H new ATOM 0 HE2 MET B 747 42.948 -14.038 1.516 1.00 0.00 H new ATOM 0 HE3 MET B 747 43.886 -15.177 2.512 1.00 0.00 H new ATOM 2101 N ASN B 748 48.512 -16.279 -3.231 1.00 0.00 N ATOM 2102 CA ASN B 748 49.242 -16.331 -4.509 1.00 0.00 C ATOM 2103 C ASN B 748 50.262 -17.486 -4.564 1.00 0.00 C ATOM 2104 O ASN B 748 50.606 -18.096 -3.549 1.00 0.00 O ATOM 2105 CB ASN B 748 49.969 -14.984 -4.724 1.00 0.00 C ATOM 2106 CG ASN B 748 49.063 -13.765 -4.822 1.00 0.00 C ATOM 2107 OD1 ASN B 748 47.923 -13.824 -5.260 1.00 0.00 O ATOM 2108 ND2 ASN B 748 49.549 -12.610 -4.428 1.00 0.00 N ATOM 0 H ASN B 748 49.115 -16.038 -2.444 1.00 0.00 H new ATOM 0 HA ASN B 748 48.515 -16.511 -5.301 1.00 0.00 H new ATOM 0 HB2 ASN B 748 50.668 -14.832 -3.902 1.00 0.00 H new ATOM 0 HB3 ASN B 748 50.561 -15.051 -5.637 1.00 0.00 H new ATOM 0 HD21 ASN B 748 48.976 -11.768 -4.488 1.00 0.00 H new ATOM 0 HD22 ASN B 748 50.499 -12.555 -4.062 1.00 0.00 H new ATOM 2115 N THR B 749 50.782 -17.769 -5.761 1.00 0.00 N ATOM 2116 CA THR B 749 51.821 -18.791 -6.005 1.00 0.00 C ATOM 2117 C THR B 749 53.210 -18.325 -5.551 1.00 0.00 C ATOM 2118 O THR B 749 53.998 -19.114 -5.024 1.00 0.00 O ATOM 2119 CB THR B 749 51.894 -19.129 -7.505 1.00 0.00 C ATOM 2120 OG1 THR B 749 52.039 -17.945 -8.266 1.00 0.00 O ATOM 2121 CG2 THR B 749 50.617 -19.813 -7.985 1.00 0.00 C ATOM 0 H THR B 749 50.490 -17.287 -6.611 1.00 0.00 H new ATOM 0 HA THR B 749 51.538 -19.669 -5.424 1.00 0.00 H new ATOM 0 HB THR B 749 52.748 -19.793 -7.638 1.00 0.00 H new ATOM 0 HG1 THR B 749 52.086 -18.172 -9.218 1.00 0.00 H new ATOM 0 HG21 THR B 749 50.702 -20.038 -9.048 1.00 0.00 H new ATOM 0 HG22 THR B 749 50.469 -20.739 -7.429 1.00 0.00 H new ATOM 0 HG23 THR B 749 49.766 -19.152 -7.821 1.00 0.00 H new ATOM 2129 N VAL B 750 53.508 -17.035 -5.745 1.00 0.00 N ATOM 2130 CA VAL B 750 54.777 -16.368 -5.392 1.00 0.00 C ATOM 2131 C VAL B 750 55.065 -16.463 -3.889 1.00 0.00 C ATOM 2132 O VAL B 750 54.338 -15.896 -3.065 1.00 0.00 O ATOM 2133 CB VAL B 750 54.785 -14.898 -5.870 1.00 0.00 C ATOM 2134 CG1 VAL B 750 56.127 -14.213 -5.577 1.00 0.00 C ATOM 2135 CG2 VAL B 750 54.546 -14.800 -7.385 1.00 0.00 C ATOM 0 H VAL B 750 52.842 -16.392 -6.173 1.00 0.00 H new ATOM 0 HA VAL B 750 55.578 -16.894 -5.911 1.00 0.00 H new ATOM 0 HB VAL B 750 53.983 -14.402 -5.324 1.00 0.00 H new ATOM 0 HG11 VAL B 750 56.093 -13.181 -5.928 1.00 0.00 H new ATOM 0 HG12 VAL B 750 56.315 -14.225 -4.503 1.00 0.00 H new ATOM 0 HG13 VAL B 750 56.927 -14.745 -6.092 1.00 0.00 H new ATOM 0 HG21 VAL B 750 54.558 -13.753 -7.688 1.00 0.00 H new ATOM 0 HG22 VAL B 750 55.332 -15.340 -7.913 1.00 0.00 H new ATOM 0 HG23 VAL B 750 53.578 -15.238 -7.630 1.00 0.00 H new TER 2145 VAL B 750 HETATM 2146 ZN ZN A 93 31.360 -27.156 14.674 1.00 0.00 ZN HETATM 2147 ZN ZN A 94 38.081 -11.025 1.821 1.00 0.00 ZN HETATM 2148 ZN ZN A 95 48.845 -26.809 10.819 1.00 0.00 ZN