USER MOD reduce.3.24.130724 H: found=0, std=0, add=1588, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1592 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 79 MET CE :methyl 164:sc= -0.356 (180deg=-1.36!) USER MOD Set 1.2: Y 111 LYS NZ :NH3+ -119:sc= -1.57 (180deg=-4.08!) USER MOD Set 2.1: B 37 ASN : amide:sc= -0.316 X(o=-5.4,f=-4.9) USER MOD Set 2.2: B 38 ASN : amide:sc= -5.08! C(o=-5.4!,f=-4.9!) USER MOD Set 3.1: A 81 THR OG1 : rot 82:sc= 0.762 USER MOD Set 3.2: B 7 MET CE :methyl 162:sc= -0.235 (180deg=-1.21) USER MOD Set 4.1: A 79 MET CE :methyl 160:sc= -0.2 (180deg=-1.46) USER MOD Set 4.2: X 111 LYS NZ :NH3+ -114:sc= -1.46 (180deg=-4.01!) USER MOD Set 5.1: A 37 ASN : amide:sc= -0.29 X(o=-5.1,f=-5.1) USER MOD Set 5.2: A 38 ASN : amide:sc= -4.84! C(o=-5.1!,f=-5.1!) USER MOD Set 6.1: A 7 MET CE :methyl 162:sc= -0.168 (180deg=-0.949) USER MOD Set 6.2: B 81 THR OG1 : rot 79:sc= 0.724 USER MOD Single : A 0 MET CE :methyl -152:sc= -0.169 (180deg=-1.19) USER MOD Single : A 0 MET N :NH3+ -163:sc= -0.012 (180deg=-0.266) USER MOD Single : A 1 SER OG : rot -24:sc= 0.174 USER MOD Single : A 5 LYS NZ :NH3+ -110:sc= -0.843 (180deg=-2.43!) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= -0.857 X(o=-0.86,f=-0.39) USER MOD Single : A 17 TYR OH : rot -94:sc= 0.403 USER MOD Single : A 18 SER OG : rot -140:sc= 0.664 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.801 K(o=-0.8,f=-2!) USER MOD Single : A 26 LYS NZ :NH3+ 157:sc= -0.343 (180deg=-1) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 157:sc= -0.114 (180deg=-0.635) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 158:sc= -1.17 (180deg=-2.64!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.216 X(o=-0.22,f=-0.22) USER MOD Single : A 48 LYS NZ :NH3+ -158:sc= -0.0319 (180deg=-0.6) USER MOD Single : A 50 GLN :FLIP amide:sc= -3.29! C(o=-4.1!,f=-3.3!) USER MOD Single : A 55 LYS NZ :NH3+ 158:sc= -0.0716 (180deg=-0.567) USER MOD Single : A 57 MET CE :methyl -107:sc= -1.07 (180deg=-4.28!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 17:sc= -0.0247 USER MOD Single : A 71 GLN : amide:sc= -0.0626 K(o=-0.063,f=-2!) USER MOD Single : A 74 MET CE :methyl -113:sc= -1.91 (180deg=-7.86!) USER MOD Single : A 78 SER OG : rot -120:sc= -2.69! USER MOD Single : A 82 THR OG1 : rot -58:sc= 1.42 USER MOD Single : A 84 CYS SG : rot 180:sc= -0.0357 USER MOD Single : A 85 HIS : no HD1:sc= -0.287 X(o=-0.29,f=-0.58) USER MOD Single : B 0 MET CE :methyl -156:sc= -0.187 (180deg=-1.3!) USER MOD Single : B 0 MET N :NH3+ -163:sc=-0.00452 (180deg=-0.293) USER MOD Single : B 1 SER OG : rot -59:sc= 0.404! USER MOD Single : B 5 LYS NZ :NH3+ -104:sc= -0.822 (180deg=-2.48!) USER MOD Single : B 15 HIS : no HD1:sc=-0.000684 X(o=-0.00068,f=-0.0035) USER MOD Single : B 16 GLN : amide:sc= -0.687 X(o=-0.69,f=-0.31) USER MOD Single : B 17 TYR OH : rot -95:sc= 0.444 USER MOD Single : B 18 SER OG : rot -142:sc= 0.613 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -0.893 K(o=-0.89,f=-1.8!) USER MOD Single : B 26 LYS NZ :NH3+ 158:sc= -0.186 (180deg=-0.947) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -120:sc= -0.116 (180deg=-0.604) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 160:sc= -1.39 (180deg=-2.77!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.3) USER MOD Single : B 48 LYS NZ :NH3+ -160:sc= -0.0756 (180deg=-0.531) USER MOD Single : B 50 GLN :FLIP amide:sc= -3.3! C(o=-4.1!,f=-3.3!) USER MOD Single : B 55 LYS NZ :NH3+ 159:sc= -0.0768 (180deg=-0.574) USER MOD Single : B 57 MET CE :methyl -108:sc= -1 (180deg=-4.28!) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 CYS SG : rot 11:sc= 0.0841 USER MOD Single : B 71 GLN : amide:sc= -0.061 K(o=-0.061,f=-1.9!) USER MOD Single : B 74 MET CE :methyl -113:sc= -2.23 (180deg=-8!) USER MOD Single : B 78 SER OG : rot -120:sc= -2.57! USER MOD Single : B 82 THR OG1 : rot -36:sc= 1.39 USER MOD Single : B 84 CYS SG : rot 180:sc= -0.038 USER MOD Single : B 85 HIS : no HD1:sc= -0.212 X(o=-0.21,f=-0.57) USER MOD Single : X 105 HIS : no HD1:sc= -5.3! C(o=-5.3!,f=-8.3!) USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ -164:sc= -0.03 (180deg=-0.324) USER MOD Single : X 109 MET CE :methyl -165:sc= 0 (180deg=-0.0646) USER MOD Single : X 112 THR OG1 : rot 170:sc= 0.927 USER MOD Single : Y 105 HIS : no HD1:sc= -5.31! C(o=-5.3!,f=-8.5!) USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ -161:sc= -0.036 (180deg=-0.396) USER MOD Single : Y 109 MET CE :methyl -168:sc= 0 (180deg=-0.04) USER MOD Single : Y 112 THR OG1 : rot 171:sc= 0.909 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 0.232 -1.707 -13.259 1.00 0.00 N ATOM 2 CA MET A 0 -0.930 -2.325 -13.955 1.00 0.00 C ATOM 3 C MET A 0 -2.080 -1.320 -14.013 1.00 0.00 C ATOM 4 O MET A 0 -3.091 -1.474 -13.355 1.00 0.00 O ATOM 5 CB MET A 0 -1.370 -3.577 -13.196 1.00 0.00 C ATOM 6 CG MET A 0 -0.309 -4.667 -13.361 1.00 0.00 C ATOM 7 SD MET A 0 -0.838 -6.165 -12.494 1.00 0.00 S ATOM 8 CE MET A 0 -0.766 -5.509 -10.808 1.00 0.00 C ATOM 0 H1 MET A 0 1.091 -2.256 -13.464 1.00 0.00 H new ATOM 0 H2 MET A 0 0.357 -0.730 -13.593 1.00 0.00 H new ATOM 0 H3 MET A 0 0.060 -1.703 -12.233 1.00 0.00 H new ATOM 0 HA MET A 0 -0.645 -2.603 -14.970 1.00 0.00 H new ATOM 0 HB2 MET A 0 -1.509 -3.346 -12.140 1.00 0.00 H new ATOM 0 HB3 MET A 0 -2.330 -3.927 -13.575 1.00 0.00 H new ATOM 0 HG2 MET A 0 -0.155 -4.882 -14.418 1.00 0.00 H new ATOM 0 HG3 MET A 0 0.646 -4.323 -12.964 1.00 0.00 H new ATOM 0 HE1 MET A 0 -0.564 -6.321 -10.110 1.00 0.00 H new ATOM 0 HE2 MET A 0 0.029 -4.766 -10.740 1.00 0.00 H new ATOM 0 HE3 MET A 0 -1.719 -5.044 -10.558 1.00 0.00 H new ATOM 20 N SER A 1 -1.928 -0.287 -14.797 1.00 0.00 N ATOM 21 CA SER A 1 -3.010 0.737 -14.901 1.00 0.00 C ATOM 22 C SER A 1 -3.422 1.183 -13.499 1.00 0.00 C ATOM 23 O SER A 1 -4.504 1.696 -13.285 1.00 0.00 O ATOM 24 CB SER A 1 -4.218 0.136 -15.620 1.00 0.00 C ATOM 25 OG SER A 1 -4.915 -0.724 -14.728 1.00 0.00 O ATOM 0 H SER A 1 -1.103 -0.107 -15.370 1.00 0.00 H new ATOM 0 HA SER A 1 -2.644 1.595 -15.465 1.00 0.00 H new ATOM 0 HB2 SER A 1 -4.879 0.929 -15.970 1.00 0.00 H new ATOM 0 HB3 SER A 1 -3.893 -0.420 -16.500 1.00 0.00 H new ATOM 0 HG SER A 1 -4.301 -1.041 -14.033 1.00 0.00 H new ATOM 31 N GLU A 2 -2.555 0.997 -12.550 1.00 0.00 N ATOM 32 CA GLU A 2 -2.854 1.409 -11.152 1.00 0.00 C ATOM 33 C GLU A 2 -2.746 2.923 -11.038 1.00 0.00 C ATOM 34 O GLU A 2 -3.088 3.510 -10.032 1.00 0.00 O ATOM 35 CB GLU A 2 -1.859 0.729 -10.216 1.00 0.00 C ATOM 36 CG GLU A 2 -2.188 -0.759 -10.181 1.00 0.00 C ATOM 37 CD GLU A 2 -1.218 -1.492 -9.253 1.00 0.00 C ATOM 38 OE1 GLU A 2 -0.225 -0.893 -8.874 1.00 0.00 O ATOM 39 OE2 GLU A 2 -1.489 -2.637 -8.931 1.00 0.00 O ATOM 0 H GLU A 2 -1.638 0.571 -12.683 1.00 0.00 H new ATOM 0 HA GLU A 2 -3.866 1.111 -10.877 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -0.838 0.886 -10.565 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -1.923 1.157 -9.216 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -3.212 -0.905 -9.837 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.127 -1.176 -11.186 1.00 0.00 H new ATOM 46 N LEU A 3 -2.261 3.553 -12.063 1.00 0.00 N ATOM 47 CA LEU A 3 -2.110 5.030 -12.039 1.00 0.00 C ATOM 48 C LEU A 3 -3.426 5.685 -11.618 1.00 0.00 C ATOM 49 O LEU A 3 -3.440 6.791 -11.135 1.00 0.00 O ATOM 50 CB LEU A 3 -1.687 5.494 -13.445 1.00 0.00 C ATOM 51 CG LEU A 3 -1.893 7.019 -13.630 1.00 0.00 C ATOM 52 CD1 LEU A 3 -0.756 7.594 -14.485 1.00 0.00 C ATOM 53 CD2 LEU A 3 -3.236 7.287 -14.332 1.00 0.00 C ATOM 0 H LEU A 3 -1.959 3.104 -12.927 1.00 0.00 H new ATOM 0 HA LEU A 3 -1.349 5.323 -11.316 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.639 5.245 -13.610 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -2.265 4.955 -14.196 1.00 0.00 H new ATOM 0 HG LEU A 3 -1.894 7.496 -12.650 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.904 8.666 -14.613 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.198 7.416 -13.989 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.754 7.109 -15.461 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -3.373 8.361 -14.458 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -3.239 6.804 -15.309 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.049 6.886 -13.727 1.00 0.00 H new ATOM 65 N GLU A 4 -4.533 5.023 -11.785 1.00 0.00 N ATOM 66 CA GLU A 4 -5.823 5.649 -11.370 1.00 0.00 C ATOM 67 C GLU A 4 -5.866 5.747 -9.847 1.00 0.00 C ATOM 68 O GLU A 4 -6.302 6.733 -9.286 1.00 0.00 O ATOM 69 CB GLU A 4 -6.990 4.800 -11.881 1.00 0.00 C ATOM 70 CG GLU A 4 -8.320 5.498 -11.574 1.00 0.00 C ATOM 71 CD GLU A 4 -8.686 5.306 -10.099 1.00 0.00 C ATOM 72 OE1 GLU A 4 -8.179 4.375 -9.495 1.00 0.00 O ATOM 73 OE2 GLU A 4 -9.469 6.095 -9.599 1.00 0.00 O ATOM 0 H GLU A 4 -4.605 4.088 -12.185 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.904 6.650 -11.794 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.892 4.642 -12.955 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.969 3.817 -11.411 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.243 6.561 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.108 5.092 -12.208 1.00 0.00 H new ATOM 80 N LYS A 5 -5.397 4.739 -9.179 1.00 0.00 N ATOM 81 CA LYS A 5 -5.380 4.765 -7.692 1.00 0.00 C ATOM 82 C LYS A 5 -4.341 5.778 -7.235 1.00 0.00 C ATOM 83 O LYS A 5 -4.470 6.398 -6.202 1.00 0.00 O ATOM 84 CB LYS A 5 -5.009 3.379 -7.172 1.00 0.00 C ATOM 85 CG LYS A 5 -6.169 2.416 -7.447 1.00 0.00 C ATOM 86 CD LYS A 5 -5.762 0.975 -7.103 1.00 0.00 C ATOM 87 CE LYS A 5 -5.010 0.341 -8.281 1.00 0.00 C ATOM 88 NZ LYS A 5 -4.695 -1.080 -7.951 1.00 0.00 N ATOM 0 H LYS A 5 -5.021 3.890 -9.600 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.361 5.044 -7.307 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.101 3.024 -7.660 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.800 3.421 -6.103 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -7.038 2.706 -6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.461 2.478 -8.495 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.131 0.970 -6.214 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -6.648 0.385 -6.868 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.616 0.392 -9.185 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.092 0.893 -8.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -3.671 -1.183 -7.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -5.200 -1.355 -7.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.994 -1.693 -8.736 1.00 0.00 H new ATOM 102 N ALA A 6 -3.296 5.922 -7.996 1.00 0.00 N ATOM 103 CA ALA A 6 -2.214 6.868 -7.627 1.00 0.00 C ATOM 104 C ALA A 6 -2.699 8.314 -7.732 1.00 0.00 C ATOM 105 O ALA A 6 -2.382 9.140 -6.903 1.00 0.00 O ATOM 106 CB ALA A 6 -1.023 6.641 -8.564 1.00 0.00 C ATOM 0 H ALA A 6 -3.145 5.417 -8.869 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.915 6.690 -6.594 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.219 7.330 -8.304 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -0.669 5.615 -8.461 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -1.332 6.816 -9.594 1.00 0.00 H new ATOM 112 N MET A 7 -3.464 8.629 -8.736 1.00 0.00 N ATOM 113 CA MET A 7 -3.965 10.020 -8.875 1.00 0.00 C ATOM 114 C MET A 7 -4.923 10.322 -7.732 1.00 0.00 C ATOM 115 O MET A 7 -4.926 11.400 -7.172 1.00 0.00 O ATOM 116 CB MET A 7 -4.703 10.174 -10.211 1.00 0.00 C ATOM 117 CG MET A 7 -3.704 10.113 -11.369 1.00 0.00 C ATOM 118 SD MET A 7 -4.540 10.588 -12.902 1.00 0.00 S ATOM 119 CE MET A 7 -3.058 11.017 -13.846 1.00 0.00 C ATOM 0 H MET A 7 -3.764 7.983 -9.466 1.00 0.00 H new ATOM 0 HA MET A 7 -3.124 10.713 -8.847 1.00 0.00 H new ATOM 0 HB2 MET A 7 -5.446 9.384 -10.319 1.00 0.00 H new ATOM 0 HB3 MET A 7 -5.240 11.122 -10.232 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.865 10.781 -11.176 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.296 9.106 -11.460 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.296 11.033 -14.910 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.703 12.001 -13.539 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.281 10.276 -13.659 1.00 0.00 H new ATOM 129 N VAL A 8 -5.736 9.372 -7.385 1.00 0.00 N ATOM 130 CA VAL A 8 -6.705 9.591 -6.278 1.00 0.00 C ATOM 131 C VAL A 8 -5.956 9.790 -4.961 1.00 0.00 C ATOM 132 O VAL A 8 -6.363 10.563 -4.122 1.00 0.00 O ATOM 133 CB VAL A 8 -7.638 8.386 -6.151 1.00 0.00 C ATOM 134 CG1 VAL A 8 -8.549 8.574 -4.929 1.00 0.00 C ATOM 135 CG2 VAL A 8 -8.489 8.267 -7.417 1.00 0.00 C ATOM 0 H VAL A 8 -5.774 8.450 -7.819 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.293 10.482 -6.500 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.049 7.477 -6.026 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.215 7.716 -4.836 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.939 8.658 -4.030 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.141 9.481 -5.052 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.155 7.409 -7.328 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.081 9.174 -7.544 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.839 8.134 -8.281 1.00 0.00 H new ATOM 145 N ALA A 9 -4.883 9.076 -4.761 1.00 0.00 N ATOM 146 CA ALA A 9 -4.126 9.203 -3.477 1.00 0.00 C ATOM 147 C ALA A 9 -3.436 10.559 -3.401 1.00 0.00 C ATOM 148 O ALA A 9 -3.284 11.132 -2.343 1.00 0.00 O ATOM 149 CB ALA A 9 -3.072 8.104 -3.384 1.00 0.00 C ATOM 0 H ALA A 9 -4.495 8.410 -5.429 1.00 0.00 H new ATOM 0 HA ALA A 9 -4.831 9.109 -2.651 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -2.525 8.203 -2.446 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -3.559 7.129 -3.419 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.378 8.193 -4.220 1.00 0.00 H new ATOM 155 N LEU A 10 -3.010 11.071 -4.513 1.00 0.00 N ATOM 156 CA LEU A 10 -2.319 12.386 -4.515 1.00 0.00 C ATOM 157 C LEU A 10 -3.273 13.428 -3.920 1.00 0.00 C ATOM 158 O LEU A 10 -2.887 14.291 -3.157 1.00 0.00 O ATOM 159 CB LEU A 10 -1.989 12.742 -5.989 1.00 0.00 C ATOM 160 CG LEU A 10 -0.479 12.960 -6.205 1.00 0.00 C ATOM 161 CD1 LEU A 10 -0.014 14.201 -5.429 1.00 0.00 C ATOM 162 CD2 LEU A 10 0.321 11.712 -5.762 1.00 0.00 C ATOM 0 H LEU A 10 -3.110 10.634 -5.429 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.401 12.361 -3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.337 11.942 -6.642 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -2.530 13.644 -6.274 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.296 13.120 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.054 14.349 -5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.558 15.077 -5.783 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.208 14.059 -4.366 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.385 11.886 -5.923 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.140 11.520 -4.704 1.00 0.00 H new ATOM 0 HD23 LEU A 10 0.002 10.849 -6.347 1.00 0.00 H new ATOM 174 N ILE A 11 -4.516 13.336 -4.278 1.00 0.00 N ATOM 175 CA ILE A 11 -5.534 14.292 -3.771 1.00 0.00 C ATOM 176 C ILE A 11 -5.908 13.971 -2.316 1.00 0.00 C ATOM 177 O ILE A 11 -6.198 14.855 -1.534 1.00 0.00 O ATOM 178 CB ILE A 11 -6.765 14.201 -4.680 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.391 14.774 -6.056 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.934 14.995 -4.077 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.453 14.401 -7.092 1.00 0.00 C ATOM 0 H ILE A 11 -4.879 12.625 -4.913 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.133 15.305 -3.785 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.078 13.162 -4.779 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.299 15.858 -5.993 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.419 14.389 -6.366 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.801 14.921 -4.733 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -8.184 14.587 -3.098 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.647 16.041 -3.971 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.176 14.813 -8.062 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.524 13.316 -7.166 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.417 14.808 -6.787 1.00 0.00 H new ATOM 193 N ASP A 12 -5.930 12.717 -1.952 1.00 0.00 N ATOM 194 CA ASP A 12 -6.322 12.350 -0.556 1.00 0.00 C ATOM 195 C ASP A 12 -5.371 12.988 0.465 1.00 0.00 C ATOM 196 O ASP A 12 -5.794 13.495 1.486 1.00 0.00 O ATOM 197 CB ASP A 12 -6.266 10.827 -0.404 1.00 0.00 C ATOM 198 CG ASP A 12 -6.668 10.431 1.020 1.00 0.00 C ATOM 199 OD1 ASP A 12 -6.824 11.319 1.841 1.00 0.00 O ATOM 200 OD2 ASP A 12 -6.826 9.245 1.260 1.00 0.00 O ATOM 0 H ASP A 12 -5.694 11.931 -2.558 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.332 12.716 -0.371 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.935 10.356 -1.124 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.260 10.468 -0.621 1.00 0.00 H new ATOM 205 N VAL A 13 -4.094 12.951 0.209 1.00 0.00 N ATOM 206 CA VAL A 13 -3.114 13.535 1.173 1.00 0.00 C ATOM 207 C VAL A 13 -3.180 15.072 1.116 1.00 0.00 C ATOM 208 O VAL A 13 -2.846 15.757 2.068 1.00 0.00 O ATOM 209 CB VAL A 13 -1.692 12.987 0.831 1.00 0.00 C ATOM 210 CG1 VAL A 13 -0.647 14.109 0.772 1.00 0.00 C ATOM 211 CG2 VAL A 13 -1.244 11.955 1.886 1.00 0.00 C ATOM 0 H VAL A 13 -3.683 12.540 -0.629 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.354 13.244 2.196 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.761 12.518 -0.151 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.328 13.686 0.531 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.929 14.829 0.004 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.596 14.610 1.739 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -0.251 11.583 1.633 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.215 12.428 2.868 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.949 11.124 1.904 1.00 0.00 H new ATOM 221 N PHE A 14 -3.607 15.623 0.019 1.00 0.00 N ATOM 222 CA PHE A 14 -3.684 17.104 -0.065 1.00 0.00 C ATOM 223 C PHE A 14 -4.628 17.615 1.022 1.00 0.00 C ATOM 224 O PHE A 14 -4.369 18.608 1.666 1.00 0.00 O ATOM 225 CB PHE A 14 -4.214 17.501 -1.444 1.00 0.00 C ATOM 226 CG PHE A 14 -4.453 18.988 -1.486 1.00 0.00 C ATOM 227 CD1 PHE A 14 -3.399 19.860 -1.777 1.00 0.00 C ATOM 228 CD2 PHE A 14 -5.732 19.494 -1.231 1.00 0.00 C ATOM 229 CE1 PHE A 14 -3.625 21.240 -1.815 1.00 0.00 C ATOM 230 CE2 PHE A 14 -5.959 20.872 -1.269 1.00 0.00 C ATOM 231 CZ PHE A 14 -4.905 21.748 -1.561 1.00 0.00 C ATOM 0 H PHE A 14 -3.904 15.118 -0.816 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.696 17.540 0.079 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.499 17.216 -2.215 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -5.141 16.968 -1.656 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -2.412 19.468 -1.972 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -6.544 18.819 -1.005 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.812 21.914 -2.040 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -6.947 21.262 -1.073 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.080 22.813 -1.590 1.00 0.00 H new ATOM 241 N HIS A 15 -5.715 16.936 1.232 1.00 0.00 N ATOM 242 CA HIS A 15 -6.684 17.367 2.279 1.00 0.00 C ATOM 243 C HIS A 15 -6.211 16.914 3.665 1.00 0.00 C ATOM 244 O HIS A 15 -6.612 17.463 4.672 1.00 0.00 O ATOM 245 CB HIS A 15 -8.046 16.746 1.979 1.00 0.00 C ATOM 246 CG HIS A 15 -9.100 17.374 2.853 1.00 0.00 C ATOM 247 ND1 HIS A 15 -9.686 16.689 3.908 1.00 0.00 N ATOM 248 CD2 HIS A 15 -9.686 18.617 2.840 1.00 0.00 C ATOM 249 CE1 HIS A 15 -10.579 17.516 4.482 1.00 0.00 C ATOM 250 NE2 HIS A 15 -10.617 18.700 3.869 1.00 0.00 N ATOM 0 H HIS A 15 -5.979 16.094 0.721 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.757 18.455 2.273 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -8.298 16.892 0.929 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -8.011 15.670 2.152 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -9.459 19.407 2.139 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -11.189 17.254 5.334 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -11.206 19.499 4.106 1.00 0.00 H new ATOM 259 N GLN A 16 -5.383 15.905 3.728 1.00 0.00 N ATOM 260 CA GLN A 16 -4.914 15.404 5.050 1.00 0.00 C ATOM 261 C GLN A 16 -4.325 16.542 5.882 1.00 0.00 C ATOM 262 O GLN A 16 -4.634 16.672 7.050 1.00 0.00 O ATOM 263 CB GLN A 16 -3.853 14.309 4.811 1.00 0.00 C ATOM 264 CG GLN A 16 -3.042 14.028 6.081 1.00 0.00 C ATOM 265 CD GLN A 16 -3.985 13.744 7.248 1.00 0.00 C ATOM 266 OE1 GLN A 16 -4.857 12.902 7.151 1.00 0.00 O ATOM 267 NE2 GLN A 16 -3.843 14.416 8.355 1.00 0.00 N ATOM 0 H GLN A 16 -5.012 15.407 2.919 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.757 14.991 5.604 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -4.342 13.393 4.480 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.182 14.619 4.010 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -2.382 13.176 5.920 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.408 14.883 6.315 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.110 15.122 8.433 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.464 14.237 9.144 1.00 0.00 H new ATOM 276 N TYR A 17 -3.465 17.349 5.313 1.00 0.00 N ATOM 277 CA TYR A 17 -2.834 18.466 6.114 1.00 0.00 C ATOM 278 C TYR A 17 -3.317 19.846 5.651 1.00 0.00 C ATOM 279 O TYR A 17 -3.292 20.798 6.405 1.00 0.00 O ATOM 280 CB TYR A 17 -1.316 18.380 5.983 1.00 0.00 C ATOM 281 CG TYR A 17 -0.911 18.726 4.576 1.00 0.00 C ATOM 282 CD1 TYR A 17 -1.095 17.789 3.560 1.00 0.00 C ATOM 283 CD2 TYR A 17 -0.357 19.979 4.288 1.00 0.00 C ATOM 284 CE1 TYR A 17 -0.725 18.097 2.252 1.00 0.00 C ATOM 285 CE2 TYR A 17 0.016 20.293 2.978 1.00 0.00 C ATOM 286 CZ TYR A 17 -0.167 19.349 1.955 1.00 0.00 C ATOM 287 OH TYR A 17 0.199 19.654 0.658 1.00 0.00 O ATOM 0 H TYR A 17 -3.169 17.292 4.339 1.00 0.00 H new ATOM 0 HA TYR A 17 -3.132 18.347 7.156 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.841 19.063 6.687 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.975 17.375 6.234 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.524 16.824 3.787 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.218 20.703 5.078 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.868 17.370 1.466 1.00 0.00 H new ATOM 0 HE2 TYR A 17 0.444 21.259 2.753 1.00 0.00 H new ATOM 0 HH TYR A 17 1.148 19.445 0.528 1.00 0.00 H new ATOM 297 N SER A 18 -3.728 19.981 4.422 1.00 0.00 N ATOM 298 CA SER A 18 -4.170 21.324 3.942 1.00 0.00 C ATOM 299 C SER A 18 -5.349 21.822 4.781 1.00 0.00 C ATOM 300 O SER A 18 -5.436 22.991 5.105 1.00 0.00 O ATOM 301 CB SER A 18 -4.597 21.238 2.477 1.00 0.00 C ATOM 302 OG SER A 18 -4.952 22.536 2.017 1.00 0.00 O ATOM 0 H SER A 18 -3.778 19.230 3.734 1.00 0.00 H new ATOM 0 HA SER A 18 -3.337 22.020 4.040 1.00 0.00 H new ATOM 0 HB2 SER A 18 -3.785 20.834 1.872 1.00 0.00 H new ATOM 0 HB3 SER A 18 -5.442 20.558 2.371 1.00 0.00 H new ATOM 0 HG SER A 18 -5.739 22.473 1.436 1.00 0.00 H new ATOM 308 N GLY A 19 -6.261 20.955 5.125 1.00 0.00 N ATOM 309 CA GLY A 19 -7.436 21.392 5.934 1.00 0.00 C ATOM 310 C GLY A 19 -7.058 21.471 7.416 1.00 0.00 C ATOM 311 O GLY A 19 -7.846 21.886 8.243 1.00 0.00 O ATOM 0 H GLY A 19 -6.245 19.965 4.882 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.784 22.365 5.587 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.261 20.692 5.798 1.00 0.00 H new ATOM 315 N ARG A 20 -5.865 21.072 7.764 1.00 0.00 N ATOM 316 CA ARG A 20 -5.451 21.122 9.197 1.00 0.00 C ATOM 317 C ARG A 20 -5.516 22.564 9.707 1.00 0.00 C ATOM 318 O ARG A 20 -6.058 22.836 10.760 1.00 0.00 O ATOM 319 CB ARG A 20 -4.017 20.606 9.328 1.00 0.00 C ATOM 320 CG ARG A 20 -3.577 20.647 10.795 1.00 0.00 C ATOM 321 CD ARG A 20 -2.148 20.126 10.900 1.00 0.00 C ATOM 322 NE ARG A 20 -1.707 20.161 12.321 1.00 0.00 N ATOM 323 CZ ARG A 20 -0.669 19.466 12.697 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.033 18.722 11.836 1.00 0.00 N ATOM 325 NH2 ARG A 20 -0.269 19.505 13.936 1.00 0.00 N ATOM 0 H ARG A 20 -5.160 20.714 7.120 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.124 20.500 9.787 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -3.953 19.586 8.949 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -3.346 21.214 8.721 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -3.635 21.666 11.177 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -4.245 20.039 11.405 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -2.093 19.107 10.516 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -1.483 20.734 10.287 1.00 0.00 H new ATOM 0 HE ARG A 20 -2.216 20.728 13.000 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.347 18.683 10.866 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.778 18.179 12.132 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -0.768 20.080 14.615 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.543 18.961 14.227 1.00 0.00 H new ATOM 339 N GLU A 21 -4.949 23.490 8.977 1.00 0.00 N ATOM 340 CA GLU A 21 -4.959 24.917 9.429 1.00 0.00 C ATOM 341 C GLU A 21 -6.206 25.628 8.891 1.00 0.00 C ATOM 342 O GLU A 21 -7.175 25.806 9.602 1.00 0.00 O ATOM 343 CB GLU A 21 -3.689 25.619 8.922 1.00 0.00 C ATOM 344 CG GLU A 21 -3.422 26.888 9.742 1.00 0.00 C ATOM 345 CD GLU A 21 -4.499 27.932 9.442 1.00 0.00 C ATOM 346 OE1 GLU A 21 -4.737 28.190 8.274 1.00 0.00 O ATOM 347 OE2 GLU A 21 -5.069 28.455 10.386 1.00 0.00 O ATOM 0 H GLU A 21 -4.479 23.321 8.087 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.981 24.953 10.518 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.837 24.943 8.996 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -3.802 25.875 7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.418 26.651 10.806 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.437 27.288 9.501 1.00 0.00 H new ATOM 354 N GLY A 22 -6.200 26.045 7.650 1.00 0.00 N ATOM 355 CA GLY A 22 -7.399 26.748 7.106 1.00 0.00 C ATOM 356 C GLY A 22 -7.297 26.879 5.583 1.00 0.00 C ATOM 357 O GLY A 22 -8.296 26.920 4.892 1.00 0.00 O ATOM 0 H GLY A 22 -5.425 25.930 6.997 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.302 26.198 7.370 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.485 27.736 7.557 1.00 0.00 H new ATOM 361 N ASP A 23 -6.108 26.946 5.048 1.00 0.00 N ATOM 362 CA ASP A 23 -5.982 27.074 3.569 1.00 0.00 C ATOM 363 C ASP A 23 -6.329 25.727 2.934 1.00 0.00 C ATOM 364 O ASP A 23 -5.474 25.010 2.454 1.00 0.00 O ATOM 365 CB ASP A 23 -4.548 27.463 3.203 1.00 0.00 C ATOM 366 CG ASP A 23 -4.103 28.657 4.051 1.00 0.00 C ATOM 367 OD1 ASP A 23 -4.935 29.503 4.333 1.00 0.00 O ATOM 368 OD2 ASP A 23 -2.935 28.706 4.400 1.00 0.00 O ATOM 0 H ASP A 23 -5.229 26.918 5.564 1.00 0.00 H new ATOM 0 HA ASP A 23 -6.659 27.846 3.203 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.879 26.618 3.368 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -4.489 27.715 2.144 1.00 0.00 H new ATOM 373 N LYS A 24 -7.584 25.378 2.948 1.00 0.00 N ATOM 374 CA LYS A 24 -8.018 24.077 2.371 1.00 0.00 C ATOM 375 C LYS A 24 -7.663 23.992 0.883 1.00 0.00 C ATOM 376 O LYS A 24 -7.111 23.014 0.430 1.00 0.00 O ATOM 377 CB LYS A 24 -9.536 23.956 2.541 1.00 0.00 C ATOM 378 CG LYS A 24 -10.037 22.634 1.952 1.00 0.00 C ATOM 379 CD LYS A 24 -11.553 22.539 2.138 1.00 0.00 C ATOM 380 CE LYS A 24 -12.105 21.420 1.254 1.00 0.00 C ATOM 381 NZ LYS A 24 -13.484 21.066 1.697 1.00 0.00 N ATOM 0 H LYS A 24 -8.336 25.945 3.339 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.506 23.266 2.889 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.795 24.011 3.598 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.031 24.792 2.047 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.785 22.576 0.893 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.546 21.794 2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.790 22.342 3.183 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -12.022 23.488 1.878 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.118 21.739 0.212 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.458 20.545 1.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.858 20.305 1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.459 20.744 2.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.099 21.901 1.620 1.00 0.00 H new ATOM 395 N HIS A 25 -8.004 24.989 0.114 1.00 0.00 N ATOM 396 CA HIS A 25 -7.718 24.937 -1.355 1.00 0.00 C ATOM 397 C HIS A 25 -6.337 25.521 -1.679 1.00 0.00 C ATOM 398 O HIS A 25 -5.909 25.497 -2.816 1.00 0.00 O ATOM 399 CB HIS A 25 -8.786 25.742 -2.094 1.00 0.00 C ATOM 400 CG HIS A 25 -8.627 25.547 -3.578 1.00 0.00 C ATOM 401 ND1 HIS A 25 -7.885 26.418 -4.365 1.00 0.00 N ATOM 402 CD2 HIS A 25 -9.106 24.585 -4.433 1.00 0.00 C ATOM 403 CE1 HIS A 25 -7.939 25.966 -5.632 1.00 0.00 C ATOM 404 NE2 HIS A 25 -8.670 24.854 -5.725 1.00 0.00 N ATOM 0 H HIS A 25 -8.468 25.839 0.435 1.00 0.00 H new ATOM 0 HA HIS A 25 -7.729 23.894 -1.672 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.779 25.423 -1.779 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -8.697 26.799 -1.844 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -9.726 23.749 -4.146 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -7.451 26.444 -6.469 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -8.868 24.314 -6.568 1.00 0.00 H new ATOM 413 N LYS A 26 -5.640 26.054 -0.707 1.00 0.00 N ATOM 414 CA LYS A 26 -4.289 26.651 -0.980 1.00 0.00 C ATOM 415 C LYS A 26 -3.290 26.219 0.079 1.00 0.00 C ATOM 416 O LYS A 26 -3.640 25.811 1.171 1.00 0.00 O ATOM 417 CB LYS A 26 -4.405 28.173 -0.996 1.00 0.00 C ATOM 418 CG LYS A 26 -5.154 28.587 -2.259 1.00 0.00 C ATOM 419 CD LYS A 26 -5.468 30.089 -2.224 1.00 0.00 C ATOM 420 CE LYS A 26 -4.171 30.908 -2.217 1.00 0.00 C ATOM 421 NZ LYS A 26 -3.185 30.313 -3.165 1.00 0.00 N ATOM 0 H LYS A 26 -5.945 26.103 0.265 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.935 26.299 -1.949 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.935 28.522 -0.110 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.415 28.629 -0.976 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -4.554 28.354 -3.139 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.079 28.017 -2.345 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.072 30.361 -3.090 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.058 30.323 -1.338 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.381 31.940 -2.499 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -3.752 30.932 -1.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -2.499 31.039 -3.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.685 29.529 -2.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.683 29.955 -4.005 1.00 0.00 H new ATOM 435 N LEU A 27 -2.035 26.288 -0.266 1.00 0.00 N ATOM 436 CA LEU A 27 -0.953 25.876 0.667 1.00 0.00 C ATOM 437 C LEU A 27 0.052 27.007 0.823 1.00 0.00 C ATOM 438 O LEU A 27 0.525 27.557 -0.144 1.00 0.00 O ATOM 439 CB LEU A 27 -0.239 24.665 0.068 1.00 0.00 C ATOM 440 CG LEU A 27 -1.179 23.455 0.081 1.00 0.00 C ATOM 441 CD1 LEU A 27 -0.523 22.304 -0.687 1.00 0.00 C ATOM 442 CD2 LEU A 27 -1.472 23.028 1.534 1.00 0.00 C ATOM 0 H LEU A 27 -1.709 26.619 -1.174 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.378 25.634 1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.075 24.883 -0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.663 24.443 0.638 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.122 23.719 -0.397 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.186 21.439 -0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.336 22.613 -1.716 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.421 22.040 -0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.141 22.167 1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.539 22.761 2.030 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.944 23.853 2.068 1.00 0.00 H new ATOM 454 N LYS A 28 0.408 27.333 2.034 1.00 0.00 N ATOM 455 CA LYS A 28 1.425 28.401 2.267 1.00 0.00 C ATOM 456 C LYS A 28 2.727 27.697 2.643 1.00 0.00 C ATOM 457 O LYS A 28 2.705 26.553 3.052 1.00 0.00 O ATOM 458 CB LYS A 28 0.979 29.302 3.424 1.00 0.00 C ATOM 459 CG LYS A 28 -0.293 30.060 3.030 1.00 0.00 C ATOM 460 CD LYS A 28 -0.733 30.961 4.189 1.00 0.00 C ATOM 461 CE LYS A 28 -2.004 31.721 3.802 1.00 0.00 C ATOM 462 NZ LYS A 28 -2.300 32.744 4.845 1.00 0.00 N ATOM 0 H LYS A 28 0.036 26.903 2.881 1.00 0.00 H new ATOM 0 HA LYS A 28 1.551 29.020 1.379 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.794 28.701 4.315 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.771 30.008 3.674 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.110 30.660 2.139 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.087 29.355 2.782 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.915 30.360 5.080 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.062 31.665 4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.874 32.200 2.832 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.841 31.029 3.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.163 33.263 4.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.440 32.274 5.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.504 33.409 4.915 1.00 0.00 H new ATOM 476 N LYS A 29 3.862 28.341 2.518 1.00 0.00 N ATOM 477 CA LYS A 29 5.133 27.654 2.889 1.00 0.00 C ATOM 478 C LYS A 29 4.933 27.032 4.270 1.00 0.00 C ATOM 479 O LYS A 29 5.571 26.068 4.642 1.00 0.00 O ATOM 480 CB LYS A 29 6.290 28.666 2.939 1.00 0.00 C ATOM 481 CG LYS A 29 6.142 29.606 4.142 1.00 0.00 C ATOM 482 CD LYS A 29 7.159 30.743 4.022 1.00 0.00 C ATOM 483 CE LYS A 29 7.197 31.534 5.332 1.00 0.00 C ATOM 484 NZ LYS A 29 7.767 30.677 6.412 1.00 0.00 N ATOM 0 H LYS A 29 3.961 29.298 2.180 1.00 0.00 H new ATOM 0 HA LYS A 29 5.380 26.891 2.151 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.240 28.136 3.001 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.310 29.248 2.018 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.130 30.010 4.180 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.301 29.056 5.070 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.147 30.340 3.800 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.890 31.400 3.195 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.801 32.433 5.209 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.192 31.859 5.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.154 31.280 7.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.020 30.069 6.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.526 30.084 6.020 1.00 0.00 H new ATOM 498 N SER A 30 4.023 27.593 5.014 1.00 0.00 N ATOM 499 CA SER A 30 3.719 27.067 6.375 1.00 0.00 C ATOM 500 C SER A 30 2.920 25.764 6.261 1.00 0.00 C ATOM 501 O SER A 30 3.207 24.793 6.932 1.00 0.00 O ATOM 502 CB SER A 30 2.898 28.099 7.151 1.00 0.00 C ATOM 503 OG SER A 30 2.728 27.653 8.490 1.00 0.00 O ATOM 0 H SER A 30 3.470 28.403 4.735 1.00 0.00 H new ATOM 0 HA SER A 30 4.654 26.873 6.901 1.00 0.00 H new ATOM 0 HB2 SER A 30 3.402 29.065 7.139 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.927 28.240 6.676 1.00 0.00 H new ATOM 0 HG SER A 30 2.204 28.313 8.990 1.00 0.00 H new ATOM 509 N GLU A 31 1.921 25.728 5.414 1.00 0.00 N ATOM 510 CA GLU A 31 1.127 24.484 5.271 1.00 0.00 C ATOM 511 C GLU A 31 2.006 23.439 4.585 1.00 0.00 C ATOM 512 O GLU A 31 1.932 22.260 4.865 1.00 0.00 O ATOM 513 CB GLU A 31 -0.121 24.766 4.430 1.00 0.00 C ATOM 514 CG GLU A 31 -0.951 25.860 5.107 1.00 0.00 C ATOM 515 CD GLU A 31 -1.565 25.311 6.394 1.00 0.00 C ATOM 516 OE1 GLU A 31 -2.322 24.359 6.305 1.00 0.00 O ATOM 517 OE2 GLU A 31 -1.273 25.857 7.445 1.00 0.00 O ATOM 0 H GLU A 31 1.628 26.505 4.822 1.00 0.00 H new ATOM 0 HA GLU A 31 0.807 24.117 6.246 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.166 25.080 3.426 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.714 23.858 4.322 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.323 26.722 5.330 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.737 26.204 4.434 1.00 0.00 H new ATOM 524 N LEU A 32 2.851 23.878 3.691 1.00 0.00 N ATOM 525 CA LEU A 32 3.756 22.934 2.982 1.00 0.00 C ATOM 526 C LEU A 32 4.636 22.222 4.009 1.00 0.00 C ATOM 527 O LEU A 32 4.846 21.032 3.941 1.00 0.00 O ATOM 528 CB LEU A 32 4.638 23.737 2.017 1.00 0.00 C ATOM 529 CG LEU A 32 5.604 22.811 1.268 1.00 0.00 C ATOM 530 CD1 LEU A 32 4.821 21.770 0.457 1.00 0.00 C ATOM 531 CD2 LEU A 32 6.462 23.661 0.325 1.00 0.00 C ATOM 0 H LEU A 32 2.952 24.856 3.421 1.00 0.00 H new ATOM 0 HA LEU A 32 3.177 22.195 2.427 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.011 24.271 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.202 24.488 2.571 1.00 0.00 H new ATOM 0 HG LEU A 32 6.237 22.287 1.984 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.519 21.119 -0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.205 21.173 1.130 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.182 22.277 -0.266 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.155 23.017 -0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.818 24.179 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.024 24.393 0.905 1.00 0.00 H new ATOM 543 N LYS A 33 5.141 22.949 4.962 1.00 0.00 N ATOM 544 CA LYS A 33 6.003 22.335 6.016 1.00 0.00 C ATOM 545 C LYS A 33 5.202 21.305 6.815 1.00 0.00 C ATOM 546 O LYS A 33 5.720 20.291 7.236 1.00 0.00 O ATOM 547 CB LYS A 33 6.519 23.437 6.952 1.00 0.00 C ATOM 548 CG LYS A 33 7.248 22.834 8.166 1.00 0.00 C ATOM 549 CD LYS A 33 8.372 21.897 7.706 1.00 0.00 C ATOM 550 CE LYS A 33 9.366 21.664 8.861 1.00 0.00 C ATOM 551 NZ LYS A 33 8.681 21.841 10.177 1.00 0.00 N ATOM 0 H LYS A 33 4.994 23.954 5.060 1.00 0.00 H new ATOM 0 HA LYS A 33 6.847 21.832 5.545 1.00 0.00 H new ATOM 0 HB2 LYS A 33 7.196 24.095 6.407 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.684 24.050 7.292 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.661 23.632 8.783 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.540 22.285 8.787 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.953 20.946 7.378 1.00 0.00 H new ATOM 0 HD3 LYS A 33 8.890 22.329 6.850 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.784 20.660 8.793 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.199 22.362 8.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 9.214 21.339 10.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.635 22.853 10.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 7.717 21.454 10.122 1.00 0.00 H new ATOM 565 N GLU A 34 3.949 21.564 7.053 1.00 0.00 N ATOM 566 CA GLU A 34 3.145 20.605 7.856 1.00 0.00 C ATOM 567 C GLU A 34 3.123 19.254 7.157 1.00 0.00 C ATOM 568 O GLU A 34 3.220 18.225 7.787 1.00 0.00 O ATOM 569 CB GLU A 34 1.719 21.132 8.010 1.00 0.00 C ATOM 570 CG GLU A 34 1.729 22.358 8.922 1.00 0.00 C ATOM 571 CD GLU A 34 0.306 22.891 9.081 1.00 0.00 C ATOM 572 OE1 GLU A 34 -0.562 22.429 8.359 1.00 0.00 O ATOM 573 OE2 GLU A 34 0.109 23.758 9.916 1.00 0.00 O ATOM 0 H GLU A 34 3.449 22.392 6.729 1.00 0.00 H new ATOM 0 HA GLU A 34 3.592 20.493 8.844 1.00 0.00 H new ATOM 0 HB2 GLU A 34 1.308 21.393 7.035 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.076 20.358 8.429 1.00 0.00 H new ATOM 0 HG2 GLU A 34 2.141 22.095 9.897 1.00 0.00 H new ATOM 0 HG3 GLU A 34 2.373 23.131 8.502 1.00 0.00 H new ATOM 580 N LEU A 35 3.007 19.237 5.864 1.00 0.00 N ATOM 581 CA LEU A 35 3.006 17.927 5.154 1.00 0.00 C ATOM 582 C LEU A 35 4.402 17.308 5.250 1.00 0.00 C ATOM 583 O LEU A 35 4.564 16.133 5.501 1.00 0.00 O ATOM 584 CB LEU A 35 2.637 18.149 3.672 1.00 0.00 C ATOM 585 CG LEU A 35 3.023 16.911 2.803 1.00 0.00 C ATOM 586 CD1 LEU A 35 1.964 16.659 1.727 1.00 0.00 C ATOM 587 CD2 LEU A 35 4.383 17.131 2.107 1.00 0.00 C ATOM 0 H LEU A 35 2.914 20.061 5.270 1.00 0.00 H new ATOM 0 HA LEU A 35 2.276 17.258 5.610 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.567 18.338 3.585 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.149 19.035 3.296 1.00 0.00 H new ATOM 0 HG LEU A 35 3.088 16.051 3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.250 15.792 1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.001 16.471 2.201 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.886 17.534 1.081 1.00 0.00 H new ATOM 0 HD21 LEU A 35 4.631 16.255 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.324 18.008 1.462 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.156 17.286 2.860 1.00 0.00 H new ATOM 599 N ILE A 36 5.407 18.095 5.015 1.00 0.00 N ATOM 600 CA ILE A 36 6.798 17.571 5.035 1.00 0.00 C ATOM 601 C ILE A 36 7.249 17.204 6.452 1.00 0.00 C ATOM 602 O ILE A 36 7.898 16.197 6.654 1.00 0.00 O ATOM 603 CB ILE A 36 7.719 18.650 4.457 1.00 0.00 C ATOM 604 CG1 ILE A 36 7.284 18.943 3.013 1.00 0.00 C ATOM 605 CG2 ILE A 36 9.180 18.171 4.485 1.00 0.00 C ATOM 606 CD1 ILE A 36 8.032 20.165 2.475 1.00 0.00 C ATOM 0 H ILE A 36 5.325 19.090 4.807 1.00 0.00 H new ATOM 0 HA ILE A 36 6.843 16.659 4.439 1.00 0.00 H new ATOM 0 HB ILE A 36 7.647 19.558 5.056 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.485 18.077 2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.209 19.121 2.978 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.825 18.946 4.072 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.475 17.964 5.514 1.00 0.00 H new ATOM 0 HG23 ILE A 36 9.277 17.263 3.890 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.716 20.363 1.451 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.809 21.031 3.098 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.105 19.972 2.493 1.00 0.00 H new ATOM 618 N ASN A 37 6.933 18.000 7.431 1.00 0.00 N ATOM 619 CA ASN A 37 7.378 17.671 8.814 1.00 0.00 C ATOM 620 C ASN A 37 6.613 16.470 9.370 1.00 0.00 C ATOM 621 O ASN A 37 7.150 15.656 10.093 1.00 0.00 O ATOM 622 CB ASN A 37 7.136 18.868 9.735 1.00 0.00 C ATOM 623 CG ASN A 37 7.707 18.557 11.120 1.00 0.00 C ATOM 624 OD1 ASN A 37 7.036 18.726 12.119 1.00 0.00 O ATOM 625 ND2 ASN A 37 8.927 18.103 11.221 1.00 0.00 N ATOM 0 H ASN A 37 6.390 18.858 7.337 1.00 0.00 H new ATOM 0 HA ASN A 37 8.440 17.429 8.772 1.00 0.00 H new ATOM 0 HB2 ASN A 37 7.609 19.760 9.325 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.069 19.078 9.807 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.318 17.890 12.139 1.00 0.00 H new ATOM 0 HD22 ASN A 37 9.490 17.961 10.382 1.00 0.00 H new ATOM 632 N ASN A 38 5.345 16.406 9.096 1.00 0.00 N ATOM 633 CA ASN A 38 4.487 15.312 9.669 1.00 0.00 C ATOM 634 C ASN A 38 4.198 14.173 8.685 1.00 0.00 C ATOM 635 O ASN A 38 4.018 13.041 9.091 1.00 0.00 O ATOM 636 CB ASN A 38 3.157 15.929 10.098 1.00 0.00 C ATOM 637 CG ASN A 38 3.420 17.022 11.133 1.00 0.00 C ATOM 638 OD1 ASN A 38 2.499 17.625 11.647 1.00 0.00 O ATOM 639 ND2 ASN A 38 4.651 17.312 11.455 1.00 0.00 N ATOM 0 H ASN A 38 4.852 17.066 8.495 1.00 0.00 H new ATOM 0 HA ASN A 38 5.036 14.876 10.503 1.00 0.00 H new ATOM 0 HB2 ASN A 38 2.641 16.347 9.234 1.00 0.00 H new ATOM 0 HB3 ASN A 38 2.506 15.163 10.518 1.00 0.00 H new ATOM 0 HD21 ASN A 38 4.840 18.045 12.138 1.00 0.00 H new ATOM 0 HD22 ASN A 38 5.424 16.805 11.023 1.00 0.00 H new ATOM 646 N GLU A 39 4.087 14.443 7.415 1.00 0.00 N ATOM 647 CA GLU A 39 3.735 13.343 6.466 1.00 0.00 C ATOM 648 C GLU A 39 4.976 12.526 6.099 1.00 0.00 C ATOM 649 O GLU A 39 4.868 11.440 5.568 1.00 0.00 O ATOM 650 CB GLU A 39 3.111 13.950 5.194 1.00 0.00 C ATOM 651 CG GLU A 39 2.116 12.961 4.575 1.00 0.00 C ATOM 652 CD GLU A 39 0.790 13.024 5.340 1.00 0.00 C ATOM 653 OE1 GLU A 39 0.110 14.030 5.223 1.00 0.00 O ATOM 654 OE2 GLU A 39 0.480 12.069 6.032 1.00 0.00 O ATOM 0 H GLU A 39 4.222 15.362 6.994 1.00 0.00 H new ATOM 0 HA GLU A 39 3.018 12.677 6.947 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.604 14.884 5.438 1.00 0.00 H new ATOM 0 HB3 GLU A 39 3.893 14.190 4.474 1.00 0.00 H new ATOM 0 HG2 GLU A 39 1.954 13.202 3.524 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.521 11.950 4.612 1.00 0.00 H new ATOM 661 N LEU A 40 6.149 13.035 6.379 1.00 0.00 N ATOM 662 CA LEU A 40 7.403 12.288 6.043 1.00 0.00 C ATOM 663 C LEU A 40 8.139 11.932 7.334 1.00 0.00 C ATOM 664 O LEU A 40 9.295 12.259 7.515 1.00 0.00 O ATOM 665 CB LEU A 40 8.293 13.170 5.167 1.00 0.00 C ATOM 666 CG LEU A 40 7.473 13.709 3.979 1.00 0.00 C ATOM 667 CD1 LEU A 40 8.362 14.568 3.051 1.00 0.00 C ATOM 668 CD2 LEU A 40 6.864 12.534 3.190 1.00 0.00 C ATOM 0 H LEU A 40 6.294 13.939 6.828 1.00 0.00 H new ATOM 0 HA LEU A 40 7.157 11.373 5.504 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.692 13.998 5.753 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.146 12.597 4.804 1.00 0.00 H new ATOM 0 HG LEU A 40 6.670 14.337 4.364 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.766 14.940 2.218 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.767 15.410 3.612 1.00 0.00 H new ATOM 0 HD13 LEU A 40 9.182 13.960 2.668 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.285 12.920 2.351 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.663 11.894 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.212 11.955 3.845 1.00 0.00 H new ATOM 680 N SER A 41 7.471 11.272 8.240 1.00 0.00 N ATOM 681 CA SER A 41 8.128 10.903 9.524 1.00 0.00 C ATOM 682 C SER A 41 9.347 10.013 9.256 1.00 0.00 C ATOM 683 O SER A 41 10.378 10.161 9.883 1.00 0.00 O ATOM 684 CB SER A 41 7.129 10.150 10.400 1.00 0.00 C ATOM 685 OG SER A 41 6.051 11.016 10.731 1.00 0.00 O ATOM 0 H SER A 41 6.500 10.973 8.146 1.00 0.00 H new ATOM 0 HA SER A 41 8.457 11.809 10.033 1.00 0.00 H new ATOM 0 HB2 SER A 41 6.757 9.271 9.874 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.618 9.795 11.307 1.00 0.00 H new ATOM 0 HG SER A 41 5.406 10.536 11.292 1.00 0.00 H new ATOM 691 N HIS A 42 9.246 9.091 8.330 1.00 0.00 N ATOM 692 CA HIS A 42 10.412 8.196 8.028 1.00 0.00 C ATOM 693 C HIS A 42 10.472 7.876 6.532 1.00 0.00 C ATOM 694 O HIS A 42 11.481 7.415 6.035 1.00 0.00 O ATOM 695 CB HIS A 42 10.276 6.886 8.817 1.00 0.00 C ATOM 696 CG HIS A 42 11.388 5.943 8.429 1.00 0.00 C ATOM 697 ND1 HIS A 42 12.727 6.261 8.616 1.00 0.00 N ATOM 698 CD2 HIS A 42 11.378 4.692 7.855 1.00 0.00 C ATOM 699 CE1 HIS A 42 13.459 5.225 8.163 1.00 0.00 C ATOM 700 NE2 HIS A 42 12.685 4.247 7.690 1.00 0.00 N ATOM 0 H HIS A 42 8.411 8.918 7.771 1.00 0.00 H new ATOM 0 HA HIS A 42 11.327 8.712 8.318 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.315 7.089 9.887 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.309 6.426 8.614 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.492 4.141 7.576 1.00 0.00 H new ATOM 0 HE1 HIS A 42 14.538 5.190 8.181 1.00 0.00 H new ATOM 0 HE2 HIS A 42 12.988 3.359 7.291 1.00 0.00 H new ATOM 709 N PHE A 43 9.411 8.098 5.807 1.00 0.00 N ATOM 710 CA PHE A 43 9.443 7.781 4.355 1.00 0.00 C ATOM 711 C PHE A 43 10.520 8.630 3.673 1.00 0.00 C ATOM 712 O PHE A 43 11.312 8.137 2.895 1.00 0.00 O ATOM 713 CB PHE A 43 8.067 8.063 3.736 1.00 0.00 C ATOM 714 CG PHE A 43 8.098 7.955 2.214 1.00 0.00 C ATOM 715 CD1 PHE A 43 9.035 7.138 1.542 1.00 0.00 C ATOM 716 CD2 PHE A 43 7.164 8.688 1.466 1.00 0.00 C ATOM 717 CE1 PHE A 43 9.027 7.069 0.144 1.00 0.00 C ATOM 718 CE2 PHE A 43 7.166 8.610 0.069 1.00 0.00 C ATOM 719 CZ PHE A 43 8.096 7.804 -0.590 1.00 0.00 C ATOM 0 H PHE A 43 8.532 8.481 6.154 1.00 0.00 H new ATOM 0 HA PHE A 43 9.681 6.727 4.213 1.00 0.00 H new ATOM 0 HB2 PHE A 43 7.337 7.359 4.136 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.737 9.061 4.023 1.00 0.00 H new ATOM 0 HD1 PHE A 43 9.757 6.567 2.107 1.00 0.00 H new ATOM 0 HD2 PHE A 43 6.442 9.314 1.970 1.00 0.00 H new ATOM 0 HE1 PHE A 43 9.744 6.445 -0.368 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.445 9.176 -0.502 1.00 0.00 H new ATOM 0 HZ PHE A 43 8.095 7.749 -1.669 1.00 0.00 H new ATOM 729 N LEU A 44 10.564 9.903 3.974 1.00 0.00 N ATOM 730 CA LEU A 44 11.595 10.801 3.366 1.00 0.00 C ATOM 731 C LEU A 44 12.181 11.654 4.482 1.00 0.00 C ATOM 732 O LEU A 44 11.508 11.969 5.443 1.00 0.00 O ATOM 733 CB LEU A 44 10.939 11.715 2.320 1.00 0.00 C ATOM 734 CG LEU A 44 12.010 12.487 1.520 1.00 0.00 C ATOM 735 CD1 LEU A 44 12.564 11.615 0.387 1.00 0.00 C ATOM 736 CD2 LEU A 44 11.386 13.750 0.912 1.00 0.00 C ATOM 0 H LEU A 44 9.924 10.364 4.621 1.00 0.00 H new ATOM 0 HA LEU A 44 12.371 10.211 2.879 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.330 11.119 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.269 12.419 2.814 1.00 0.00 H new ATOM 0 HG LEU A 44 12.821 12.756 2.197 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.318 12.174 -0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.015 10.716 0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.753 11.334 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.143 14.294 0.347 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.570 13.468 0.247 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.001 14.386 1.709 1.00 0.00 H new ATOM 748 N GLU A 45 13.418 12.034 4.382 1.00 0.00 N ATOM 749 CA GLU A 45 13.999 12.861 5.466 1.00 0.00 C ATOM 750 C GLU A 45 13.132 14.108 5.642 1.00 0.00 C ATOM 751 O GLU A 45 13.037 14.944 4.766 1.00 0.00 O ATOM 752 CB GLU A 45 15.425 13.267 5.093 1.00 0.00 C ATOM 753 CG GLU A 45 16.033 14.116 6.212 1.00 0.00 C ATOM 754 CD GLU A 45 17.499 14.399 5.884 1.00 0.00 C ATOM 755 OE1 GLU A 45 17.970 13.886 4.881 1.00 0.00 O ATOM 756 OE2 GLU A 45 18.128 15.121 6.639 1.00 0.00 O ATOM 0 H GLU A 45 14.045 11.812 3.608 1.00 0.00 H new ATOM 0 HA GLU A 45 14.028 12.295 6.397 1.00 0.00 H new ATOM 0 HB2 GLU A 45 16.034 12.378 4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 45 15.420 13.829 4.159 1.00 0.00 H new ATOM 0 HG2 GLU A 45 15.483 15.052 6.315 1.00 0.00 H new ATOM 0 HG3 GLU A 45 15.955 13.593 7.165 1.00 0.00 H new ATOM 763 N GLU A 46 12.490 14.223 6.768 1.00 0.00 N ATOM 764 CA GLU A 46 11.613 15.401 7.021 1.00 0.00 C ATOM 765 C GLU A 46 12.465 16.668 7.111 1.00 0.00 C ATOM 766 O GLU A 46 13.677 16.606 7.151 1.00 0.00 O ATOM 767 CB GLU A 46 10.828 15.187 8.324 1.00 0.00 C ATOM 768 CG GLU A 46 11.754 15.263 9.546 1.00 0.00 C ATOM 769 CD GLU A 46 12.829 14.182 9.437 1.00 0.00 C ATOM 770 OE1 GLU A 46 12.487 13.071 9.067 1.00 0.00 O ATOM 771 OE2 GLU A 46 13.976 14.482 9.725 1.00 0.00 O ATOM 0 H GLU A 46 12.534 13.547 7.531 1.00 0.00 H new ATOM 0 HA GLU A 46 10.906 15.514 6.199 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.046 15.941 8.409 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.333 14.216 8.299 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.218 16.248 9.604 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.178 15.128 10.461 1.00 0.00 H new ATOM 778 N ILE A 47 11.840 17.822 7.140 1.00 0.00 N ATOM 779 CA ILE A 47 12.617 19.100 7.225 1.00 0.00 C ATOM 780 C ILE A 47 12.653 19.580 8.678 1.00 0.00 C ATOM 781 O ILE A 47 11.685 19.468 9.405 1.00 0.00 O ATOM 782 CB ILE A 47 11.967 20.156 6.331 1.00 0.00 C ATOM 783 CG1 ILE A 47 12.168 19.746 4.869 1.00 0.00 C ATOM 784 CG2 ILE A 47 12.622 21.519 6.574 1.00 0.00 C ATOM 785 CD1 ILE A 47 11.369 20.670 3.953 1.00 0.00 C ATOM 0 H ILE A 47 10.827 17.934 7.109 1.00 0.00 H new ATOM 0 HA ILE A 47 13.638 18.932 6.883 1.00 0.00 H new ATOM 0 HB ILE A 47 10.904 20.230 6.559 1.00 0.00 H new ATOM 0 HG12 ILE A 47 13.226 19.792 4.612 1.00 0.00 H new ATOM 0 HG13 ILE A 47 11.850 18.714 4.725 1.00 0.00 H new ATOM 0 HG21 ILE A 47 12.154 22.267 5.934 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.493 21.804 7.618 1.00 0.00 H new ATOM 0 HG23 ILE A 47 13.686 21.458 6.343 1.00 0.00 H new ATOM 0 HD11 ILE A 47 11.518 20.371 2.915 1.00 0.00 H new ATOM 0 HD12 ILE A 47 10.310 20.602 4.202 1.00 0.00 H new ATOM 0 HD13 ILE A 47 11.708 21.697 4.087 1.00 0.00 H new ATOM 797 N LYS A 48 13.781 20.086 9.111 1.00 0.00 N ATOM 798 CA LYS A 48 13.925 20.555 10.525 1.00 0.00 C ATOM 799 C LYS A 48 14.040 22.080 10.575 1.00 0.00 C ATOM 800 O LYS A 48 13.726 22.696 11.574 1.00 0.00 O ATOM 801 CB LYS A 48 15.190 19.923 11.116 1.00 0.00 C ATOM 802 CG LYS A 48 15.252 18.426 10.727 1.00 0.00 C ATOM 803 CD LYS A 48 16.127 18.229 9.481 1.00 0.00 C ATOM 804 CE LYS A 48 16.166 16.745 9.117 1.00 0.00 C ATOM 805 NZ LYS A 48 16.812 15.985 10.224 1.00 0.00 N ATOM 0 H LYS A 48 14.618 20.196 8.539 1.00 0.00 H new ATOM 0 HA LYS A 48 13.047 20.259 11.100 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.075 20.442 10.747 1.00 0.00 H new ATOM 0 HB3 LYS A 48 15.188 20.028 12.201 1.00 0.00 H new ATOM 0 HG2 LYS A 48 15.655 17.845 11.557 1.00 0.00 H new ATOM 0 HG3 LYS A 48 14.246 18.052 10.535 1.00 0.00 H new ATOM 0 HD2 LYS A 48 15.729 18.809 8.648 1.00 0.00 H new ATOM 0 HD3 LYS A 48 17.136 18.595 9.670 1.00 0.00 H new ATOM 0 HE2 LYS A 48 15.156 16.374 8.946 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.720 16.600 8.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 17.177 15.083 9.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 17.597 16.543 10.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 16.113 15.798 10.971 1.00 0.00 H new ATOM 819 N GLU A 49 14.485 22.693 9.506 1.00 0.00 N ATOM 820 CA GLU A 49 14.622 24.187 9.480 1.00 0.00 C ATOM 821 C GLU A 49 13.659 24.761 8.444 1.00 0.00 C ATOM 822 O GLU A 49 13.487 24.214 7.372 1.00 0.00 O ATOM 823 CB GLU A 49 16.053 24.569 9.091 1.00 0.00 C ATOM 824 CG GLU A 49 17.027 24.174 10.205 1.00 0.00 C ATOM 825 CD GLU A 49 17.303 22.667 10.155 1.00 0.00 C ATOM 826 OE1 GLU A 49 16.910 22.041 9.185 1.00 0.00 O ATOM 827 OE2 GLU A 49 17.911 22.167 11.087 1.00 0.00 O ATOM 0 H GLU A 49 14.761 22.222 8.644 1.00 0.00 H new ATOM 0 HA GLU A 49 14.393 24.587 10.468 1.00 0.00 H new ATOM 0 HB2 GLU A 49 16.330 24.071 8.162 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.114 25.642 8.908 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.960 24.726 10.095 1.00 0.00 H new ATOM 0 HG3 GLU A 49 16.610 24.443 11.175 1.00 0.00 H new ATOM 834 N GLN A 50 13.030 25.862 8.747 1.00 0.00 N ATOM 835 CA GLN A 50 12.085 26.464 7.771 1.00 0.00 C ATOM 836 C GLN A 50 12.868 27.023 6.582 1.00 0.00 C ATOM 837 O GLN A 50 12.311 27.272 5.537 1.00 0.00 O ATOM 838 CB GLN A 50 11.275 27.587 8.436 1.00 0.00 C ATOM 839 CG GLN A 50 12.215 28.606 9.091 1.00 0.00 C ATOM 840 CD GLN A 50 12.833 29.504 8.018 1.00 0.00 C ATOM 841 OE1 GLN A 50 12.096 29.920 7.025 1.00 0.00 O flip ATOM 842 NE2 GLN A 50 14.002 29.831 8.085 1.00 0.00 N flip ATOM 0 H GLN A 50 13.130 26.369 9.627 1.00 0.00 H new ATOM 0 HA GLN A 50 11.395 25.695 7.424 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.651 28.083 7.693 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.605 27.166 9.186 1.00 0.00 H new ATOM 0 HG2 GLN A 50 11.665 29.211 9.812 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.000 28.089 9.642 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.579 29.506 8.861 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.406 30.430 7.365 1.00 0.00 H new ATOM 851 N GLU A 51 14.154 27.232 6.727 1.00 0.00 N ATOM 852 CA GLU A 51 14.941 27.781 5.581 1.00 0.00 C ATOM 853 C GLU A 51 14.896 26.805 4.408 1.00 0.00 C ATOM 854 O GLU A 51 14.776 27.203 3.271 1.00 0.00 O ATOM 855 CB GLU A 51 16.398 28.010 6.015 1.00 0.00 C ATOM 856 CG GLU A 51 17.134 26.669 6.134 1.00 0.00 C ATOM 857 CD GLU A 51 18.475 26.880 6.838 1.00 0.00 C ATOM 858 OE1 GLU A 51 18.979 27.990 6.789 1.00 0.00 O ATOM 859 OE2 GLU A 51 18.975 25.929 7.416 1.00 0.00 O ATOM 0 H GLU A 51 14.686 27.049 7.578 1.00 0.00 H new ATOM 0 HA GLU A 51 14.507 28.731 5.270 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.905 28.648 5.291 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.422 28.532 6.971 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.526 25.958 6.693 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.295 26.242 5.144 1.00 0.00 H new ATOM 866 N VAL A 52 14.982 25.532 4.671 1.00 0.00 N ATOM 867 CA VAL A 52 14.932 24.554 3.556 1.00 0.00 C ATOM 868 C VAL A 52 13.612 24.718 2.844 1.00 0.00 C ATOM 869 O VAL A 52 13.533 24.652 1.641 1.00 0.00 O ATOM 870 CB VAL A 52 15.048 23.132 4.099 1.00 0.00 C ATOM 871 CG1 VAL A 52 14.957 22.128 2.944 1.00 0.00 C ATOM 872 CG2 VAL A 52 16.383 22.978 4.822 1.00 0.00 C ATOM 0 H VAL A 52 15.084 25.131 5.603 1.00 0.00 H new ATOM 0 HA VAL A 52 15.760 24.731 2.869 1.00 0.00 H new ATOM 0 HB VAL A 52 14.234 22.939 4.798 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.040 21.114 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.999 22.243 2.436 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.767 22.312 2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.471 21.964 5.212 1.00 0.00 H new ATOM 0 HG22 VAL A 52 17.199 23.171 4.125 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.435 23.689 5.646 1.00 0.00 H new ATOM 882 N VAL A 53 12.574 24.925 3.585 1.00 0.00 N ATOM 883 CA VAL A 53 11.245 25.097 2.965 1.00 0.00 C ATOM 884 C VAL A 53 11.256 26.323 2.068 1.00 0.00 C ATOM 885 O VAL A 53 10.682 26.323 1.016 1.00 0.00 O ATOM 886 CB VAL A 53 10.210 25.296 4.057 1.00 0.00 C ATOM 887 CG1 VAL A 53 8.819 25.382 3.439 1.00 0.00 C ATOM 888 CG2 VAL A 53 10.274 24.130 5.027 1.00 0.00 C ATOM 0 H VAL A 53 12.588 24.983 4.603 1.00 0.00 H new ATOM 0 HA VAL A 53 11.003 24.213 2.375 1.00 0.00 H new ATOM 0 HB VAL A 53 10.417 26.223 4.592 1.00 0.00 H new ATOM 0 HG11 VAL A 53 8.079 25.525 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.780 26.223 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.602 24.459 2.901 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.532 24.269 5.813 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.068 23.202 4.494 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.268 24.080 5.471 1.00 0.00 H new ATOM 898 N ASP A 54 11.892 27.372 2.493 1.00 0.00 N ATOM 899 CA ASP A 54 11.932 28.614 1.673 1.00 0.00 C ATOM 900 C ASP A 54 12.626 28.336 0.346 1.00 0.00 C ATOM 901 O ASP A 54 12.240 28.834 -0.689 1.00 0.00 O ATOM 902 CB ASP A 54 12.684 29.708 2.437 1.00 0.00 C ATOM 903 CG ASP A 54 12.658 31.011 1.634 1.00 0.00 C ATOM 904 OD1 ASP A 54 12.463 30.942 0.432 1.00 0.00 O ATOM 905 OD2 ASP A 54 12.826 32.057 2.238 1.00 0.00 O ATOM 0 H ASP A 54 12.391 27.426 3.381 1.00 0.00 H new ATOM 0 HA ASP A 54 10.914 28.949 1.476 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.226 29.863 3.414 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.714 29.399 2.613 1.00 0.00 H new ATOM 910 N LYS A 55 13.655 27.554 0.381 1.00 0.00 N ATOM 911 CA LYS A 55 14.402 27.233 -0.866 1.00 0.00 C ATOM 912 C LYS A 55 13.515 26.394 -1.776 1.00 0.00 C ATOM 913 O LYS A 55 13.479 26.571 -2.980 1.00 0.00 O ATOM 914 CB LYS A 55 15.669 26.452 -0.521 1.00 0.00 C ATOM 915 CG LYS A 55 16.546 26.344 -1.767 1.00 0.00 C ATOM 916 CD LYS A 55 17.816 25.564 -1.431 1.00 0.00 C ATOM 917 CE LYS A 55 18.702 25.485 -2.673 1.00 0.00 C ATOM 918 NZ LYS A 55 19.156 26.855 -3.039 1.00 0.00 N ATOM 0 H LYS A 55 14.020 27.115 1.226 1.00 0.00 H new ATOM 0 HA LYS A 55 14.680 28.156 -1.374 1.00 0.00 H new ATOM 0 HB2 LYS A 55 16.213 26.953 0.279 1.00 0.00 H new ATOM 0 HB3 LYS A 55 15.410 25.458 -0.156 1.00 0.00 H new ATOM 0 HG2 LYS A 55 16.000 25.843 -2.567 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.803 27.339 -2.131 1.00 0.00 H new ATOM 0 HD2 LYS A 55 18.352 26.053 -0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.561 24.561 -1.088 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.562 24.843 -2.481 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.150 25.039 -3.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.019 26.792 -3.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.410 27.334 -3.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 19.356 27.397 -2.174 1.00 0.00 H new ATOM 932 N VAL A 56 12.788 25.487 -1.199 1.00 0.00 N ATOM 933 CA VAL A 56 11.884 24.632 -2.004 1.00 0.00 C ATOM 934 C VAL A 56 10.766 25.518 -2.528 1.00 0.00 C ATOM 935 O VAL A 56 10.213 25.295 -3.588 1.00 0.00 O ATOM 936 CB VAL A 56 11.331 23.510 -1.109 1.00 0.00 C ATOM 937 CG1 VAL A 56 10.059 22.904 -1.710 1.00 0.00 C ATOM 938 CG2 VAL A 56 12.386 22.412 -0.976 1.00 0.00 C ATOM 0 H VAL A 56 12.781 25.300 -0.196 1.00 0.00 H new ATOM 0 HA VAL A 56 12.405 24.170 -2.842 1.00 0.00 H new ATOM 0 HB VAL A 56 11.090 23.933 -0.134 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.689 22.113 -1.057 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.298 23.679 -1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.283 22.488 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.001 21.613 -0.343 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.621 22.012 -1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 56 13.289 22.827 -0.528 1.00 0.00 H new ATOM 948 N MET A 57 10.444 26.539 -1.790 1.00 0.00 N ATOM 949 CA MET A 57 9.376 27.464 -2.239 1.00 0.00 C ATOM 950 C MET A 57 9.912 28.330 -3.369 1.00 0.00 C ATOM 951 O MET A 57 9.179 28.775 -4.210 1.00 0.00 O ATOM 952 CB MET A 57 8.875 28.324 -1.076 1.00 0.00 C ATOM 953 CG MET A 57 8.037 27.454 -0.128 1.00 0.00 C ATOM 954 SD MET A 57 6.492 26.964 -0.938 1.00 0.00 S ATOM 955 CE MET A 57 5.543 28.465 -0.598 1.00 0.00 C ATOM 0 H MET A 57 10.875 26.772 -0.895 1.00 0.00 H new ATOM 0 HA MET A 57 8.527 26.886 -2.603 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.719 28.758 -0.540 1.00 0.00 H new ATOM 0 HB3 MET A 57 8.276 29.153 -1.453 1.00 0.00 H new ATOM 0 HG2 MET A 57 8.602 26.568 0.161 1.00 0.00 H new ATOM 0 HG3 MET A 57 7.819 28.005 0.787 1.00 0.00 H new ATOM 0 HE1 MET A 57 4.798 28.258 0.170 1.00 0.00 H new ATOM 0 HE2 MET A 57 6.215 29.249 -0.250 1.00 0.00 H new ATOM 0 HE3 MET A 57 5.043 28.794 -1.509 1.00 0.00 H new ATOM 965 N GLU A 58 11.188 28.552 -3.438 1.00 0.00 N ATOM 966 CA GLU A 58 11.698 29.363 -4.570 1.00 0.00 C ATOM 967 C GLU A 58 11.308 28.611 -5.839 1.00 0.00 C ATOM 968 O GLU A 58 10.889 29.182 -6.826 1.00 0.00 O ATOM 969 CB GLU A 58 13.220 29.489 -4.472 1.00 0.00 C ATOM 970 CG GLU A 58 13.736 30.395 -5.589 1.00 0.00 C ATOM 971 CD GLU A 58 15.254 30.525 -5.468 1.00 0.00 C ATOM 972 OE1 GLU A 58 15.790 30.051 -4.480 1.00 0.00 O ATOM 973 OE2 GLU A 58 15.856 31.092 -6.365 1.00 0.00 O ATOM 0 H GLU A 58 11.888 28.216 -2.776 1.00 0.00 H new ATOM 0 HA GLU A 58 11.282 30.371 -4.565 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.499 29.898 -3.501 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.681 28.504 -4.547 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.471 29.981 -6.562 1.00 0.00 H new ATOM 0 HG3 GLU A 58 13.268 31.377 -5.523 1.00 0.00 H new ATOM 980 N THR A 59 11.427 27.314 -5.787 1.00 0.00 N ATOM 981 CA THR A 59 11.054 26.459 -6.946 1.00 0.00 C ATOM 982 C THR A 59 9.528 26.257 -7.018 1.00 0.00 C ATOM 983 O THR A 59 8.948 26.246 -8.085 1.00 0.00 O ATOM 984 CB THR A 59 11.738 25.102 -6.774 1.00 0.00 C ATOM 985 OG1 THR A 59 13.148 25.280 -6.753 1.00 0.00 O ATOM 986 CG2 THR A 59 11.355 24.172 -7.920 1.00 0.00 C ATOM 0 H THR A 59 11.773 26.802 -4.975 1.00 0.00 H new ATOM 0 HA THR A 59 11.373 26.944 -7.869 1.00 0.00 H new ATOM 0 HB THR A 59 11.413 24.656 -5.834 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.586 24.410 -6.641 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.848 23.209 -7.787 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.274 24.029 -7.927 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.669 24.613 -8.866 1.00 0.00 H new ATOM 994 N LEU A 60 8.881 26.062 -5.895 1.00 0.00 N ATOM 995 CA LEU A 60 7.404 25.820 -5.898 1.00 0.00 C ATOM 996 C LEU A 60 6.643 27.148 -5.849 1.00 0.00 C ATOM 997 O LEU A 60 5.482 27.214 -6.203 1.00 0.00 O ATOM 998 CB LEU A 60 7.042 24.960 -4.660 1.00 0.00 C ATOM 999 CG LEU A 60 6.847 23.473 -5.037 1.00 0.00 C ATOM 1000 CD1 LEU A 60 5.708 23.310 -6.076 1.00 0.00 C ATOM 1001 CD2 LEU A 60 8.173 22.883 -5.573 1.00 0.00 C ATOM 0 H LEU A 60 9.315 26.060 -4.972 1.00 0.00 H new ATOM 0 HA LEU A 60 7.122 25.299 -6.813 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.831 25.046 -3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.129 25.343 -4.204 1.00 0.00 H new ATOM 0 HG LEU A 60 6.559 22.922 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.591 22.255 -6.325 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.776 23.690 -5.657 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.955 23.870 -6.978 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.025 21.835 -5.836 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.487 23.438 -6.457 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.942 22.959 -4.804 1.00 0.00 H new ATOM 1013 N ASP A 61 7.270 28.203 -5.422 1.00 0.00 N ATOM 1014 CA ASP A 61 6.545 29.503 -5.371 1.00 0.00 C ATOM 1015 C ASP A 61 6.544 30.081 -6.770 1.00 0.00 C ATOM 1016 O ASP A 61 7.089 31.135 -7.034 1.00 0.00 O ATOM 1017 CB ASP A 61 7.228 30.480 -4.417 1.00 0.00 C ATOM 1018 CG ASP A 61 6.334 31.706 -4.235 1.00 0.00 C ATOM 1019 OD1 ASP A 61 5.313 31.773 -4.900 1.00 0.00 O ATOM 1020 OD2 ASP A 61 6.683 32.555 -3.432 1.00 0.00 O ATOM 0 H ASP A 61 8.241 28.226 -5.109 1.00 0.00 H new ATOM 0 HA ASP A 61 5.530 29.341 -5.008 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.410 30.001 -3.455 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.198 30.778 -4.814 1.00 0.00 H new ATOM 1025 N GLU A 62 5.937 29.377 -7.667 1.00 0.00 N ATOM 1026 CA GLU A 62 5.879 29.835 -9.072 1.00 0.00 C ATOM 1027 C GLU A 62 5.171 31.188 -9.119 1.00 0.00 C ATOM 1028 O GLU A 62 5.528 32.064 -9.882 1.00 0.00 O ATOM 1029 CB GLU A 62 5.085 28.813 -9.874 1.00 0.00 C ATOM 1030 CG GLU A 62 5.684 27.420 -9.642 1.00 0.00 C ATOM 1031 CD GLU A 62 4.943 26.393 -10.500 1.00 0.00 C ATOM 1032 OE1 GLU A 62 3.967 26.768 -11.129 1.00 0.00 O ATOM 1033 OE2 GLU A 62 5.369 25.250 -10.521 1.00 0.00 O ATOM 0 H GLU A 62 5.470 28.489 -7.485 1.00 0.00 H new ATOM 0 HA GLU A 62 6.881 29.936 -9.488 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.038 28.828 -9.571 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.113 29.063 -10.935 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.744 27.422 -9.895 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.608 27.151 -8.588 1.00 0.00 H new ATOM 1040 N ASP A 63 4.169 31.362 -8.303 1.00 0.00 N ATOM 1041 CA ASP A 63 3.435 32.657 -8.290 1.00 0.00 C ATOM 1042 C ASP A 63 4.281 33.695 -7.553 1.00 0.00 C ATOM 1043 O ASP A 63 4.006 34.878 -7.589 1.00 0.00 O ATOM 1044 CB ASP A 63 2.105 32.486 -7.551 1.00 0.00 C ATOM 1045 CG ASP A 63 1.268 31.408 -8.239 1.00 0.00 C ATOM 1046 OD1 ASP A 63 1.284 31.360 -9.457 1.00 0.00 O ATOM 1047 OD2 ASP A 63 0.627 30.647 -7.533 1.00 0.00 O ATOM 0 H ASP A 63 3.827 30.663 -7.644 1.00 0.00 H new ATOM 0 HA ASP A 63 3.245 32.981 -9.313 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.288 32.210 -6.512 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.561 33.430 -7.539 1.00 0.00 H new ATOM 1052 N GLY A 64 5.316 33.257 -6.887 1.00 0.00 N ATOM 1053 CA GLY A 64 6.187 34.221 -6.151 1.00 0.00 C ATOM 1054 C GLY A 64 5.377 34.905 -5.041 1.00 0.00 C ATOM 1055 O GLY A 64 5.623 36.048 -4.706 1.00 0.00 O ATOM 0 H GLY A 64 5.596 32.278 -6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 64 7.042 33.699 -5.722 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.582 34.968 -6.839 1.00 0.00 H new ATOM 1059 N ASP A 65 4.406 34.222 -4.476 1.00 0.00 N ATOM 1060 CA ASP A 65 3.566 34.837 -3.394 1.00 0.00 C ATOM 1061 C ASP A 65 3.925 34.229 -2.038 1.00 0.00 C ATOM 1062 O ASP A 65 3.269 34.475 -1.044 1.00 0.00 O ATOM 1063 CB ASP A 65 2.087 34.581 -3.703 1.00 0.00 C ATOM 1064 CG ASP A 65 1.885 33.122 -4.116 1.00 0.00 C ATOM 1065 OD1 ASP A 65 2.862 32.391 -4.140 1.00 0.00 O ATOM 1066 OD2 ASP A 65 0.757 32.762 -4.408 1.00 0.00 O ATOM 0 H ASP A 65 4.158 33.263 -4.718 1.00 0.00 H new ATOM 0 HA ASP A 65 3.754 35.910 -3.355 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.479 34.807 -2.827 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.754 35.243 -4.502 1.00 0.00 H new ATOM 1071 N GLY A 66 4.956 33.435 -1.986 1.00 0.00 N ATOM 1072 CA GLY A 66 5.347 32.810 -0.693 1.00 0.00 C ATOM 1073 C GLY A 66 4.433 31.617 -0.419 1.00 0.00 C ATOM 1074 O GLY A 66 4.537 30.959 0.596 1.00 0.00 O ATOM 0 H GLY A 66 5.545 33.192 -2.782 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.387 32.486 -0.731 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.269 33.537 0.115 1.00 0.00 H new ATOM 1078 N GLU A 67 3.538 31.334 -1.328 1.00 0.00 N ATOM 1079 CA GLU A 67 2.606 30.182 -1.149 1.00 0.00 C ATOM 1080 C GLU A 67 2.411 29.482 -2.498 1.00 0.00 C ATOM 1081 O GLU A 67 2.502 30.095 -3.541 1.00 0.00 O ATOM 1082 CB GLU A 67 1.258 30.686 -0.623 1.00 0.00 C ATOM 1083 CG GLU A 67 0.692 31.749 -1.564 1.00 0.00 C ATOM 1084 CD GLU A 67 -0.653 32.238 -1.023 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -1.230 31.538 -0.207 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -1.083 33.303 -1.433 1.00 0.00 O ATOM 0 H GLU A 67 3.412 31.857 -2.195 1.00 0.00 H new ATOM 0 HA GLU A 67 3.025 29.478 -0.430 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.558 29.855 -0.538 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.381 31.103 0.377 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.388 32.584 -1.649 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.566 31.336 -2.565 1.00 0.00 H new ATOM 1093 N CYS A 68 2.138 28.200 -2.479 1.00 0.00 N ATOM 1094 CA CYS A 68 1.925 27.433 -3.743 1.00 0.00 C ATOM 1095 C CYS A 68 0.495 26.890 -3.718 1.00 0.00 C ATOM 1096 O CYS A 68 0.007 26.451 -2.697 1.00 0.00 O ATOM 1097 CB CYS A 68 2.961 26.295 -3.824 1.00 0.00 C ATOM 1098 SG CYS A 68 2.389 24.840 -2.906 1.00 0.00 S ATOM 0 H CYS A 68 2.053 27.646 -1.627 1.00 0.00 H new ATOM 0 HA CYS A 68 2.055 28.063 -4.623 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.135 26.028 -4.866 1.00 0.00 H new ATOM 0 HB3 CYS A 68 3.914 26.635 -3.419 1.00 0.00 H new ATOM 0 HG CYS A 68 1.112 24.942 -2.683 1.00 0.00 H new ATOM 1104 N ASP A 69 -0.189 26.940 -4.823 1.00 0.00 N ATOM 1105 CA ASP A 69 -1.598 26.454 -4.855 1.00 0.00 C ATOM 1106 C ASP A 69 -1.612 24.941 -5.045 1.00 0.00 C ATOM 1107 O ASP A 69 -0.592 24.327 -5.285 1.00 0.00 O ATOM 1108 CB ASP A 69 -2.350 27.139 -5.999 1.00 0.00 C ATOM 1109 CG ASP A 69 -1.753 26.711 -7.338 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -0.808 25.944 -7.322 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -2.248 27.165 -8.356 1.00 0.00 O ATOM 0 H ASP A 69 0.166 27.297 -5.710 1.00 0.00 H new ATOM 0 HA ASP A 69 -2.090 26.696 -3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -3.407 26.876 -5.961 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -2.287 28.222 -5.891 1.00 0.00 H new ATOM 1116 N PHE A 70 -2.757 24.329 -4.933 1.00 0.00 N ATOM 1117 CA PHE A 70 -2.828 22.860 -5.099 1.00 0.00 C ATOM 1118 C PHE A 70 -2.154 22.481 -6.419 1.00 0.00 C ATOM 1119 O PHE A 70 -1.447 21.503 -6.496 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.305 22.444 -5.095 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.474 21.052 -5.664 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.692 19.996 -5.182 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.418 20.819 -6.672 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.854 18.712 -5.708 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.579 19.538 -7.196 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.798 18.481 -6.715 1.00 0.00 C ATOM 0 H PHE A 70 -3.646 24.788 -4.733 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.314 22.346 -4.287 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.693 22.475 -4.077 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -4.889 23.154 -5.680 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.964 20.174 -4.404 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.022 21.633 -7.044 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.250 17.897 -5.337 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.307 19.361 -7.974 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.924 17.488 -7.121 1.00 0.00 H new ATOM 1136 N GLN A 71 -2.357 23.252 -7.449 1.00 0.00 N ATOM 1137 CA GLN A 71 -1.711 22.937 -8.756 1.00 0.00 C ATOM 1138 C GLN A 71 -0.177 22.943 -8.617 1.00 0.00 C ATOM 1139 O GLN A 71 0.494 22.013 -9.025 1.00 0.00 O ATOM 1140 CB GLN A 71 -2.162 23.993 -9.788 1.00 0.00 C ATOM 1141 CG GLN A 71 -1.141 24.122 -10.929 1.00 0.00 C ATOM 1142 CD GLN A 71 -1.760 24.917 -12.082 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -2.965 24.962 -12.225 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -0.982 25.556 -12.914 1.00 0.00 N ATOM 0 H GLN A 71 -2.942 24.087 -7.444 1.00 0.00 H new ATOM 0 HA GLN A 71 -2.011 21.942 -9.086 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -3.134 23.716 -10.195 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.286 24.958 -9.296 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.241 24.622 -10.571 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.840 23.133 -11.275 1.00 0.00 H new ATOM 0 HE21 GLN A 71 0.030 25.520 -12.796 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.387 26.091 -13.682 1.00 0.00 H new ATOM 1153 N GLU A 72 0.388 23.986 -8.072 1.00 0.00 N ATOM 1154 CA GLU A 72 1.870 24.036 -7.948 1.00 0.00 C ATOM 1155 C GLU A 72 2.366 22.899 -7.054 1.00 0.00 C ATOM 1156 O GLU A 72 3.368 22.267 -7.330 1.00 0.00 O ATOM 1157 CB GLU A 72 2.270 25.375 -7.341 1.00 0.00 C ATOM 1158 CG GLU A 72 2.058 26.499 -8.355 1.00 0.00 C ATOM 1159 CD GLU A 72 2.466 27.829 -7.719 1.00 0.00 C ATOM 1160 OE1 GLU A 72 3.156 27.794 -6.712 1.00 0.00 O ATOM 1161 OE2 GLU A 72 2.088 28.860 -8.249 1.00 0.00 O ATOM 0 H GLU A 72 -0.109 24.800 -7.710 1.00 0.00 H new ATOM 0 HA GLU A 72 2.319 23.924 -8.935 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.679 25.567 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.315 25.345 -7.033 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.650 26.313 -9.251 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.013 26.535 -8.664 1.00 0.00 H new ATOM 1168 N PHE A 73 1.666 22.631 -5.994 1.00 0.00 N ATOM 1169 CA PHE A 73 2.079 21.538 -5.074 1.00 0.00 C ATOM 1170 C PHE A 73 2.085 20.207 -5.817 1.00 0.00 C ATOM 1171 O PHE A 73 2.885 19.336 -5.542 1.00 0.00 O ATOM 1172 CB PHE A 73 1.113 21.457 -3.888 1.00 0.00 C ATOM 1173 CG PHE A 73 1.463 20.246 -3.060 1.00 0.00 C ATOM 1174 CD1 PHE A 73 2.389 20.352 -2.019 1.00 0.00 C ATOM 1175 CD2 PHE A 73 0.871 19.013 -3.349 1.00 0.00 C ATOM 1176 CE1 PHE A 73 2.726 19.223 -1.267 1.00 0.00 C ATOM 1177 CE2 PHE A 73 1.204 17.884 -2.596 1.00 0.00 C ATOM 1178 CZ PHE A 73 2.132 17.989 -1.556 1.00 0.00 C ATOM 0 H PHE A 73 0.817 23.126 -5.721 1.00 0.00 H new ATOM 0 HA PHE A 73 3.083 21.750 -4.706 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.181 22.361 -3.283 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.085 21.388 -4.243 1.00 0.00 H new ATOM 0 HD1 PHE A 73 2.844 21.306 -1.796 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.156 18.933 -4.155 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.444 19.303 -0.464 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.745 16.932 -2.817 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.391 17.117 -0.975 1.00 0.00 H new ATOM 1188 N MET A 74 1.189 20.034 -6.738 1.00 0.00 N ATOM 1189 CA MET A 74 1.125 18.752 -7.477 1.00 0.00 C ATOM 1190 C MET A 74 2.440 18.508 -8.201 1.00 0.00 C ATOM 1191 O MET A 74 2.891 17.387 -8.327 1.00 0.00 O ATOM 1192 CB MET A 74 -0.013 18.797 -8.506 1.00 0.00 C ATOM 1193 CG MET A 74 -1.399 18.750 -7.809 1.00 0.00 C ATOM 1194 SD MET A 74 -2.423 17.458 -8.566 1.00 0.00 S ATOM 1195 CE MET A 74 -1.354 16.049 -8.166 1.00 0.00 C ATOM 0 H MET A 74 0.494 20.729 -7.012 1.00 0.00 H new ATOM 0 HA MET A 74 0.942 17.946 -6.766 1.00 0.00 H new ATOM 0 HB2 MET A 74 0.067 19.706 -9.102 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.081 17.956 -9.193 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.275 18.551 -6.745 1.00 0.00 H new ATOM 0 HG3 MET A 74 -1.894 19.717 -7.897 1.00 0.00 H new ATOM 0 HE1 MET A 74 -0.940 15.634 -9.085 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.542 16.381 -7.519 1.00 0.00 H new ATOM 0 HE3 MET A 74 -1.937 15.284 -7.653 1.00 0.00 H new ATOM 1205 N ALA A 75 3.047 19.533 -8.709 1.00 0.00 N ATOM 1206 CA ALA A 75 4.317 19.323 -9.453 1.00 0.00 C ATOM 1207 C ALA A 75 5.452 18.905 -8.511 1.00 0.00 C ATOM 1208 O ALA A 75 6.318 18.139 -8.881 1.00 0.00 O ATOM 1209 CB ALA A 75 4.698 20.605 -10.196 1.00 0.00 C ATOM 0 H ALA A 75 2.727 20.499 -8.645 1.00 0.00 H new ATOM 0 HA ALA A 75 4.163 18.517 -10.171 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.629 20.447 -10.740 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.907 20.867 -10.899 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.829 21.416 -9.479 1.00 0.00 H new ATOM 1215 N PHE A 76 5.464 19.395 -7.309 1.00 0.00 N ATOM 1216 CA PHE A 76 6.561 19.009 -6.363 1.00 0.00 C ATOM 1217 C PHE A 76 6.559 17.508 -6.136 1.00 0.00 C ATOM 1218 O PHE A 76 7.585 16.879 -6.036 1.00 0.00 O ATOM 1219 CB PHE A 76 6.356 19.713 -5.023 1.00 0.00 C ATOM 1220 CG PHE A 76 7.448 19.308 -4.056 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.779 19.657 -4.315 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.128 18.588 -2.895 1.00 0.00 C ATOM 1223 CE1 PHE A 76 9.788 19.288 -3.416 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.137 18.222 -1.997 1.00 0.00 C ATOM 1225 CZ PHE A 76 9.466 18.572 -2.257 1.00 0.00 C ATOM 0 H PHE A 76 4.771 20.042 -6.934 1.00 0.00 H new ATOM 0 HA PHE A 76 7.515 19.306 -6.798 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.366 20.794 -5.165 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.380 19.455 -4.612 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.028 20.211 -5.208 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.102 18.316 -2.694 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.815 19.556 -3.617 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.889 17.669 -1.103 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.244 18.290 -1.563 1.00 0.00 H new ATOM 1235 N VAL A 77 5.407 16.951 -6.025 1.00 0.00 N ATOM 1236 CA VAL A 77 5.276 15.490 -5.771 1.00 0.00 C ATOM 1237 C VAL A 77 5.829 14.714 -6.962 1.00 0.00 C ATOM 1238 O VAL A 77 6.401 13.657 -6.816 1.00 0.00 O ATOM 1239 CB VAL A 77 3.782 15.152 -5.556 1.00 0.00 C ATOM 1240 CG1 VAL A 77 3.620 14.083 -4.467 1.00 0.00 C ATOM 1241 CG2 VAL A 77 3.038 16.426 -5.144 1.00 0.00 C ATOM 0 H VAL A 77 4.520 17.450 -6.100 1.00 0.00 H new ATOM 0 HA VAL A 77 5.840 15.212 -4.881 1.00 0.00 H new ATOM 0 HB VAL A 77 3.367 14.761 -6.485 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.562 13.860 -4.331 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.147 13.177 -4.766 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.036 14.452 -3.530 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.983 16.198 -4.990 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.464 16.813 -4.219 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.136 17.175 -5.930 1.00 0.00 H new ATOM 1251 N SER A 78 5.635 15.223 -8.138 1.00 0.00 N ATOM 1252 CA SER A 78 6.126 14.511 -9.343 1.00 0.00 C ATOM 1253 C SER A 78 7.649 14.408 -9.307 1.00 0.00 C ATOM 1254 O SER A 78 8.225 13.400 -9.671 1.00 0.00 O ATOM 1255 CB SER A 78 5.695 15.288 -10.591 1.00 0.00 C ATOM 1256 OG SER A 78 6.628 15.058 -11.638 1.00 0.00 O ATOM 0 H SER A 78 5.156 16.105 -8.319 1.00 0.00 H new ATOM 0 HA SER A 78 5.705 13.506 -9.366 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.699 14.974 -10.902 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.638 16.353 -10.368 1.00 0.00 H new ATOM 0 HG SER A 78 7.026 15.910 -11.915 1.00 0.00 H new ATOM 1262 N MET A 79 8.308 15.451 -8.894 1.00 0.00 N ATOM 1263 CA MET A 79 9.795 15.420 -8.862 1.00 0.00 C ATOM 1264 C MET A 79 10.315 14.544 -7.715 1.00 0.00 C ATOM 1265 O MET A 79 11.244 13.778 -7.880 1.00 0.00 O ATOM 1266 CB MET A 79 10.303 16.845 -8.678 1.00 0.00 C ATOM 1267 CG MET A 79 9.939 17.698 -9.894 1.00 0.00 C ATOM 1268 SD MET A 79 9.987 19.452 -9.434 1.00 0.00 S ATOM 1269 CE MET A 79 11.572 19.444 -8.554 1.00 0.00 C ATOM 0 H MET A 79 7.883 16.323 -8.578 1.00 0.00 H new ATOM 0 HA MET A 79 10.157 14.995 -9.798 1.00 0.00 H new ATOM 0 HB2 MET A 79 9.870 17.280 -7.777 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.384 16.838 -8.540 1.00 0.00 H new ATOM 0 HG2 MET A 79 10.636 17.505 -10.709 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.945 17.432 -10.255 1.00 0.00 H new ATOM 0 HE1 MET A 79 11.962 20.460 -8.497 1.00 0.00 H new ATOM 0 HE2 MET A 79 11.427 19.054 -7.546 1.00 0.00 H new ATOM 0 HE3 MET A 79 12.282 18.812 -9.088 1.00 0.00 H new ATOM 1279 N VAL A 80 9.737 14.661 -6.552 1.00 0.00 N ATOM 1280 CA VAL A 80 10.215 13.847 -5.391 1.00 0.00 C ATOM 1281 C VAL A 80 10.056 12.362 -5.698 1.00 0.00 C ATOM 1282 O VAL A 80 10.880 11.546 -5.335 1.00 0.00 O ATOM 1283 CB VAL A 80 9.419 14.198 -4.132 1.00 0.00 C ATOM 1284 CG1 VAL A 80 9.852 13.284 -2.981 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.691 15.652 -3.748 1.00 0.00 C ATOM 0 H VAL A 80 8.954 15.284 -6.352 1.00 0.00 H new ATOM 0 HA VAL A 80 11.268 14.071 -5.219 1.00 0.00 H new ATOM 0 HB VAL A 80 8.355 14.062 -4.327 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.285 13.534 -2.084 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.664 12.245 -3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.916 13.422 -2.788 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.125 15.904 -2.851 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.755 15.784 -3.554 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.387 16.307 -4.565 1.00 0.00 H new ATOM 1295 N THR A 81 8.996 12.008 -6.357 1.00 0.00 N ATOM 1296 CA THR A 81 8.759 10.577 -6.687 1.00 0.00 C ATOM 1297 C THR A 81 9.917 10.082 -7.536 1.00 0.00 C ATOM 1298 O THR A 81 10.392 8.974 -7.383 1.00 0.00 O ATOM 1299 CB THR A 81 7.459 10.438 -7.475 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.377 10.926 -6.697 1.00 0.00 O ATOM 1301 CG2 THR A 81 7.219 8.966 -7.821 1.00 0.00 C ATOM 0 H THR A 81 8.276 12.652 -6.685 1.00 0.00 H new ATOM 0 HA THR A 81 8.684 9.992 -5.771 1.00 0.00 H new ATOM 0 HB THR A 81 7.533 11.016 -8.396 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.331 11.902 -6.777 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.290 8.871 -8.383 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.048 8.594 -8.424 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.148 8.383 -6.903 1.00 0.00 H new ATOM 1309 N THR A 82 10.373 10.900 -8.435 1.00 0.00 N ATOM 1310 CA THR A 82 11.500 10.492 -9.304 1.00 0.00 C ATOM 1311 C THR A 82 12.648 10.024 -8.406 1.00 0.00 C ATOM 1312 O THR A 82 13.301 9.035 -8.677 1.00 0.00 O ATOM 1313 CB THR A 82 11.942 11.705 -10.130 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.792 12.402 -10.589 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.756 11.244 -11.333 1.00 0.00 C ATOM 0 H THR A 82 10.011 11.838 -8.605 1.00 0.00 H new ATOM 0 HA THR A 82 11.207 9.686 -9.976 1.00 0.00 H new ATOM 0 HB THR A 82 12.553 12.359 -9.508 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.231 11.796 -11.116 1.00 0.00 H new ATOM 0 HG21 THR A 82 13.067 12.111 -11.916 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.637 10.702 -10.990 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.147 10.588 -11.955 1.00 0.00 H new ATOM 1323 N ALA A 83 12.868 10.709 -7.314 1.00 0.00 N ATOM 1324 CA ALA A 83 13.938 10.283 -6.370 1.00 0.00 C ATOM 1325 C ALA A 83 13.608 8.872 -5.886 1.00 0.00 C ATOM 1326 O ALA A 83 14.474 8.037 -5.715 1.00 0.00 O ATOM 1327 CB ALA A 83 13.993 11.243 -5.173 1.00 0.00 C ATOM 0 H ALA A 83 12.352 11.544 -7.037 1.00 0.00 H new ATOM 0 HA ALA A 83 14.907 10.296 -6.869 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.778 10.925 -4.487 1.00 0.00 H new ATOM 0 HB2 ALA A 83 14.206 12.252 -5.525 1.00 0.00 H new ATOM 0 HB3 ALA A 83 13.034 11.235 -4.655 1.00 0.00 H new ATOM 1333 N CYS A 84 12.350 8.610 -5.663 1.00 0.00 N ATOM 1334 CA CYS A 84 11.937 7.265 -5.188 1.00 0.00 C ATOM 1335 C CYS A 84 12.397 6.215 -6.204 1.00 0.00 C ATOM 1336 O CYS A 84 12.768 5.116 -5.843 1.00 0.00 O ATOM 1337 CB CYS A 84 10.410 7.220 -5.043 1.00 0.00 C ATOM 1338 SG CYS A 84 9.952 5.910 -3.881 1.00 0.00 S ATOM 0 H CYS A 84 11.588 9.276 -5.791 1.00 0.00 H new ATOM 0 HA CYS A 84 12.391 7.057 -4.219 1.00 0.00 H new ATOM 0 HB2 CYS A 84 10.039 8.182 -4.688 1.00 0.00 H new ATOM 0 HB3 CYS A 84 9.947 7.038 -6.013 1.00 0.00 H new ATOM 0 HG CYS A 84 8.658 5.873 -3.757 1.00 0.00 H new ATOM 1344 N HIS A 85 12.387 6.542 -7.472 1.00 0.00 N ATOM 1345 CA HIS A 85 12.837 5.548 -8.484 1.00 0.00 C ATOM 1346 C HIS A 85 14.286 5.178 -8.180 1.00 0.00 C ATOM 1347 O HIS A 85 14.675 4.029 -8.248 1.00 0.00 O ATOM 1348 CB HIS A 85 12.758 6.168 -9.881 1.00 0.00 C ATOM 1349 CG HIS A 85 13.194 5.155 -10.902 1.00 0.00 C ATOM 1350 ND1 HIS A 85 14.519 5.011 -11.291 1.00 0.00 N ATOM 1351 CD2 HIS A 85 12.487 4.226 -11.626 1.00 0.00 C ATOM 1352 CE1 HIS A 85 14.567 4.028 -12.211 1.00 0.00 C ATOM 1353 NE2 HIS A 85 13.357 3.520 -12.448 1.00 0.00 N ATOM 0 H HIS A 85 12.090 7.444 -7.844 1.00 0.00 H new ATOM 0 HA HIS A 85 12.202 4.663 -8.448 1.00 0.00 H new ATOM 0 HB2 HIS A 85 11.739 6.495 -10.089 1.00 0.00 H new ATOM 0 HB3 HIS A 85 13.393 7.052 -9.935 1.00 0.00 H new ATOM 0 HD2 HIS A 85 11.420 4.069 -11.566 1.00 0.00 H new ATOM 0 HE1 HIS A 85 15.472 3.693 -12.696 1.00 0.00 H new ATOM 0 HE2 HIS A 85 13.120 2.770 -13.097 1.00 0.00 H new ATOM 1362 N GLU A 86 15.085 6.145 -7.820 1.00 0.00 N ATOM 1363 CA GLU A 86 16.503 5.853 -7.485 1.00 0.00 C ATOM 1364 C GLU A 86 16.538 4.889 -6.298 1.00 0.00 C ATOM 1365 O GLU A 86 17.334 3.973 -6.247 1.00 0.00 O ATOM 1366 CB GLU A 86 17.217 7.156 -7.118 1.00 0.00 C ATOM 1367 CG GLU A 86 18.688 6.868 -6.815 1.00 0.00 C ATOM 1368 CD GLU A 86 19.422 8.188 -6.575 1.00 0.00 C ATOM 1369 OE1 GLU A 86 18.830 9.225 -6.824 1.00 0.00 O ATOM 1370 OE2 GLU A 86 20.565 8.139 -6.151 1.00 0.00 O ATOM 0 H GLU A 86 14.814 7.125 -7.744 1.00 0.00 H new ATOM 0 HA GLU A 86 17.006 5.401 -8.340 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.137 7.869 -7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 86 16.739 7.612 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.772 6.227 -5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 86 19.144 6.331 -7.647 1.00 0.00 H new ATOM 1377 N PHE A 87 15.669 5.093 -5.346 1.00 0.00 N ATOM 1378 CA PHE A 87 15.629 4.198 -4.161 1.00 0.00 C ATOM 1379 C PHE A 87 15.122 2.832 -4.595 1.00 0.00 C ATOM 1380 O PHE A 87 15.630 1.808 -4.183 1.00 0.00 O ATOM 1381 CB PHE A 87 14.677 4.774 -3.114 1.00 0.00 C ATOM 1382 CG PHE A 87 14.703 3.893 -1.890 1.00 0.00 C ATOM 1383 CD1 PHE A 87 13.818 2.812 -1.782 1.00 0.00 C ATOM 1384 CD2 PHE A 87 15.621 4.151 -0.867 1.00 0.00 C ATOM 1385 CE1 PHE A 87 13.852 1.991 -0.648 1.00 0.00 C ATOM 1386 CE2 PHE A 87 15.656 3.329 0.266 1.00 0.00 C ATOM 1387 CZ PHE A 87 14.772 2.249 0.375 1.00 0.00 C ATOM 0 H PHE A 87 14.982 5.847 -5.341 1.00 0.00 H new ATOM 0 HA PHE A 87 16.628 4.111 -3.734 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.974 5.790 -2.853 1.00 0.00 H new ATOM 0 HB3 PHE A 87 13.665 4.831 -3.516 1.00 0.00 H new ATOM 0 HD1 PHE A 87 13.110 2.612 -2.573 1.00 0.00 H new ATOM 0 HD2 PHE A 87 16.303 4.984 -0.951 1.00 0.00 H new ATOM 0 HE1 PHE A 87 13.169 1.159 -0.563 1.00 0.00 H new ATOM 0 HE2 PHE A 87 16.365 3.528 1.056 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.800 1.615 1.249 1.00 0.00 H new ATOM 1397 N PHE A 88 14.128 2.809 -5.443 1.00 0.00 N ATOM 1398 CA PHE A 88 13.589 1.509 -5.930 1.00 0.00 C ATOM 1399 C PHE A 88 14.285 1.165 -7.236 1.00 0.00 C ATOM 1400 O PHE A 88 13.708 1.211 -8.304 1.00 0.00 O ATOM 1401 CB PHE A 88 12.070 1.606 -6.144 1.00 0.00 C ATOM 1402 CG PHE A 88 11.361 1.425 -4.819 1.00 0.00 C ATOM 1403 CD1 PHE A 88 11.504 0.221 -4.116 1.00 0.00 C ATOM 1404 CD2 PHE A 88 10.571 2.456 -4.288 1.00 0.00 C ATOM 1405 CE1 PHE A 88 10.858 0.046 -2.888 1.00 0.00 C ATOM 1406 CE2 PHE A 88 9.927 2.279 -3.058 1.00 0.00 C ATOM 1407 CZ PHE A 88 10.070 1.075 -2.358 1.00 0.00 C ATOM 0 H PHE A 88 13.666 3.637 -5.819 1.00 0.00 H new ATOM 0 HA PHE A 88 13.774 0.729 -5.192 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.814 2.573 -6.576 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.742 0.844 -6.851 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.114 -0.572 -4.523 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.460 3.385 -4.828 1.00 0.00 H new ATOM 0 HE1 PHE A 88 10.967 -0.883 -2.348 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.319 3.072 -2.648 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.572 0.940 -1.409 1.00 0.00 H new ATOM 1464 N MET B 0 -4.137 9.856 4.219 1.00 0.00 N ATOM 1465 CA MET B 0 -3.499 9.406 5.486 1.00 0.00 C ATOM 1466 C MET B 0 -2.047 9.010 5.218 1.00 0.00 C ATOM 1467 O MET B 0 -1.689 7.851 5.264 1.00 0.00 O ATOM 1468 CB MET B 0 -4.270 8.208 6.046 1.00 0.00 C ATOM 1469 CG MET B 0 -5.635 8.681 6.550 1.00 0.00 C ATOM 1470 SD MET B 0 -6.559 7.275 7.220 1.00 0.00 S ATOM 1471 CE MET B 0 -6.756 6.355 5.674 1.00 0.00 C ATOM 0 H1 MET B 0 -5.005 10.387 4.437 1.00 0.00 H new ATOM 0 H2 MET B 0 -3.478 10.468 3.697 1.00 0.00 H new ATOM 0 H3 MET B 0 -4.375 9.028 3.637 1.00 0.00 H new ATOM 0 HA MET B 0 -3.518 10.219 6.212 1.00 0.00 H new ATOM 0 HB2 MET B 0 -4.397 7.449 5.274 1.00 0.00 H new ATOM 0 HB3 MET B 0 -3.709 7.746 6.858 1.00 0.00 H new ATOM 0 HG2 MET B 0 -5.506 9.443 7.319 1.00 0.00 H new ATOM 0 HG3 MET B 0 -6.195 9.141 5.736 1.00 0.00 H new ATOM 0 HE1 MET B 0 -7.624 5.700 5.748 1.00 0.00 H new ATOM 0 HE2 MET B 0 -6.899 7.054 4.850 1.00 0.00 H new ATOM 0 HE3 MET B 0 -5.864 5.756 5.491 1.00 0.00 H new ATOM 1483 N SER B 1 -1.208 9.970 4.935 1.00 0.00 N ATOM 1484 CA SER B 1 0.225 9.651 4.660 1.00 0.00 C ATOM 1485 C SER B 1 0.306 8.539 3.616 1.00 0.00 C ATOM 1486 O SER B 1 1.297 7.846 3.498 1.00 0.00 O ATOM 1487 CB SER B 1 0.905 9.191 5.951 1.00 0.00 C ATOM 1488 OG SER B 1 0.521 7.851 6.232 1.00 0.00 O ATOM 0 H SER B 1 -1.451 10.959 4.882 1.00 0.00 H new ATOM 0 HA SER B 1 0.729 10.541 4.284 1.00 0.00 H new ATOM 0 HB2 SER B 1 1.988 9.257 5.849 1.00 0.00 H new ATOM 0 HB3 SER B 1 0.622 9.843 6.777 1.00 0.00 H new ATOM 0 HG SER B 1 -0.454 7.801 6.318 1.00 0.00 H new ATOM 1494 N GLU B 2 -0.732 8.379 2.851 1.00 0.00 N ATOM 1495 CA GLU B 2 -0.746 7.333 1.794 1.00 0.00 C ATOM 1496 C GLU B 2 0.119 7.782 0.624 1.00 0.00 C ATOM 1497 O GLU B 2 0.380 7.035 -0.295 1.00 0.00 O ATOM 1498 CB GLU B 2 -2.185 7.114 1.341 1.00 0.00 C ATOM 1499 CG GLU B 2 -2.934 6.418 2.471 1.00 0.00 C ATOM 1500 CD GLU B 2 -4.388 6.176 2.063 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -4.802 6.733 1.059 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -5.060 5.432 2.757 1.00 0.00 O ATOM 0 H GLU B 2 -1.584 8.936 2.913 1.00 0.00 H new ATOM 0 HA GLU B 2 -0.345 6.397 2.183 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -2.658 8.066 1.100 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -2.211 6.507 0.436 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -2.452 5.470 2.708 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -2.898 7.029 3.373 1.00 0.00 H new ATOM 1509 N LEU B 3 0.554 9.004 0.653 1.00 0.00 N ATOM 1510 CA LEU B 3 1.397 9.534 -0.450 1.00 0.00 C ATOM 1511 C LEU B 3 2.567 8.587 -0.713 1.00 0.00 C ATOM 1512 O LEU B 3 3.123 8.573 -1.784 1.00 0.00 O ATOM 1513 CB LEU B 3 1.902 10.930 -0.044 1.00 0.00 C ATOM 1514 CG LEU B 3 3.090 11.392 -0.929 1.00 0.00 C ATOM 1515 CD1 LEU B 3 2.998 12.905 -1.174 1.00 0.00 C ATOM 1516 CD2 LEU B 3 4.428 11.081 -0.230 1.00 0.00 C ATOM 0 H LEU B 3 0.360 9.668 1.402 1.00 0.00 H new ATOM 0 HA LEU B 3 0.817 9.610 -1.369 1.00 0.00 H new ATOM 0 HB2 LEU B 3 1.087 11.649 -0.125 1.00 0.00 H new ATOM 0 HB3 LEU B 3 2.211 10.915 1.001 1.00 0.00 H new ATOM 0 HG LEU B 3 3.043 10.858 -1.878 1.00 0.00 H new ATOM 0 HD11 LEU B 3 3.834 13.224 -1.796 1.00 0.00 H new ATOM 0 HD12 LEU B 3 2.061 13.135 -1.680 1.00 0.00 H new ATOM 0 HD13 LEU B 3 3.034 13.431 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU B 3 5.253 11.410 -0.861 1.00 0.00 H new ATOM 0 HD22 LEU B 3 4.470 11.605 0.725 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.508 10.008 -0.058 1.00 0.00 H new ATOM 1528 N GLU B 4 2.950 7.793 0.245 1.00 0.00 N ATOM 1529 CA GLU B 4 4.090 6.856 0.002 1.00 0.00 C ATOM 1530 C GLU B 4 3.659 5.789 -1.002 1.00 0.00 C ATOM 1531 O GLU B 4 4.404 5.413 -1.886 1.00 0.00 O ATOM 1532 CB GLU B 4 4.496 6.199 1.328 1.00 0.00 C ATOM 1533 CG GLU B 4 5.750 5.342 1.124 1.00 0.00 C ATOM 1534 CD GLU B 4 5.375 4.020 0.446 1.00 0.00 C ATOM 1535 OE1 GLU B 4 4.219 3.638 0.529 1.00 0.00 O ATOM 1536 OE2 GLU B 4 6.251 3.410 -0.143 1.00 0.00 O ATOM 0 H GLU B 4 2.533 7.748 1.175 1.00 0.00 H new ATOM 0 HA GLU B 4 4.942 7.403 -0.401 1.00 0.00 H new ATOM 0 HB2 GLU B 4 4.687 6.965 2.080 1.00 0.00 H new ATOM 0 HB3 GLU B 4 3.680 5.581 1.703 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.474 5.881 0.513 1.00 0.00 H new ATOM 0 HG3 GLU B 4 6.227 5.146 2.084 1.00 0.00 H new ATOM 1543 N LYS B 5 2.456 5.317 -0.881 1.00 0.00 N ATOM 1544 CA LYS B 5 1.948 4.292 -1.832 1.00 0.00 C ATOM 1545 C LYS B 5 1.739 4.949 -3.190 1.00 0.00 C ATOM 1546 O LYS B 5 1.866 4.329 -4.222 1.00 0.00 O ATOM 1547 CB LYS B 5 0.621 3.746 -1.314 1.00 0.00 C ATOM 1548 CG LYS B 5 0.881 2.902 -0.061 1.00 0.00 C ATOM 1549 CD LYS B 5 -0.449 2.481 0.584 1.00 0.00 C ATOM 1550 CE LYS B 5 -0.970 3.600 1.493 1.00 0.00 C ATOM 1551 NZ LYS B 5 -2.209 3.134 2.177 1.00 0.00 N ATOM 0 H LYS B 5 1.794 5.599 -0.158 1.00 0.00 H new ATOM 0 HA LYS B 5 2.662 3.474 -1.926 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -0.058 4.566 -1.081 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.138 3.141 -2.081 1.00 0.00 H new ATOM 0 HG2 LYS B 5 1.461 2.018 -0.324 1.00 0.00 H new ATOM 0 HG3 LYS B 5 1.475 3.472 0.653 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -1.183 2.259 -0.190 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.309 1.568 1.162 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.213 3.870 2.229 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -1.178 4.495 0.907 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -3.039 3.573 1.730 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -2.281 2.099 2.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.174 3.403 3.181 1.00 0.00 H new ATOM 1565 N ALA B 6 1.391 6.202 -3.179 1.00 0.00 N ATOM 1566 CA ALA B 6 1.139 6.932 -4.446 1.00 0.00 C ATOM 1567 C ALA B 6 2.440 7.132 -5.222 1.00 0.00 C ATOM 1568 O ALA B 6 2.471 7.011 -6.429 1.00 0.00 O ATOM 1569 CB ALA B 6 0.510 8.290 -4.117 1.00 0.00 C ATOM 0 H ALA B 6 1.269 6.758 -2.333 1.00 0.00 H new ATOM 0 HA ALA B 6 0.461 6.349 -5.069 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.320 8.836 -5.041 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -0.430 8.137 -3.586 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.192 8.864 -3.490 1.00 0.00 H new ATOM 1575 N MET B 7 3.510 7.434 -4.550 1.00 0.00 N ATOM 1576 CA MET B 7 4.799 7.632 -5.263 1.00 0.00 C ATOM 1577 C MET B 7 5.248 6.304 -5.853 1.00 0.00 C ATOM 1578 O MET B 7 5.752 6.234 -6.956 1.00 0.00 O ATOM 1579 CB MET B 7 5.863 8.140 -4.284 1.00 0.00 C ATOM 1580 CG MET B 7 5.544 9.576 -3.866 1.00 0.00 C ATOM 1581 SD MET B 7 6.949 10.259 -2.952 1.00 0.00 S ATOM 1582 CE MET B 7 6.538 12.006 -3.181 1.00 0.00 C ATOM 0 H MET B 7 3.549 7.553 -3.538 1.00 0.00 H new ATOM 0 HA MET B 7 4.666 8.366 -6.058 1.00 0.00 H new ATOM 0 HB2 MET B 7 5.898 7.496 -3.405 1.00 0.00 H new ATOM 0 HB3 MET B 7 6.848 8.098 -4.750 1.00 0.00 H new ATOM 0 HG2 MET B 7 5.337 10.185 -4.746 1.00 0.00 H new ATOM 0 HG3 MET B 7 4.648 9.596 -3.246 1.00 0.00 H new ATOM 0 HE1 MET B 7 7.076 12.606 -2.447 1.00 0.00 H new ATOM 0 HE2 MET B 7 6.824 12.319 -4.185 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.465 12.148 -3.049 1.00 0.00 H new ATOM 1592 N VAL B 8 5.068 5.249 -5.121 1.00 0.00 N ATOM 1593 CA VAL B 8 5.484 3.913 -5.625 1.00 0.00 C ATOM 1594 C VAL B 8 4.648 3.533 -6.847 1.00 0.00 C ATOM 1595 O VAL B 8 5.132 2.910 -7.765 1.00 0.00 O ATOM 1596 CB VAL B 8 5.283 2.861 -4.535 1.00 0.00 C ATOM 1597 CG1 VAL B 8 5.620 1.477 -5.104 1.00 0.00 C ATOM 1598 CG2 VAL B 8 6.197 3.172 -3.343 1.00 0.00 C ATOM 0 H VAL B 8 4.649 5.251 -4.191 1.00 0.00 H new ATOM 0 HA VAL B 8 6.537 3.956 -5.903 1.00 0.00 H new ATOM 0 HB VAL B 8 4.246 2.873 -4.199 1.00 0.00 H new ATOM 0 HG11 VAL B 8 5.479 0.722 -4.331 1.00 0.00 H new ATOM 0 HG12 VAL B 8 4.964 1.261 -5.947 1.00 0.00 H new ATOM 0 HG13 VAL B 8 6.657 1.464 -5.439 1.00 0.00 H new ATOM 0 HG21 VAL B 8 6.052 2.420 -2.567 1.00 0.00 H new ATOM 0 HG22 VAL B 8 7.237 3.160 -3.669 1.00 0.00 H new ATOM 0 HG23 VAL B 8 5.953 4.157 -2.944 1.00 0.00 H new ATOM 1608 N ALA B 9 3.391 3.876 -6.848 1.00 0.00 N ATOM 1609 CA ALA B 9 2.514 3.503 -7.999 1.00 0.00 C ATOM 1610 C ALA B 9 2.899 4.302 -9.237 1.00 0.00 C ATOM 1611 O ALA B 9 2.804 3.827 -10.351 1.00 0.00 O ATOM 1612 CB ALA B 9 1.062 3.802 -7.652 1.00 0.00 C ATOM 0 H ALA B 9 2.930 4.399 -6.103 1.00 0.00 H new ATOM 0 HA ALA B 9 2.639 2.439 -8.202 1.00 0.00 H new ATOM 0 HB1 ALA B 9 0.424 3.529 -8.492 1.00 0.00 H new ATOM 0 HB2 ALA B 9 0.772 3.225 -6.774 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.950 4.866 -7.441 1.00 0.00 H new ATOM 1618 N LEU B 10 3.323 5.513 -9.052 1.00 0.00 N ATOM 1619 CA LEU B 10 3.705 6.355 -10.215 1.00 0.00 C ATOM 1620 C LEU B 10 4.820 5.635 -10.980 1.00 0.00 C ATOM 1621 O LEU B 10 4.851 5.607 -12.195 1.00 0.00 O ATOM 1622 CB LEU B 10 4.224 7.712 -9.668 1.00 0.00 C ATOM 1623 CG LEU B 10 3.405 8.904 -10.200 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.611 9.049 -11.715 1.00 0.00 C ATOM 1625 CD2 LEU B 10 1.902 8.727 -9.876 1.00 0.00 C ATOM 0 H LEU B 10 3.423 5.961 -8.141 1.00 0.00 H new ATOM 0 HA LEU B 10 2.860 6.526 -10.882 1.00 0.00 H new ATOM 0 HB2 LEU B 10 4.183 7.702 -8.579 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.270 7.838 -9.947 1.00 0.00 H new ATOM 0 HG LEU B 10 3.754 9.811 -9.706 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.028 9.894 -12.082 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.667 9.218 -11.924 1.00 0.00 H new ATOM 0 HD13 LEU B 10 3.284 8.138 -12.216 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.344 9.580 -10.261 1.00 0.00 H new ATOM 0 HD22 LEU B 10 1.535 7.813 -10.342 1.00 0.00 H new ATOM 0 HD23 LEU B 10 1.768 8.663 -8.796 1.00 0.00 H new ATOM 1637 N ILE B 11 5.733 5.062 -10.257 1.00 0.00 N ATOM 1638 CA ILE B 11 6.869 4.338 -10.885 1.00 0.00 C ATOM 1639 C ILE B 11 6.412 2.978 -11.441 1.00 0.00 C ATOM 1640 O ILE B 11 6.914 2.512 -12.445 1.00 0.00 O ATOM 1641 CB ILE B 11 7.964 4.153 -9.823 1.00 0.00 C ATOM 1642 CG1 ILE B 11 8.588 5.525 -9.516 1.00 0.00 C ATOM 1643 CG2 ILE B 11 9.045 3.187 -10.335 1.00 0.00 C ATOM 1644 CD1 ILE B 11 9.389 5.467 -8.213 1.00 0.00 C ATOM 0 H ILE B 11 5.742 5.064 -9.237 1.00 0.00 H new ATOM 0 HA ILE B 11 7.258 4.915 -11.724 1.00 0.00 H new ATOM 0 HB ILE B 11 7.529 3.731 -8.917 1.00 0.00 H new ATOM 0 HG12 ILE B 11 9.238 5.828 -10.337 1.00 0.00 H new ATOM 0 HG13 ILE B 11 7.804 6.278 -9.435 1.00 0.00 H new ATOM 0 HG21 ILE B 11 9.815 3.065 -9.573 1.00 0.00 H new ATOM 0 HG22 ILE B 11 8.594 2.219 -10.554 1.00 0.00 H new ATOM 0 HG23 ILE B 11 9.494 3.591 -11.242 1.00 0.00 H new ATOM 0 HD11 ILE B 11 9.824 6.445 -8.010 1.00 0.00 H new ATOM 0 HD12 ILE B 11 8.729 5.186 -7.392 1.00 0.00 H new ATOM 0 HD13 ILE B 11 10.185 4.728 -8.308 1.00 0.00 H new ATOM 1656 N ASP B 12 5.489 2.325 -10.782 1.00 0.00 N ATOM 1657 CA ASP B 12 5.033 0.982 -11.260 1.00 0.00 C ATOM 1658 C ASP B 12 4.447 1.074 -12.676 1.00 0.00 C ATOM 1659 O ASP B 12 4.714 0.242 -13.521 1.00 0.00 O ATOM 1660 CB ASP B 12 3.957 0.453 -10.305 1.00 0.00 C ATOM 1661 CG ASP B 12 3.480 -0.926 -10.771 1.00 0.00 C ATOM 1662 OD1 ASP B 12 3.873 -1.337 -11.850 1.00 0.00 O ATOM 1663 OD2 ASP B 12 2.739 -1.553 -10.032 1.00 0.00 O ATOM 0 H ASP B 12 5.031 2.662 -9.935 1.00 0.00 H new ATOM 0 HA ASP B 12 5.890 0.309 -11.282 1.00 0.00 H new ATOM 0 HB2 ASP B 12 4.357 0.386 -9.293 1.00 0.00 H new ATOM 0 HB3 ASP B 12 3.116 1.146 -10.270 1.00 0.00 H new ATOM 1668 N VAL B 13 3.640 2.064 -12.936 1.00 0.00 N ATOM 1669 CA VAL B 13 3.019 2.202 -14.289 1.00 0.00 C ATOM 1670 C VAL B 13 4.079 2.667 -15.304 1.00 0.00 C ATOM 1671 O VAL B 13 3.968 2.425 -16.495 1.00 0.00 O ATOM 1672 CB VAL B 13 1.818 3.190 -14.182 1.00 0.00 C ATOM 1673 CG1 VAL B 13 1.850 4.263 -15.282 1.00 0.00 C ATOM 1674 CG2 VAL B 13 0.493 2.412 -14.283 1.00 0.00 C ATOM 0 H VAL B 13 3.380 2.789 -12.267 1.00 0.00 H new ATOM 0 HA VAL B 13 2.640 1.244 -14.646 1.00 0.00 H new ATOM 0 HB VAL B 13 1.897 3.691 -13.217 1.00 0.00 H new ATOM 0 HG11 VAL B 13 0.994 4.928 -15.167 1.00 0.00 H new ATOM 0 HG12 VAL B 13 2.771 4.840 -15.201 1.00 0.00 H new ATOM 0 HG13 VAL B 13 1.807 3.783 -16.260 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -0.344 3.107 -14.208 1.00 0.00 H new ATOM 0 HG22 VAL B 13 0.448 1.892 -15.240 1.00 0.00 H new ATOM 0 HG23 VAL B 13 0.435 1.685 -13.473 1.00 0.00 H new ATOM 1684 N PHE B 14 5.104 3.325 -14.854 1.00 0.00 N ATOM 1685 CA PHE B 14 6.148 3.787 -15.808 1.00 0.00 C ATOM 1686 C PHE B 14 6.741 2.571 -16.519 1.00 0.00 C ATOM 1687 O PHE B 14 6.978 2.587 -17.710 1.00 0.00 O ATOM 1688 CB PHE B 14 7.247 4.518 -15.033 1.00 0.00 C ATOM 1689 CG PHE B 14 8.386 4.857 -15.965 1.00 0.00 C ATOM 1690 CD1 PHE B 14 8.327 6.008 -16.759 1.00 0.00 C ATOM 1691 CD2 PHE B 14 9.499 4.012 -16.039 1.00 0.00 C ATOM 1692 CE1 PHE B 14 9.383 6.314 -17.626 1.00 0.00 C ATOM 1693 CE2 PHE B 14 10.554 4.317 -16.904 1.00 0.00 C ATOM 1694 CZ PHE B 14 10.497 5.468 -17.700 1.00 0.00 C ATOM 0 H PHE B 14 5.266 3.563 -13.875 1.00 0.00 H new ATOM 0 HA PHE B 14 5.713 4.464 -16.543 1.00 0.00 H new ATOM 0 HB2 PHE B 14 6.847 5.428 -14.586 1.00 0.00 H new ATOM 0 HB3 PHE B 14 7.607 3.893 -14.216 1.00 0.00 H new ATOM 0 HD1 PHE B 14 7.468 6.660 -16.703 1.00 0.00 H new ATOM 0 HD2 PHE B 14 9.543 3.123 -15.427 1.00 0.00 H new ATOM 0 HE1 PHE B 14 9.339 7.203 -18.238 1.00 0.00 H new ATOM 0 HE2 PHE B 14 11.413 3.665 -16.958 1.00 0.00 H new ATOM 0 HZ PHE B 14 11.311 5.703 -18.370 1.00 0.00 H new ATOM 1704 N HIS B 15 6.976 1.518 -15.795 1.00 0.00 N ATOM 1705 CA HIS B 15 7.550 0.288 -16.410 1.00 0.00 C ATOM 1706 C HIS B 15 6.456 -0.521 -17.117 1.00 0.00 C ATOM 1707 O HIS B 15 6.737 -1.327 -17.983 1.00 0.00 O ATOM 1708 CB HIS B 15 8.186 -0.562 -15.314 1.00 0.00 C ATOM 1709 CG HIS B 15 8.992 -1.675 -15.928 1.00 0.00 C ATOM 1710 ND1 HIS B 15 8.580 -3.001 -15.889 1.00 0.00 N ATOM 1711 CD2 HIS B 15 10.193 -1.676 -16.595 1.00 0.00 C ATOM 1712 CE1 HIS B 15 9.519 -3.736 -16.513 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.520 -2.976 -16.961 1.00 0.00 N ATOM 0 H HIS B 15 6.794 1.453 -14.793 1.00 0.00 H new ATOM 0 HA HIS B 15 8.300 0.573 -17.147 1.00 0.00 H new ATOM 0 HB2 HIS B 15 8.826 0.058 -14.687 1.00 0.00 H new ATOM 0 HB3 HIS B 15 7.412 -0.976 -14.668 1.00 0.00 H new ATOM 0 HD2 HIS B 15 10.791 -0.801 -16.803 1.00 0.00 H new ATOM 0 HE1 HIS B 15 9.469 -4.808 -16.636 1.00 0.00 H new ATOM 0 HE2 HIS B 15 11.351 -3.284 -17.466 1.00 0.00 H new ATOM 1722 N GLN B 16 5.216 -0.333 -16.746 1.00 0.00 N ATOM 1723 CA GLN B 16 4.120 -1.114 -17.382 1.00 0.00 C ATOM 1724 C GLN B 16 4.170 -0.970 -18.903 1.00 0.00 C ATOM 1725 O GLN B 16 4.065 -1.948 -19.618 1.00 0.00 O ATOM 1726 CB GLN B 16 2.775 -0.589 -16.843 1.00 0.00 C ATOM 1727 CG GLN B 16 1.601 -1.043 -17.721 1.00 0.00 C ATOM 1728 CD GLN B 16 1.649 -2.559 -17.916 1.00 0.00 C ATOM 1729 OE1 GLN B 16 1.730 -3.304 -16.960 1.00 0.00 O ATOM 1730 NE2 GLN B 16 1.594 -3.053 -19.123 1.00 0.00 N ATOM 0 H GLN B 16 4.917 0.329 -16.029 1.00 0.00 H new ATOM 0 HA GLN B 16 4.234 -2.171 -17.142 1.00 0.00 H new ATOM 0 HB2 GLN B 16 2.627 -0.945 -15.823 1.00 0.00 H new ATOM 0 HB3 GLN B 16 2.799 0.500 -16.801 1.00 0.00 H new ATOM 0 HG2 GLN B 16 0.657 -0.758 -17.256 1.00 0.00 H new ATOM 0 HG3 GLN B 16 1.645 -0.542 -18.688 1.00 0.00 H new ATOM 0 HE21 GLN B 16 1.526 -2.429 -19.927 1.00 0.00 H new ATOM 0 HE22 GLN B 16 1.619 -4.063 -19.262 1.00 0.00 H new ATOM 1739 N TYR B 17 4.299 0.232 -19.409 1.00 0.00 N ATOM 1740 CA TYR B 17 4.318 0.421 -20.910 1.00 0.00 C ATOM 1741 C TYR B 17 5.699 0.853 -21.416 1.00 0.00 C ATOM 1742 O TYR B 17 6.038 0.626 -22.561 1.00 0.00 O ATOM 1743 CB TYR B 17 3.276 1.467 -21.307 1.00 0.00 C ATOM 1744 CG TYR B 17 3.706 2.818 -20.809 1.00 0.00 C ATOM 1745 CD1 TYR B 17 3.579 3.123 -19.455 1.00 0.00 C ATOM 1746 CD2 TYR B 17 4.236 3.761 -21.699 1.00 0.00 C ATOM 1747 CE1 TYR B 17 3.979 4.370 -18.981 1.00 0.00 C ATOM 1748 CE2 TYR B 17 4.640 5.013 -21.229 1.00 0.00 C ATOM 1749 CZ TYR B 17 4.511 5.320 -19.866 1.00 0.00 C ATOM 1750 OH TYR B 17 4.908 6.554 -19.393 1.00 0.00 O ATOM 0 H TYR B 17 4.392 1.088 -18.862 1.00 0.00 H new ATOM 0 HA TYR B 17 4.082 -0.539 -21.369 1.00 0.00 H new ATOM 0 HB2 TYR B 17 3.160 1.487 -22.391 1.00 0.00 H new ATOM 0 HB3 TYR B 17 2.305 1.205 -20.887 1.00 0.00 H new ATOM 0 HD1 TYR B 17 3.170 2.392 -18.773 1.00 0.00 H new ATOM 0 HD2 TYR B 17 4.332 3.520 -22.747 1.00 0.00 H new ATOM 0 HE1 TYR B 17 3.880 4.606 -17.932 1.00 0.00 H new ATOM 0 HE2 TYR B 17 5.050 5.742 -21.912 1.00 0.00 H new ATOM 0 HH TYR B 17 4.176 7.197 -19.502 1.00 0.00 H new ATOM 1760 N SER B 18 6.492 1.491 -20.602 1.00 0.00 N ATOM 1761 CA SER B 18 7.827 1.945 -21.091 1.00 0.00 C ATOM 1762 C SER B 18 8.657 0.742 -21.548 1.00 0.00 C ATOM 1763 O SER B 18 9.358 0.807 -22.540 1.00 0.00 O ATOM 1764 CB SER B 18 8.570 2.670 -19.970 1.00 0.00 C ATOM 1765 OG SER B 18 9.810 3.155 -20.471 1.00 0.00 O ATOM 0 H SER B 18 6.279 1.717 -19.630 1.00 0.00 H new ATOM 0 HA SER B 18 7.680 2.623 -21.932 1.00 0.00 H new ATOM 0 HB2 SER B 18 7.968 3.497 -19.593 1.00 0.00 H new ATOM 0 HB3 SER B 18 8.742 1.993 -19.133 1.00 0.00 H new ATOM 0 HG SER B 18 10.500 3.065 -19.780 1.00 0.00 H new ATOM 1771 N GLY B 19 8.596 -0.349 -20.834 1.00 0.00 N ATOM 1772 CA GLY B 19 9.395 -1.546 -21.232 1.00 0.00 C ATOM 1773 C GLY B 19 8.680 -2.316 -22.347 1.00 0.00 C ATOM 1774 O GLY B 19 9.198 -3.279 -22.876 1.00 0.00 O ATOM 0 H GLY B 19 8.029 -0.464 -19.994 1.00 0.00 H new ATOM 0 HA2 GLY B 19 10.383 -1.236 -21.571 1.00 0.00 H new ATOM 0 HA3 GLY B 19 9.543 -2.196 -20.370 1.00 0.00 H new ATOM 1778 N ARG B 20 7.495 -1.908 -22.706 1.00 0.00 N ATOM 1779 CA ARG B 20 6.755 -2.625 -23.784 1.00 0.00 C ATOM 1780 C ARG B 20 7.555 -2.589 -25.089 1.00 0.00 C ATOM 1781 O ARG B 20 7.734 -3.597 -25.744 1.00 0.00 O ATOM 1782 CB ARG B 20 5.400 -1.949 -23.999 1.00 0.00 C ATOM 1783 CG ARG B 20 4.624 -2.672 -25.105 1.00 0.00 C ATOM 1784 CD ARG B 20 3.263 -2.004 -25.279 1.00 0.00 C ATOM 1785 NE ARG B 20 2.506 -2.685 -26.367 1.00 0.00 N ATOM 1786 CZ ARG B 20 1.218 -2.507 -26.474 1.00 0.00 C ATOM 1787 NH1 ARG B 20 0.594 -1.734 -25.629 1.00 0.00 N ATOM 1788 NH2 ARG B 20 0.552 -3.103 -27.424 1.00 0.00 N ATOM 0 H ARG B 20 7.006 -1.110 -22.301 1.00 0.00 H new ATOM 0 HA ARG B 20 6.609 -3.664 -23.488 1.00 0.00 H new ATOM 0 HB2 ARG B 20 4.826 -1.963 -23.072 1.00 0.00 H new ATOM 0 HB3 ARG B 20 5.545 -0.903 -24.269 1.00 0.00 H new ATOM 0 HG2 ARG B 20 5.182 -2.637 -26.040 1.00 0.00 H new ATOM 0 HG3 ARG B 20 4.497 -3.724 -24.849 1.00 0.00 H new ATOM 0 HD2 ARG B 20 2.701 -2.053 -24.346 1.00 0.00 H new ATOM 0 HD3 ARG B 20 3.393 -0.949 -25.518 1.00 0.00 H new ATOM 0 HE ARG B 20 2.994 -3.290 -27.027 1.00 0.00 H new ATOM 0 HH11 ARG B 20 1.113 -1.269 -24.884 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -0.413 -1.595 -25.713 1.00 0.00 H new ATOM 0 HH21 ARG B 20 1.038 -3.709 -28.085 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -0.455 -2.963 -27.506 1.00 0.00 H new ATOM 1802 N GLU B 21 8.022 -1.433 -25.479 1.00 0.00 N ATOM 1803 CA GLU B 21 8.795 -1.322 -26.755 1.00 0.00 C ATOM 1804 C GLU B 21 10.291 -1.535 -26.483 1.00 0.00 C ATOM 1805 O GLU B 21 10.819 -2.605 -26.716 1.00 0.00 O ATOM 1806 CB GLU B 21 8.563 0.068 -27.368 1.00 0.00 C ATOM 1807 CG GLU B 21 8.915 0.055 -28.861 1.00 0.00 C ATOM 1808 CD GLU B 21 10.426 -0.117 -29.026 1.00 0.00 C ATOM 1809 OE1 GLU B 21 11.158 0.628 -28.394 1.00 0.00 O ATOM 1810 OE2 GLU B 21 10.826 -0.989 -29.778 1.00 0.00 O ATOM 0 H GLU B 21 7.902 -0.558 -24.969 1.00 0.00 H new ATOM 0 HA GLU B 21 8.456 -2.087 -27.453 1.00 0.00 H new ATOM 0 HB2 GLU B 21 7.522 0.363 -27.235 1.00 0.00 H new ATOM 0 HB3 GLU B 21 9.173 0.808 -26.850 1.00 0.00 H new ATOM 0 HG2 GLU B 21 8.389 -0.757 -29.363 1.00 0.00 H new ATOM 0 HG3 GLU B 21 8.590 0.984 -29.330 1.00 0.00 H new ATOM 1817 N GLY B 22 10.984 -0.536 -26.002 1.00 0.00 N ATOM 1818 CA GLY B 22 12.442 -0.712 -25.733 1.00 0.00 C ATOM 1819 C GLY B 22 12.979 0.464 -24.912 1.00 0.00 C ATOM 1820 O GLY B 22 13.921 0.318 -24.158 1.00 0.00 O ATOM 0 H GLY B 22 10.607 0.387 -25.785 1.00 0.00 H new ATOM 0 HA2 GLY B 22 12.609 -1.645 -25.195 1.00 0.00 H new ATOM 0 HA3 GLY B 22 12.986 -0.785 -26.675 1.00 0.00 H new ATOM 1824 N ASP B 23 12.399 1.627 -25.040 1.00 0.00 N ATOM 1825 CA ASP B 23 12.904 2.783 -24.248 1.00 0.00 C ATOM 1826 C ASP B 23 12.490 2.591 -22.789 1.00 0.00 C ATOM 1827 O ASP B 23 11.608 3.256 -22.284 1.00 0.00 O ATOM 1828 CB ASP B 23 12.307 4.083 -24.791 1.00 0.00 C ATOM 1829 CG ASP B 23 12.489 4.133 -26.308 1.00 0.00 C ATOM 1830 OD1 ASP B 23 13.509 3.657 -26.779 1.00 0.00 O ATOM 1831 OD2 ASP B 23 11.605 4.646 -26.974 1.00 0.00 O ATOM 0 H ASP B 23 11.607 1.825 -25.651 1.00 0.00 H new ATOM 0 HA ASP B 23 13.990 2.840 -24.322 1.00 0.00 H new ATOM 0 HB2 ASP B 23 11.248 4.143 -24.539 1.00 0.00 H new ATOM 0 HB3 ASP B 23 12.794 4.941 -24.327 1.00 0.00 H new ATOM 1836 N LYS B 24 13.117 1.666 -22.118 1.00 0.00 N ATOM 1837 CA LYS B 24 12.772 1.393 -20.695 1.00 0.00 C ATOM 1838 C LYS B 24 12.986 2.639 -19.831 1.00 0.00 C ATOM 1839 O LYS B 24 12.134 3.012 -19.055 1.00 0.00 O ATOM 1840 CB LYS B 24 13.665 0.258 -20.185 1.00 0.00 C ATOM 1841 CG LYS B 24 13.348 -0.051 -18.718 1.00 0.00 C ATOM 1842 CD LYS B 24 14.237 -1.204 -18.244 1.00 0.00 C ATOM 1843 CE LYS B 24 14.237 -1.255 -16.716 1.00 0.00 C ATOM 1844 NZ LYS B 24 14.741 -2.582 -16.265 1.00 0.00 N ATOM 0 H LYS B 24 13.861 1.082 -22.499 1.00 0.00 H new ATOM 0 HA LYS B 24 11.721 1.111 -20.631 1.00 0.00 H new ATOM 0 HB2 LYS B 24 13.513 -0.634 -20.793 1.00 0.00 H new ATOM 0 HB3 LYS B 24 14.714 0.538 -20.286 1.00 0.00 H new ATOM 0 HG2 LYS B 24 13.518 0.832 -18.103 1.00 0.00 H new ATOM 0 HG3 LYS B 24 12.297 -0.318 -18.609 1.00 0.00 H new ATOM 0 HD2 LYS B 24 13.873 -2.148 -18.650 1.00 0.00 H new ATOM 0 HD3 LYS B 24 15.253 -1.069 -18.614 1.00 0.00 H new ATOM 0 HE2 LYS B 24 14.865 -0.460 -16.315 1.00 0.00 H new ATOM 0 HE3 LYS B 24 13.229 -1.088 -16.336 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 14.742 -2.618 -15.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 14.124 -3.332 -16.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 15.709 -2.723 -16.617 1.00 0.00 H new ATOM 1858 N HIS B 25 14.128 3.265 -19.929 1.00 0.00 N ATOM 1859 CA HIS B 25 14.404 4.462 -19.074 1.00 0.00 C ATOM 1860 C HIS B 25 13.957 5.758 -19.762 1.00 0.00 C ATOM 1861 O HIS B 25 14.041 6.823 -19.184 1.00 0.00 O ATOM 1862 CB HIS B 25 15.907 4.534 -18.797 1.00 0.00 C ATOM 1863 CG HIS B 25 16.185 5.619 -17.795 1.00 0.00 C ATOM 1864 ND1 HIS B 25 16.526 6.908 -18.179 1.00 0.00 N ATOM 1865 CD2 HIS B 25 16.178 5.626 -16.421 1.00 0.00 C ATOM 1866 CE1 HIS B 25 16.710 7.630 -17.058 1.00 0.00 C ATOM 1867 NE2 HIS B 25 16.509 6.895 -15.963 1.00 0.00 N ATOM 0 H HIS B 25 14.883 3.002 -20.563 1.00 0.00 H new ATOM 0 HA HIS B 25 13.843 4.360 -18.145 1.00 0.00 H new ATOM 0 HB2 HIS B 25 16.263 3.576 -18.419 1.00 0.00 H new ATOM 0 HB3 HIS B 25 16.448 4.732 -19.722 1.00 0.00 H new ATOM 0 HD2 HIS B 25 15.950 4.776 -15.794 1.00 0.00 H new ATOM 0 HE1 HIS B 25 16.986 8.674 -17.046 1.00 0.00 H new ATOM 0 HE2 HIS B 25 16.583 7.201 -14.993 1.00 0.00 H new ATOM 1876 N LYS B 26 13.494 5.690 -20.986 1.00 0.00 N ATOM 1877 CA LYS B 26 13.056 6.936 -21.701 1.00 0.00 C ATOM 1878 C LYS B 26 11.731 6.708 -22.410 1.00 0.00 C ATOM 1879 O LYS B 26 11.329 5.594 -22.687 1.00 0.00 O ATOM 1880 CB LYS B 26 14.120 7.342 -22.717 1.00 0.00 C ATOM 1881 CG LYS B 26 15.345 7.848 -21.960 1.00 0.00 C ATOM 1882 CD LYS B 26 16.510 8.078 -22.933 1.00 0.00 C ATOM 1883 CE LYS B 26 16.151 9.172 -23.947 1.00 0.00 C ATOM 1884 NZ LYS B 26 15.478 10.306 -23.250 1.00 0.00 N ATOM 0 H LYS B 26 13.399 4.828 -21.523 1.00 0.00 H new ATOM 0 HA LYS B 26 12.925 7.733 -20.969 1.00 0.00 H new ATOM 0 HB2 LYS B 26 14.387 6.492 -23.345 1.00 0.00 H new ATOM 0 HB3 LYS B 26 13.736 8.119 -23.378 1.00 0.00 H new ATOM 0 HG2 LYS B 26 15.104 8.777 -21.443 1.00 0.00 H new ATOM 0 HG3 LYS B 26 15.635 7.125 -21.198 1.00 0.00 H new ATOM 0 HD2 LYS B 26 17.404 8.366 -22.379 1.00 0.00 H new ATOM 0 HD3 LYS B 26 16.744 7.151 -23.456 1.00 0.00 H new ATOM 0 HE2 LYS B 26 17.052 9.525 -24.449 1.00 0.00 H new ATOM 0 HE3 LYS B 26 15.495 8.766 -24.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 15.569 11.169 -23.823 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 14.471 10.083 -23.117 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 15.924 10.457 -22.323 1.00 0.00 H new ATOM 1898 N LEU B 27 11.042 7.781 -22.682 1.00 0.00 N ATOM 1899 CA LEU B 27 9.720 7.699 -23.355 1.00 0.00 C ATOM 1900 C LEU B 27 9.717 8.583 -24.594 1.00 0.00 C ATOM 1901 O LEU B 27 10.087 9.731 -24.539 1.00 0.00 O ATOM 1902 CB LEU B 27 8.653 8.209 -22.388 1.00 0.00 C ATOM 1903 CG LEU B 27 8.512 7.238 -21.211 1.00 0.00 C ATOM 1904 CD1 LEU B 27 7.570 7.848 -20.169 1.00 0.00 C ATOM 1905 CD2 LEU B 27 7.957 5.887 -21.702 1.00 0.00 C ATOM 0 H LEU B 27 11.348 8.729 -22.461 1.00 0.00 H new ATOM 0 HA LEU B 27 9.519 6.668 -23.644 1.00 0.00 H new ATOM 0 HB2 LEU B 27 8.923 9.200 -22.023 1.00 0.00 H new ATOM 0 HB3 LEU B 27 7.699 8.309 -22.905 1.00 0.00 H new ATOM 0 HG LEU B 27 9.490 7.066 -20.761 1.00 0.00 H new ATOM 0 HD11 LEU B 27 7.465 7.162 -19.328 1.00 0.00 H new ATOM 0 HD12 LEU B 27 7.981 8.794 -19.817 1.00 0.00 H new ATOM 0 HD13 LEU B 27 6.593 8.022 -20.620 1.00 0.00 H new ATOM 0 HD21 LEU B 27 7.861 5.205 -20.857 1.00 0.00 H new ATOM 0 HD22 LEU B 27 6.979 6.040 -22.158 1.00 0.00 H new ATOM 0 HD23 LEU B 27 8.638 5.460 -22.438 1.00 0.00 H new ATOM 1917 N LYS B 28 9.268 8.064 -25.702 1.00 0.00 N ATOM 1918 CA LYS B 28 9.189 8.880 -26.949 1.00 0.00 C ATOM 1919 C LYS B 28 7.718 9.240 -27.145 1.00 0.00 C ATOM 1920 O LYS B 28 6.852 8.594 -26.588 1.00 0.00 O ATOM 1921 CB LYS B 28 9.684 8.061 -28.148 1.00 0.00 C ATOM 1922 CG LYS B 28 11.170 7.732 -27.978 1.00 0.00 C ATOM 1923 CD LYS B 28 11.650 6.915 -29.181 1.00 0.00 C ATOM 1924 CE LYS B 28 13.134 6.583 -29.016 1.00 0.00 C ATOM 1925 NZ LYS B 28 13.659 6.004 -30.287 1.00 0.00 N ATOM 0 H LYS B 28 8.949 7.100 -25.800 1.00 0.00 H new ATOM 0 HA LYS B 28 9.810 9.772 -26.870 1.00 0.00 H new ATOM 0 HB2 LYS B 28 9.107 7.141 -28.234 1.00 0.00 H new ATOM 0 HB3 LYS B 28 9.530 8.621 -29.070 1.00 0.00 H new ATOM 0 HG2 LYS B 28 11.750 8.651 -27.894 1.00 0.00 H new ATOM 0 HG3 LYS B 28 11.327 7.170 -27.057 1.00 0.00 H new ATOM 0 HD2 LYS B 28 11.069 5.997 -29.265 1.00 0.00 H new ATOM 0 HD3 LYS B 28 11.493 7.477 -30.101 1.00 0.00 H new ATOM 0 HE2 LYS B 28 13.692 7.483 -28.756 1.00 0.00 H new ATOM 0 HE3 LYS B 28 13.271 5.876 -28.198 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 14.668 5.778 -30.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 13.133 5.136 -30.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 13.542 6.693 -31.057 1.00 0.00 H new ATOM 1939 N LYS B 29 7.404 10.251 -27.915 1.00 0.00 N ATOM 1940 CA LYS B 29 5.966 10.604 -28.105 1.00 0.00 C ATOM 1941 C LYS B 29 5.224 9.320 -28.462 1.00 0.00 C ATOM 1942 O LYS B 29 4.038 9.177 -28.243 1.00 0.00 O ATOM 1943 CB LYS B 29 5.819 11.625 -29.246 1.00 0.00 C ATOM 1944 CG LYS B 29 6.115 10.970 -30.602 1.00 0.00 C ATOM 1945 CD LYS B 29 6.206 12.052 -31.680 1.00 0.00 C ATOM 1946 CE LYS B 29 6.228 11.395 -33.061 1.00 0.00 C ATOM 1947 NZ LYS B 29 4.900 10.771 -33.339 1.00 0.00 N ATOM 0 H LYS B 29 8.071 10.840 -28.414 1.00 0.00 H new ATOM 0 HA LYS B 29 5.558 11.048 -27.197 1.00 0.00 H new ATOM 0 HB2 LYS B 29 4.809 12.034 -29.247 1.00 0.00 H new ATOM 0 HB3 LYS B 29 6.500 12.460 -29.083 1.00 0.00 H new ATOM 0 HG2 LYS B 29 7.050 10.411 -30.552 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.330 10.256 -30.853 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.357 12.731 -31.602 1.00 0.00 H new ATOM 0 HD3 LYS B 29 7.106 12.650 -31.535 1.00 0.00 H new ATOM 0 HE2 LYS B 29 6.459 12.138 -33.825 1.00 0.00 H new ATOM 0 HE3 LYS B 29 7.012 10.639 -33.103 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 5.022 9.749 -33.491 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 4.267 10.927 -32.529 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 4.486 11.201 -34.191 1.00 0.00 H new ATOM 1961 N SER B 30 5.949 8.385 -29.002 1.00 0.00 N ATOM 1962 CA SER B 30 5.345 7.077 -29.378 1.00 0.00 C ATOM 1963 C SER B 30 5.083 6.245 -28.117 1.00 0.00 C ATOM 1964 O SER B 30 4.026 5.667 -27.958 1.00 0.00 O ATOM 1965 CB SER B 30 6.301 6.320 -30.302 1.00 0.00 C ATOM 1966 OG SER B 30 5.666 5.133 -30.757 1.00 0.00 O ATOM 0 H SER B 30 6.946 8.471 -29.202 1.00 0.00 H new ATOM 0 HA SER B 30 4.401 7.251 -29.895 1.00 0.00 H new ATOM 0 HB2 SER B 30 6.579 6.946 -31.150 1.00 0.00 H new ATOM 0 HB3 SER B 30 7.221 6.075 -29.772 1.00 0.00 H new ATOM 0 HG SER B 30 6.273 4.644 -31.351 1.00 0.00 H new ATOM 1972 N GLU B 31 6.032 6.178 -27.212 1.00 0.00 N ATOM 1973 CA GLU B 31 5.814 5.386 -25.974 1.00 0.00 C ATOM 1974 C GLU B 31 4.776 6.119 -25.123 1.00 0.00 C ATOM 1975 O GLU B 31 3.965 5.517 -24.447 1.00 0.00 O ATOM 1976 CB GLU B 31 7.136 5.260 -25.209 1.00 0.00 C ATOM 1977 CG GLU B 31 8.181 4.579 -26.098 1.00 0.00 C ATOM 1978 CD GLU B 31 7.792 3.118 -26.319 1.00 0.00 C ATOM 1979 OE1 GLU B 31 7.719 2.393 -25.341 1.00 0.00 O ATOM 1980 OE2 GLU B 31 7.581 2.746 -27.462 1.00 0.00 O ATOM 0 H GLU B 31 6.940 6.637 -27.282 1.00 0.00 H new ATOM 0 HA GLU B 31 5.458 4.384 -26.214 1.00 0.00 H new ATOM 0 HB2 GLU B 31 7.488 6.246 -24.907 1.00 0.00 H new ATOM 0 HB3 GLU B 31 6.987 4.681 -24.297 1.00 0.00 H new ATOM 0 HG2 GLU B 31 8.251 5.096 -27.055 1.00 0.00 H new ATOM 0 HG3 GLU B 31 9.164 4.637 -25.631 1.00 0.00 H new ATOM 1987 N LEU B 32 4.794 7.423 -25.169 1.00 0.00 N ATOM 1988 CA LEU B 32 3.811 8.221 -24.386 1.00 0.00 C ATOM 1989 C LEU B 32 2.397 7.858 -24.838 1.00 0.00 C ATOM 1990 O LEU B 32 1.504 7.693 -24.039 1.00 0.00 O ATOM 1991 CB LEU B 32 4.072 9.708 -24.653 1.00 0.00 C ATOM 1992 CG LEU B 32 3.082 10.582 -23.874 1.00 0.00 C ATOM 1993 CD1 LEU B 32 3.212 10.316 -22.366 1.00 0.00 C ATOM 1994 CD2 LEU B 32 3.394 12.055 -24.168 1.00 0.00 C ATOM 0 H LEU B 32 5.453 7.973 -25.720 1.00 0.00 H new ATOM 0 HA LEU B 32 3.912 8.011 -23.321 1.00 0.00 H new ATOM 0 HB2 LEU B 32 5.092 9.960 -24.364 1.00 0.00 H new ATOM 0 HB3 LEU B 32 3.983 9.912 -25.720 1.00 0.00 H new ATOM 0 HG LEU B 32 2.063 10.345 -24.181 1.00 0.00 H new ATOM 0 HD11 LEU B 32 2.504 10.943 -21.824 1.00 0.00 H new ATOM 0 HD12 LEU B 32 2.999 9.267 -22.162 1.00 0.00 H new ATOM 0 HD13 LEU B 32 4.226 10.550 -22.041 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.698 12.691 -23.621 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.414 12.280 -23.855 1.00 0.00 H new ATOM 0 HD23 LEU B 32 3.293 12.242 -25.237 1.00 0.00 H new ATOM 2006 N LYS B 33 2.199 7.725 -26.116 1.00 0.00 N ATOM 2007 CA LYS B 33 0.851 7.362 -26.643 1.00 0.00 C ATOM 2008 C LYS B 33 0.452 5.974 -26.145 1.00 0.00 C ATOM 2009 O LYS B 33 -0.702 5.705 -25.877 1.00 0.00 O ATOM 2010 CB LYS B 33 0.893 7.382 -28.175 1.00 0.00 C ATOM 2011 CG LYS B 33 -0.408 6.817 -28.771 1.00 0.00 C ATOM 2012 CD LYS B 33 -1.626 7.574 -28.223 1.00 0.00 C ATOM 2013 CE LYS B 33 -2.850 7.317 -29.124 1.00 0.00 C ATOM 2014 NZ LYS B 33 -2.707 6.005 -29.820 1.00 0.00 N ATOM 0 H LYS B 33 2.918 7.853 -26.828 1.00 0.00 H new ATOM 0 HA LYS B 33 0.112 8.081 -26.290 1.00 0.00 H new ATOM 0 HB2 LYS B 33 1.044 8.403 -28.525 1.00 0.00 H new ATOM 0 HB3 LYS B 33 1.742 6.796 -28.527 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -0.382 6.897 -29.858 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -0.494 5.757 -28.532 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -1.839 7.250 -27.204 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -1.413 8.642 -28.180 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -3.760 7.322 -28.524 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.946 8.118 -29.857 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.641 5.680 -30.143 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.075 6.114 -30.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -2.305 5.306 -29.163 1.00 0.00 H new ATOM 2028 N GLU B 34 1.389 5.081 -26.038 1.00 0.00 N ATOM 2029 CA GLU B 34 1.041 3.710 -25.585 1.00 0.00 C ATOM 2030 C GLU B 34 0.423 3.774 -24.197 1.00 0.00 C ATOM 2031 O GLU B 34 -0.521 3.076 -23.901 1.00 0.00 O ATOM 2032 CB GLU B 34 2.298 2.842 -25.553 1.00 0.00 C ATOM 2033 CG GLU B 34 2.763 2.571 -26.983 1.00 0.00 C ATOM 2034 CD GLU B 34 4.020 1.702 -26.953 1.00 0.00 C ATOM 2035 OE1 GLU B 34 4.560 1.514 -25.875 1.00 0.00 O ATOM 2036 OE2 GLU B 34 4.424 1.243 -28.008 1.00 0.00 O ATOM 0 H GLU B 34 2.376 5.238 -26.243 1.00 0.00 H new ATOM 0 HA GLU B 34 0.323 3.272 -26.279 1.00 0.00 H new ATOM 0 HB2 GLU B 34 3.086 3.344 -24.991 1.00 0.00 H new ATOM 0 HB3 GLU B 34 2.091 1.902 -25.042 1.00 0.00 H new ATOM 0 HG2 GLU B 34 1.975 2.070 -27.544 1.00 0.00 H new ATOM 0 HG3 GLU B 34 2.970 3.511 -27.494 1.00 0.00 H new ATOM 2043 N LEU B 35 0.934 4.604 -23.342 1.00 0.00 N ATOM 2044 CA LEU B 35 0.335 4.695 -21.984 1.00 0.00 C ATOM 2045 C LEU B 35 -1.045 5.345 -22.093 1.00 0.00 C ATOM 2046 O LEU B 35 -2.001 4.921 -21.477 1.00 0.00 O ATOM 2047 CB LEU B 35 1.249 5.547 -21.077 1.00 0.00 C ATOM 2048 CG LEU B 35 0.483 6.043 -19.811 1.00 0.00 C ATOM 2049 CD1 LEU B 35 1.404 6.029 -18.588 1.00 0.00 C ATOM 2050 CD2 LEU B 35 -0.040 7.479 -20.015 1.00 0.00 C ATOM 0 H LEU B 35 1.730 5.217 -23.517 1.00 0.00 H new ATOM 0 HA LEU B 35 0.234 3.699 -21.552 1.00 0.00 H new ATOM 0 HB2 LEU B 35 2.115 4.959 -20.774 1.00 0.00 H new ATOM 0 HB3 LEU B 35 1.625 6.403 -21.637 1.00 0.00 H new ATOM 0 HG LEU B 35 -0.358 5.368 -19.649 1.00 0.00 H new ATOM 0 HD11 LEU B 35 0.854 6.378 -17.714 1.00 0.00 H new ATOM 0 HD12 LEU B 35 1.759 5.014 -18.412 1.00 0.00 H new ATOM 0 HD13 LEU B 35 2.256 6.686 -18.766 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -0.571 7.804 -19.120 1.00 0.00 H new ATOM 0 HD22 LEU B 35 0.799 8.149 -20.202 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -0.719 7.501 -20.867 1.00 0.00 H new ATOM 2062 N ILE B 36 -1.138 6.394 -22.848 1.00 0.00 N ATOM 2063 CA ILE B 36 -2.428 7.118 -22.976 1.00 0.00 C ATOM 2064 C ILE B 36 -3.464 6.303 -23.758 1.00 0.00 C ATOM 2065 O ILE B 36 -4.627 6.279 -23.408 1.00 0.00 O ATOM 2066 CB ILE B 36 -2.162 8.444 -23.691 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -1.168 9.264 -22.852 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -3.478 9.223 -23.878 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.715 10.495 -23.637 1.00 0.00 C ATOM 0 H ILE B 36 -0.368 6.787 -23.389 1.00 0.00 H new ATOM 0 HA ILE B 36 -2.838 7.288 -21.980 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.740 8.254 -24.678 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.635 9.571 -21.916 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -0.306 8.650 -22.592 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.274 10.165 -24.388 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.170 8.629 -24.475 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.922 9.427 -22.904 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -0.011 11.071 -23.036 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -0.230 10.179 -24.561 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.580 11.114 -23.875 1.00 0.00 H new ATOM 2081 N ASN B 37 -3.072 5.652 -24.815 1.00 0.00 N ATOM 2082 CA ASN B 37 -4.065 4.871 -25.603 1.00 0.00 C ATOM 2083 C ASN B 37 -4.516 3.626 -24.846 1.00 0.00 C ATOM 2084 O ASN B 37 -5.661 3.223 -24.912 1.00 0.00 O ATOM 2085 CB ASN B 37 -3.445 4.429 -26.930 1.00 0.00 C ATOM 2086 CG ASN B 37 -4.515 3.734 -27.776 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -4.295 2.654 -28.289 1.00 0.00 O ATOM 2088 ND2 ASN B 37 -5.676 4.310 -27.938 1.00 0.00 N ATOM 0 H ASN B 37 -2.115 5.626 -25.166 1.00 0.00 H new ATOM 0 HA ASN B 37 -4.927 5.515 -25.779 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -3.045 5.291 -27.464 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -2.611 3.751 -26.748 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -6.398 3.854 -28.495 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -5.860 5.216 -27.507 1.00 0.00 H new ATOM 2095 N ASN B 38 -3.601 2.976 -24.189 1.00 0.00 N ATOM 2096 CA ASN B 38 -3.931 1.691 -23.481 1.00 0.00 C ATOM 2097 C ASN B 38 -4.128 1.850 -21.969 1.00 0.00 C ATOM 2098 O ASN B 38 -4.878 1.106 -21.367 1.00 0.00 O ATOM 2099 CB ASN B 38 -2.791 0.702 -23.715 1.00 0.00 C ATOM 2100 CG ASN B 38 -2.602 0.497 -25.217 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -1.761 -0.272 -25.638 1.00 0.00 O ATOM 2102 ND2 ASN B 38 -3.354 1.164 -26.049 1.00 0.00 N ATOM 0 H ASN B 38 -2.629 3.274 -24.106 1.00 0.00 H new ATOM 0 HA ASN B 38 -4.878 1.340 -23.891 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.870 1.078 -23.269 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -3.014 -0.249 -23.232 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -3.236 1.040 -27.055 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -4.060 1.809 -25.694 1.00 0.00 H new ATOM 2109 N GLU B 39 -3.439 2.754 -21.328 1.00 0.00 N ATOM 2110 CA GLU B 39 -3.584 2.857 -19.844 1.00 0.00 C ATOM 2111 C GLU B 39 -4.831 3.666 -19.478 1.00 0.00 C ATOM 2112 O GLU B 39 -5.279 3.635 -18.349 1.00 0.00 O ATOM 2113 CB GLU B 39 -2.327 3.530 -19.255 1.00 0.00 C ATOM 2114 CG GLU B 39 -2.073 3.023 -17.829 1.00 0.00 C ATOM 2115 CD GLU B 39 -1.401 1.647 -17.885 1.00 0.00 C ATOM 2116 OE1 GLU B 39 -0.248 1.590 -18.277 1.00 0.00 O ATOM 2117 OE2 GLU B 39 -2.051 0.676 -17.534 1.00 0.00 O ATOM 0 H GLU B 39 -2.792 3.416 -21.756 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.693 1.855 -19.428 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.463 3.316 -19.884 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -2.455 4.612 -19.246 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -1.439 3.727 -17.289 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -3.014 2.958 -17.282 1.00 0.00 H new ATOM 2124 N LEU B 40 -5.395 4.383 -20.417 1.00 0.00 N ATOM 2125 CA LEU B 40 -6.618 5.198 -20.121 1.00 0.00 C ATOM 2126 C LEU B 40 -7.791 4.661 -20.938 1.00 0.00 C ATOM 2127 O LEU B 40 -8.425 5.379 -21.686 1.00 0.00 O ATOM 2128 CB LEU B 40 -6.352 6.657 -20.492 1.00 0.00 C ATOM 2129 CG LEU B 40 -5.031 7.124 -19.852 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -4.762 8.607 -20.195 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -5.092 6.942 -18.325 1.00 0.00 C ATOM 0 H LEU B 40 -5.062 4.441 -21.379 1.00 0.00 H new ATOM 0 HA LEU B 40 -6.859 5.134 -19.060 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -6.299 6.763 -21.576 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -7.175 7.285 -20.150 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.217 6.519 -20.251 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.825 8.923 -19.736 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.693 8.724 -21.277 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -5.578 9.222 -19.815 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.154 7.275 -17.881 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.914 7.532 -17.921 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.251 5.890 -18.090 1.00 0.00 H new ATOM 2143 N SER B 41 -8.079 3.397 -20.806 1.00 0.00 N ATOM 2144 CA SER B 41 -9.206 2.802 -21.575 1.00 0.00 C ATOM 2145 C SER B 41 -10.519 3.509 -21.216 1.00 0.00 C ATOM 2146 O SER B 41 -11.338 3.780 -22.070 1.00 0.00 O ATOM 2147 CB SER B 41 -9.313 1.319 -21.233 1.00 0.00 C ATOM 2148 OG SER B 41 -8.143 0.652 -21.689 1.00 0.00 O ATOM 0 H SER B 41 -7.581 2.748 -20.197 1.00 0.00 H new ATOM 0 HA SER B 41 -9.021 2.924 -22.642 1.00 0.00 H new ATOM 0 HB2 SER B 41 -9.425 1.188 -20.157 1.00 0.00 H new ATOM 0 HB3 SER B 41 -10.198 0.888 -21.701 1.00 0.00 H new ATOM 0 HG SER B 41 -8.204 -0.301 -21.471 1.00 0.00 H new ATOM 2154 N HIS B 42 -10.729 3.813 -19.957 1.00 0.00 N ATOM 2155 CA HIS B 42 -11.995 4.506 -19.549 1.00 0.00 C ATOM 2156 C HIS B 42 -11.723 5.499 -18.413 1.00 0.00 C ATOM 2157 O HIS B 42 -12.536 6.357 -18.130 1.00 0.00 O ATOM 2158 CB HIS B 42 -13.021 3.470 -19.073 1.00 0.00 C ATOM 2159 CG HIS B 42 -14.252 4.176 -18.563 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -15.013 5.013 -19.368 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -14.860 4.186 -17.331 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -16.025 5.488 -18.617 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -15.976 5.015 -17.371 1.00 0.00 N ATOM 0 H HIS B 42 -10.081 3.612 -19.195 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.385 5.048 -20.411 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -13.286 2.802 -19.893 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -12.591 2.852 -18.285 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -14.523 3.635 -16.465 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -16.782 6.168 -18.979 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -16.621 5.218 -16.608 1.00 0.00 H new ATOM 2172 N PHE B 43 -10.606 5.391 -17.748 1.00 0.00 N ATOM 2173 CA PHE B 43 -10.329 6.335 -16.631 1.00 0.00 C ATOM 2174 C PHE B 43 -10.277 7.765 -17.174 1.00 0.00 C ATOM 2175 O PHE B 43 -10.863 8.673 -16.619 1.00 0.00 O ATOM 2176 CB PHE B 43 -8.995 5.970 -15.967 1.00 0.00 C ATOM 2177 CG PHE B 43 -8.564 7.021 -14.949 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -9.499 7.846 -14.282 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -7.199 7.166 -14.667 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -9.057 8.796 -13.354 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -6.769 8.118 -13.737 1.00 0.00 C ATOM 2182 CZ PHE B 43 -7.696 8.932 -13.083 1.00 0.00 C ATOM 0 H PHE B 43 -9.880 4.697 -17.928 1.00 0.00 H new ATOM 0 HA PHE B 43 -11.123 6.266 -15.887 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.087 5.002 -15.474 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -8.225 5.866 -16.731 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -10.554 7.743 -14.489 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.476 6.540 -15.170 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -9.772 9.426 -12.846 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.716 8.224 -13.524 1.00 0.00 H new ATOM 0 HZ PHE B 43 -7.359 9.667 -12.367 1.00 0.00 H new ATOM 2192 N LEU B 44 -9.587 7.967 -18.268 1.00 0.00 N ATOM 2193 CA LEU B 44 -9.494 9.331 -18.877 1.00 0.00 C ATOM 2194 C LEU B 44 -9.726 9.185 -20.375 1.00 0.00 C ATOM 2195 O LEU B 44 -9.398 8.172 -20.961 1.00 0.00 O ATOM 2196 CB LEU B 44 -8.095 9.918 -18.636 1.00 0.00 C ATOM 2197 CG LEU B 44 -8.050 11.404 -19.056 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -8.597 12.296 -17.938 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -6.603 11.817 -19.342 1.00 0.00 C ATOM 0 H LEU B 44 -9.079 7.239 -18.771 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.234 9.995 -18.431 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.832 9.824 -17.582 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.355 9.352 -19.201 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.662 11.524 -19.950 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.557 13.339 -18.252 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.630 12.020 -17.725 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.994 12.165 -17.040 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -6.576 12.866 -19.638 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.001 11.677 -18.444 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -6.202 11.202 -20.148 1.00 0.00 H new ATOM 2211 N GLU B 45 -10.284 10.172 -21.009 1.00 0.00 N ATOM 2212 CA GLU B 45 -10.519 10.041 -22.466 1.00 0.00 C ATOM 2213 C GLU B 45 -9.186 9.732 -23.146 1.00 0.00 C ATOM 2214 O GLU B 45 -8.280 10.541 -23.161 1.00 0.00 O ATOM 2215 CB GLU B 45 -11.088 11.350 -23.014 1.00 0.00 C ATOM 2216 CG GLU B 45 -11.349 11.210 -24.516 1.00 0.00 C ATOM 2217 CD GLU B 45 -12.048 12.470 -25.028 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -12.357 13.323 -24.212 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -12.265 12.561 -26.225 1.00 0.00 O ATOM 0 H GLU B 45 -10.584 11.052 -20.588 1.00 0.00 H new ATOM 0 HA GLU B 45 -11.231 9.239 -22.660 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -12.014 11.600 -22.496 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.389 12.166 -22.831 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -10.409 11.060 -25.048 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -11.967 10.333 -24.709 1.00 0.00 H new ATOM 2226 N GLU B 46 -9.062 8.559 -23.699 1.00 0.00 N ATOM 2227 CA GLU B 46 -7.792 8.175 -24.373 1.00 0.00 C ATOM 2228 C GLU B 46 -7.583 9.047 -25.613 1.00 0.00 C ATOM 2229 O GLU B 46 -8.458 9.786 -26.014 1.00 0.00 O ATOM 2230 CB GLU B 46 -7.849 6.691 -24.765 1.00 0.00 C ATOM 2231 CG GLU B 46 -8.853 6.455 -25.901 1.00 0.00 C ATOM 2232 CD GLU B 46 -10.249 6.892 -25.454 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -10.611 6.591 -24.329 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -10.933 7.521 -26.245 1.00 0.00 O ATOM 0 H GLU B 46 -9.791 7.845 -23.713 1.00 0.00 H new ATOM 0 HA GLU B 46 -6.955 8.329 -23.692 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -6.859 6.356 -25.075 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -8.130 6.094 -23.898 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -8.553 7.014 -26.787 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -8.863 5.401 -26.178 1.00 0.00 H new ATOM 2241 N ILE B 47 -6.425 8.971 -26.223 1.00 0.00 N ATOM 2242 CA ILE B 47 -6.154 9.801 -27.440 1.00 0.00 C ATOM 2243 C ILE B 47 -6.368 8.951 -28.695 1.00 0.00 C ATOM 2244 O ILE B 47 -6.034 7.783 -28.731 1.00 0.00 O ATOM 2245 CB ILE B 47 -4.719 10.322 -27.388 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -4.617 11.366 -26.273 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -4.344 10.962 -28.727 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -3.155 11.744 -26.049 1.00 0.00 C ATOM 0 H ILE B 47 -5.655 8.370 -25.931 1.00 0.00 H new ATOM 0 HA ILE B 47 -6.837 10.650 -27.470 1.00 0.00 H new ATOM 0 HB ILE B 47 -4.036 9.496 -27.192 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -5.194 12.252 -26.538 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -5.045 10.970 -25.352 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -3.319 11.330 -28.680 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -4.427 10.220 -29.521 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.019 11.792 -28.935 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -3.089 12.487 -25.254 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -2.589 10.857 -25.764 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -2.741 12.158 -26.968 1.00 0.00 H new ATOM 2260 N LYS B 48 -6.957 9.529 -29.714 1.00 0.00 N ATOM 2261 CA LYS B 48 -7.240 8.771 -30.973 1.00 0.00 C ATOM 2262 C LYS B 48 -6.349 9.275 -32.114 1.00 0.00 C ATOM 2263 O LYS B 48 -6.085 8.560 -33.061 1.00 0.00 O ATOM 2264 CB LYS B 48 -8.716 8.977 -31.338 1.00 0.00 C ATOM 2265 CG LYS B 48 -9.590 8.846 -30.066 1.00 0.00 C ATOM 2266 CD LYS B 48 -9.886 10.226 -29.471 1.00 0.00 C ATOM 2267 CE LYS B 48 -10.743 10.061 -28.216 1.00 0.00 C ATOM 2268 NZ LYS B 48 -12.056 9.461 -28.587 1.00 0.00 N ATOM 0 H LYS B 48 -7.257 10.504 -29.727 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.031 7.712 -30.819 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -8.856 9.960 -31.788 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -9.024 8.240 -32.080 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -10.525 8.341 -30.311 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.078 8.228 -29.328 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -8.955 10.736 -29.225 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.406 10.846 -30.201 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -10.231 9.425 -27.494 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -10.895 11.028 -27.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.750 9.654 -27.837 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.388 9.877 -29.481 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -11.948 8.433 -28.703 1.00 0.00 H new ATOM 2282 N GLU B 49 -5.881 10.497 -32.030 1.00 0.00 N ATOM 2283 CA GLU B 49 -5.000 11.058 -33.107 1.00 0.00 C ATOM 2284 C GLU B 49 -3.615 11.334 -32.527 1.00 0.00 C ATOM 2285 O GLU B 49 -3.481 11.800 -31.413 1.00 0.00 O ATOM 2286 CB GLU B 49 -5.590 12.369 -33.634 1.00 0.00 C ATOM 2287 CG GLU B 49 -6.892 12.091 -34.391 1.00 0.00 C ATOM 2288 CD GLU B 49 -8.036 11.852 -33.401 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -7.839 12.093 -32.221 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -9.094 11.435 -33.843 1.00 0.00 O ATOM 0 H GLU B 49 -6.072 11.135 -31.257 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.929 10.340 -33.924 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.780 13.051 -32.805 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.874 12.860 -34.293 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -7.132 12.934 -35.039 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -6.769 11.219 -35.034 1.00 0.00 H new ATOM 2297 N GLN B 50 -2.583 11.053 -33.268 1.00 0.00 N ATOM 2298 CA GLN B 50 -1.214 11.306 -32.746 1.00 0.00 C ATOM 2299 C GLN B 50 -0.971 12.814 -32.664 1.00 0.00 C ATOM 2300 O GLN B 50 -0.069 13.260 -31.992 1.00 0.00 O ATOM 2301 CB GLN B 50 -0.162 10.663 -33.662 1.00 0.00 C ATOM 2302 CG GLN B 50 -0.370 11.118 -35.111 1.00 0.00 C ATOM 2303 CD GLN B 50 0.158 12.545 -35.287 1.00 0.00 C ATOM 2304 OE1 GLN B 50 1.273 12.895 -34.706 1.00 0.00 O flip ATOM 2305 NE2 GLN B 50 -0.452 13.349 -35.962 1.00 0.00 N flip ATOM 0 H GLN B 50 -2.627 10.661 -34.209 1.00 0.00 H new ATOM 0 HA GLN B 50 -1.128 10.865 -31.753 1.00 0.00 H new ATOM 0 HB2 GLN B 50 0.838 10.938 -33.327 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -0.232 9.577 -33.601 1.00 0.00 H new ATOM 0 HG2 GLN B 50 0.148 10.442 -35.792 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -1.429 11.078 -35.366 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -1.324 13.076 -36.416 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -0.093 14.297 -36.075 1.00 0.00 H new ATOM 2314 N GLU B 51 -1.759 13.608 -33.348 1.00 0.00 N ATOM 2315 CA GLU B 51 -1.544 15.087 -33.294 1.00 0.00 C ATOM 2316 C GLU B 51 -1.741 15.586 -31.867 1.00 0.00 C ATOM 2317 O GLU B 51 -1.008 16.426 -31.395 1.00 0.00 O ATOM 2318 CB GLU B 51 -2.536 15.789 -34.235 1.00 0.00 C ATOM 2319 CG GLU B 51 -3.949 15.770 -33.632 1.00 0.00 C ATOM 2320 CD GLU B 51 -4.963 16.207 -34.691 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -4.567 16.904 -35.610 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -6.119 15.836 -34.565 1.00 0.00 O ATOM 0 H GLU B 51 -2.534 13.300 -33.935 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.527 15.314 -33.613 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -2.220 16.818 -34.405 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -2.541 15.292 -35.205 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -4.190 14.769 -33.274 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -3.997 16.436 -32.771 1.00 0.00 H new ATOM 2329 N VAL B 52 -2.714 15.073 -31.172 1.00 0.00 N ATOM 2330 CA VAL B 52 -2.926 15.528 -29.776 1.00 0.00 C ATOM 2331 C VAL B 52 -1.675 15.223 -28.989 1.00 0.00 C ATOM 2332 O VAL B 52 -1.249 15.993 -28.164 1.00 0.00 O ATOM 2333 CB VAL B 52 -4.106 14.788 -29.153 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -4.278 15.227 -27.692 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -5.373 15.093 -29.946 1.00 0.00 C ATOM 0 H VAL B 52 -3.366 14.364 -31.508 1.00 0.00 H new ATOM 0 HA VAL B 52 -3.140 16.597 -29.764 1.00 0.00 H new ATOM 0 HB VAL B 52 -3.919 13.714 -29.179 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -5.121 14.697 -27.250 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.371 14.996 -27.133 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.464 16.300 -27.654 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -6.216 14.565 -29.502 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -5.565 16.166 -29.926 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.244 14.767 -30.978 1.00 0.00 H new ATOM 2345 N VAL B 53 -1.093 14.094 -29.236 1.00 0.00 N ATOM 2346 CA VAL B 53 0.136 13.720 -28.504 1.00 0.00 C ATOM 2347 C VAL B 53 1.234 14.727 -28.802 1.00 0.00 C ATOM 2348 O VAL B 53 1.987 15.090 -27.943 1.00 0.00 O ATOM 2349 CB VAL B 53 0.593 12.345 -28.961 1.00 0.00 C ATOM 2350 CG1 VAL B 53 1.806 11.908 -28.147 1.00 0.00 C ATOM 2351 CG2 VAL B 53 -0.539 11.352 -28.771 1.00 0.00 C ATOM 0 H VAL B 53 -1.418 13.409 -29.918 1.00 0.00 H new ATOM 0 HA VAL B 53 -0.071 13.708 -27.434 1.00 0.00 H new ATOM 0 HB VAL B 53 0.869 12.384 -30.015 1.00 0.00 H new ATOM 0 HG11 VAL B 53 2.130 10.921 -28.478 1.00 0.00 H new ATOM 0 HG12 VAL B 53 2.616 12.623 -28.289 1.00 0.00 H new ATOM 0 HG13 VAL B 53 1.540 11.867 -27.091 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -0.215 10.364 -29.098 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -0.816 11.313 -27.717 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -1.400 11.665 -29.361 1.00 0.00 H new ATOM 2361 N ASP B 54 1.336 15.162 -30.021 1.00 0.00 N ATOM 2362 CA ASP B 54 2.397 16.139 -30.390 1.00 0.00 C ATOM 2363 C ASP B 54 2.201 17.433 -29.612 1.00 0.00 C ATOM 2364 O ASP B 54 3.143 18.065 -29.182 1.00 0.00 O ATOM 2365 CB ASP B 54 2.329 16.415 -31.894 1.00 0.00 C ATOM 2366 CG ASP B 54 3.456 17.368 -32.301 1.00 0.00 C ATOM 2367 OD1 ASP B 54 3.956 18.069 -31.438 1.00 0.00 O ATOM 2368 OD2 ASP B 54 3.804 17.374 -33.471 1.00 0.00 O ATOM 0 H ASP B 54 0.725 14.881 -30.788 1.00 0.00 H new ATOM 0 HA ASP B 54 3.375 15.726 -30.143 1.00 0.00 H new ATOM 0 HB2 ASP B 54 2.414 15.480 -32.448 1.00 0.00 H new ATOM 0 HB3 ASP B 54 1.363 16.850 -32.149 1.00 0.00 H new ATOM 2373 N LYS B 55 0.982 17.833 -29.445 1.00 0.00 N ATOM 2374 CA LYS B 55 0.695 19.093 -28.708 1.00 0.00 C ATOM 2375 C LYS B 55 1.068 18.905 -27.243 1.00 0.00 C ATOM 2376 O LYS B 55 1.621 19.780 -26.602 1.00 0.00 O ATOM 2377 CB LYS B 55 -0.790 19.429 -28.817 1.00 0.00 C ATOM 2378 CG LYS B 55 -1.027 20.838 -28.276 1.00 0.00 C ATOM 2379 CD LYS B 55 -2.512 21.184 -28.382 1.00 0.00 C ATOM 2380 CE LYS B 55 -2.742 22.606 -27.868 1.00 0.00 C ATOM 2381 NZ LYS B 55 -2.031 23.574 -28.749 1.00 0.00 N ATOM 0 H LYS B 55 0.159 17.339 -29.790 1.00 0.00 H new ATOM 0 HA LYS B 55 1.277 19.909 -29.137 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -1.114 19.366 -29.856 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -1.381 18.706 -28.254 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -0.702 20.899 -27.237 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -0.434 21.559 -28.839 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -2.842 21.102 -29.417 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -3.104 20.476 -27.802 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -3.809 22.830 -27.850 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.380 22.697 -26.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -2.452 24.518 -28.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -1.026 23.610 -28.485 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -2.118 23.270 -29.740 1.00 0.00 H new ATOM 2395 N VAL B 56 0.773 17.755 -26.715 1.00 0.00 N ATOM 2396 CA VAL B 56 1.110 17.475 -25.300 1.00 0.00 C ATOM 2397 C VAL B 56 2.625 17.393 -25.201 1.00 0.00 C ATOM 2398 O VAL B 56 3.219 17.709 -24.189 1.00 0.00 O ATOM 2399 CB VAL B 56 0.454 16.148 -24.882 1.00 0.00 C ATOM 2400 CG1 VAL B 56 1.135 15.573 -23.635 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -1.025 16.395 -24.575 1.00 0.00 C ATOM 0 H VAL B 56 0.309 16.992 -27.208 1.00 0.00 H new ATOM 0 HA VAL B 56 0.742 18.257 -24.636 1.00 0.00 H new ATOM 0 HB VAL B 56 0.559 15.434 -25.699 1.00 0.00 H new ATOM 0 HG11 VAL B 56 0.654 14.635 -23.358 1.00 0.00 H new ATOM 0 HG12 VAL B 56 2.189 15.392 -23.847 1.00 0.00 H new ATOM 0 HG13 VAL B 56 1.047 16.283 -22.812 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -1.496 15.458 -24.278 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -1.112 17.118 -23.764 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -1.521 16.785 -25.464 1.00 0.00 H new ATOM 2411 N MET B 57 3.252 16.981 -26.263 1.00 0.00 N ATOM 2412 CA MET B 57 4.731 16.885 -26.256 1.00 0.00 C ATOM 2413 C MET B 57 5.321 18.284 -26.340 1.00 0.00 C ATOM 2414 O MET B 57 6.396 18.533 -25.870 1.00 0.00 O ATOM 2415 CB MET B 57 5.226 16.008 -27.408 1.00 0.00 C ATOM 2416 CG MET B 57 4.908 14.539 -27.094 1.00 0.00 C ATOM 2417 SD MET B 57 5.926 13.964 -25.710 1.00 0.00 S ATOM 2418 CE MET B 57 7.422 13.565 -26.644 1.00 0.00 C ATOM 0 H MET B 57 2.802 16.706 -27.136 1.00 0.00 H new ATOM 0 HA MET B 57 5.058 16.415 -25.328 1.00 0.00 H new ATOM 0 HB2 MET B 57 4.746 16.306 -28.340 1.00 0.00 H new ATOM 0 HB3 MET B 57 6.299 16.139 -27.546 1.00 0.00 H new ATOM 0 HG2 MET B 57 3.852 14.432 -26.848 1.00 0.00 H new ATOM 0 HG3 MET B 57 5.094 13.922 -27.973 1.00 0.00 H new ATOM 0 HE1 MET B 57 7.538 12.483 -26.701 1.00 0.00 H new ATOM 0 HE2 MET B 57 7.342 13.975 -27.651 1.00 0.00 H new ATOM 0 HE3 MET B 57 8.289 13.997 -26.144 1.00 0.00 H new ATOM 2428 N GLU B 58 4.624 19.224 -26.897 1.00 0.00 N ATOM 2429 CA GLU B 58 5.192 20.592 -26.935 1.00 0.00 C ATOM 2430 C GLU B 58 5.409 21.003 -25.482 1.00 0.00 C ATOM 2431 O GLU B 58 6.403 21.600 -25.119 1.00 0.00 O ATOM 2432 CB GLU B 58 4.202 21.538 -27.615 1.00 0.00 C ATOM 2433 CG GLU B 58 4.828 22.925 -27.749 1.00 0.00 C ATOM 2434 CD GLU B 58 3.836 23.866 -28.433 1.00 0.00 C ATOM 2435 OE1 GLU B 58 2.819 23.383 -28.902 1.00 0.00 O ATOM 2436 OE2 GLU B 58 4.110 25.054 -28.476 1.00 0.00 O ATOM 0 H GLU B 58 3.703 19.110 -27.320 1.00 0.00 H new ATOM 0 HA GLU B 58 6.126 20.629 -27.496 1.00 0.00 H new ATOM 0 HB2 GLU B 58 3.933 21.153 -28.599 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.282 21.598 -27.033 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.095 23.312 -26.766 1.00 0.00 H new ATOM 0 HG3 GLU B 58 5.749 22.866 -28.329 1.00 0.00 H new ATOM 2443 N THR B 59 4.471 20.650 -24.652 1.00 0.00 N ATOM 2444 CA THR B 59 4.568 20.963 -23.203 1.00 0.00 C ATOM 2445 C THR B 59 5.492 19.967 -22.482 1.00 0.00 C ATOM 2446 O THR B 59 6.241 20.333 -21.598 1.00 0.00 O ATOM 2447 CB THR B 59 3.164 20.871 -22.607 1.00 0.00 C ATOM 2448 OG1 THR B 59 2.318 21.824 -23.236 1.00 0.00 O ATOM 2449 CG2 THR B 59 3.207 21.136 -21.106 1.00 0.00 C ATOM 0 H THR B 59 3.625 20.148 -24.923 1.00 0.00 H new ATOM 0 HA THR B 59 4.985 21.962 -23.076 1.00 0.00 H new ATOM 0 HB THR B 59 2.774 19.867 -22.775 1.00 0.00 H new ATOM 0 HG1 THR B 59 1.417 21.764 -22.855 1.00 0.00 H new ATOM 0 HG21 THR B 59 2.200 21.067 -20.695 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.847 20.397 -20.624 1.00 0.00 H new ATOM 0 HG23 THR B 59 3.605 22.134 -20.924 1.00 0.00 H new ATOM 2457 N LEU B 60 5.422 18.704 -22.828 1.00 0.00 N ATOM 2458 CA LEU B 60 6.266 17.678 -22.138 1.00 0.00 C ATOM 2459 C LEU B 60 7.626 17.554 -22.829 1.00 0.00 C ATOM 2460 O LEU B 60 8.578 17.071 -22.248 1.00 0.00 O ATOM 2461 CB LEU B 60 5.529 16.312 -22.176 1.00 0.00 C ATOM 2462 CG LEU B 60 4.828 16.004 -20.832 1.00 0.00 C ATOM 2463 CD1 LEU B 60 5.857 15.942 -19.673 1.00 0.00 C ATOM 2464 CD2 LEU B 60 3.739 17.065 -20.547 1.00 0.00 C ATOM 0 H LEU B 60 4.814 18.338 -23.561 1.00 0.00 H new ATOM 0 HA LEU B 60 6.431 17.982 -21.104 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.791 16.318 -22.978 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.242 15.520 -22.405 1.00 0.00 H new ATOM 0 HG LEU B 60 4.351 15.027 -20.904 1.00 0.00 H new ATOM 0 HD11 LEU B 60 5.340 15.724 -18.739 1.00 0.00 H new ATOM 0 HD12 LEU B 60 6.586 15.158 -19.876 1.00 0.00 H new ATOM 0 HD13 LEU B 60 6.369 16.901 -19.589 1.00 0.00 H new ATOM 0 HD21 LEU B 60 3.251 16.840 -19.599 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.198 18.052 -20.493 1.00 0.00 H new ATOM 0 HD23 LEU B 60 3.000 17.052 -21.348 1.00 0.00 H new ATOM 2476 N ASP B 61 7.738 17.982 -24.052 1.00 0.00 N ATOM 2477 CA ASP B 61 9.055 17.872 -24.738 1.00 0.00 C ATOM 2478 C ASP B 61 9.913 19.027 -24.270 1.00 0.00 C ATOM 2479 O ASP B 61 10.314 19.885 -25.031 1.00 0.00 O ATOM 2480 CB ASP B 61 8.896 17.936 -26.257 1.00 0.00 C ATOM 2481 CG ASP B 61 10.234 17.603 -26.912 1.00 0.00 C ATOM 2482 OD1 ASP B 61 11.200 17.429 -26.186 1.00 0.00 O ATOM 2483 OD2 ASP B 61 10.272 17.527 -28.129 1.00 0.00 O ATOM 0 H ASP B 61 6.987 18.398 -24.602 1.00 0.00 H new ATOM 0 HA ASP B 61 9.514 16.914 -24.494 1.00 0.00 H new ATOM 0 HB2 ASP B 61 8.131 17.232 -26.585 1.00 0.00 H new ATOM 0 HB3 ASP B 61 8.566 18.930 -26.559 1.00 0.00 H new ATOM 2488 N GLU B 62 10.180 19.049 -23.007 1.00 0.00 N ATOM 2489 CA GLU B 62 11.002 20.136 -22.431 1.00 0.00 C ATOM 2490 C GLU B 62 12.374 20.125 -23.101 1.00 0.00 C ATOM 2491 O GLU B 62 12.963 21.156 -23.359 1.00 0.00 O ATOM 2492 CB GLU B 62 11.156 19.878 -20.940 1.00 0.00 C ATOM 2493 CG GLU B 62 9.766 19.696 -20.319 1.00 0.00 C ATOM 2494 CD GLU B 62 9.903 19.497 -18.809 1.00 0.00 C ATOM 2495 OE1 GLU B 62 11.027 19.430 -18.339 1.00 0.00 O ATOM 2496 OE2 GLU B 62 8.881 19.426 -18.147 1.00 0.00 O ATOM 0 H GLU B 62 9.860 18.350 -22.336 1.00 0.00 H new ATOM 0 HA GLU B 62 10.530 21.105 -22.593 1.00 0.00 H new ATOM 0 HB2 GLU B 62 11.763 18.988 -20.773 1.00 0.00 H new ATOM 0 HB3 GLU B 62 11.674 20.711 -20.465 1.00 0.00 H new ATOM 0 HG2 GLU B 62 9.146 20.568 -20.527 1.00 0.00 H new ATOM 0 HG3 GLU B 62 9.266 18.836 -20.766 1.00 0.00 H new ATOM 2503 N ASP B 63 12.885 18.959 -23.384 1.00 0.00 N ATOM 2504 CA ASP B 63 14.217 18.863 -24.038 1.00 0.00 C ATOM 2505 C ASP B 63 14.064 19.208 -25.519 1.00 0.00 C ATOM 2506 O ASP B 63 15.031 19.412 -26.225 1.00 0.00 O ATOM 2507 CB ASP B 63 14.740 17.430 -23.916 1.00 0.00 C ATOM 2508 CG ASP B 63 14.866 17.050 -22.440 1.00 0.00 C ATOM 2509 OD1 ASP B 63 15.238 17.906 -21.655 1.00 0.00 O ATOM 2510 OD2 ASP B 63 14.582 15.908 -22.121 1.00 0.00 O ATOM 0 H ASP B 63 12.434 18.065 -23.189 1.00 0.00 H new ATOM 0 HA ASP B 63 14.914 19.551 -23.559 1.00 0.00 H new ATOM 0 HB2 ASP B 63 14.063 16.742 -24.422 1.00 0.00 H new ATOM 0 HB3 ASP B 63 15.709 17.343 -24.408 1.00 0.00 H new ATOM 2515 N GLY B 64 12.849 19.278 -25.991 1.00 0.00 N ATOM 2516 CA GLY B 64 12.629 19.613 -27.430 1.00 0.00 C ATOM 2517 C GLY B 64 13.240 18.521 -28.315 1.00 0.00 C ATOM 2518 O GLY B 64 13.698 18.791 -29.409 1.00 0.00 O ATOM 0 H GLY B 64 12.001 19.119 -25.446 1.00 0.00 H new ATOM 0 HA2 GLY B 64 11.562 19.704 -27.633 1.00 0.00 H new ATOM 0 HA3 GLY B 64 13.081 20.577 -27.662 1.00 0.00 H new ATOM 2522 N ASP B 65 13.261 17.292 -27.851 1.00 0.00 N ATOM 2523 CA ASP B 65 13.855 16.178 -28.662 1.00 0.00 C ATOM 2524 C ASP B 65 12.747 15.277 -29.206 1.00 0.00 C ATOM 2525 O ASP B 65 13.006 14.232 -29.768 1.00 0.00 O ATOM 2526 CB ASP B 65 14.799 15.361 -27.777 1.00 0.00 C ATOM 2527 CG ASP B 65 14.131 15.072 -26.432 1.00 0.00 C ATOM 2528 OD1 ASP B 65 13.002 15.497 -26.248 1.00 0.00 O ATOM 2529 OD2 ASP B 65 14.764 14.436 -25.604 1.00 0.00 O ATOM 0 H ASP B 65 12.891 17.012 -26.943 1.00 0.00 H new ATOM 0 HA ASP B 65 14.410 16.597 -29.501 1.00 0.00 H new ATOM 0 HB2 ASP B 65 15.058 14.425 -28.273 1.00 0.00 H new ATOM 0 HB3 ASP B 65 15.729 15.907 -27.621 1.00 0.00 H new ATOM 2534 N GLY B 66 11.516 15.666 -29.040 1.00 0.00 N ATOM 2535 CA GLY B 66 10.397 14.822 -29.546 1.00 0.00 C ATOM 2536 C GLY B 66 10.153 13.675 -28.566 1.00 0.00 C ATOM 2537 O GLY B 66 9.308 12.828 -28.778 1.00 0.00 O ATOM 0 H GLY B 66 11.235 16.530 -28.577 1.00 0.00 H new ATOM 0 HA2 GLY B 66 9.493 15.422 -29.655 1.00 0.00 H new ATOM 0 HA3 GLY B 66 10.640 14.428 -30.533 1.00 0.00 H new ATOM 2541 N GLU B 67 10.889 13.649 -27.487 1.00 0.00 N ATOM 2542 CA GLU B 67 10.717 12.571 -26.470 1.00 0.00 C ATOM 2543 C GLU B 67 10.867 13.180 -25.072 1.00 0.00 C ATOM 2544 O GLU B 67 11.563 14.159 -24.885 1.00 0.00 O ATOM 2545 CB GLU B 67 11.778 11.487 -26.680 1.00 0.00 C ATOM 2546 CG GLU B 67 13.173 12.108 -26.647 1.00 0.00 C ATOM 2547 CD GLU B 67 14.217 11.010 -26.856 1.00 0.00 C ATOM 2548 OE1 GLU B 67 13.873 9.853 -26.675 1.00 0.00 O ATOM 2549 OE2 GLU B 67 15.341 11.344 -27.192 1.00 0.00 O ATOM 0 H GLU B 67 11.610 14.336 -27.265 1.00 0.00 H new ATOM 0 HA GLU B 67 9.729 12.122 -26.572 1.00 0.00 H new ATOM 0 HB2 GLU B 67 11.691 10.726 -25.904 1.00 0.00 H new ATOM 0 HB3 GLU B 67 11.616 10.988 -27.635 1.00 0.00 H new ATOM 0 HG2 GLU B 67 13.265 12.867 -27.424 1.00 0.00 H new ATOM 0 HG3 GLU B 67 13.339 12.608 -25.693 1.00 0.00 H new ATOM 2556 N CYS B 68 10.219 12.604 -24.092 1.00 0.00 N ATOM 2557 CA CYS B 68 10.304 13.119 -22.693 1.00 0.00 C ATOM 2558 C CYS B 68 10.909 12.013 -21.829 1.00 0.00 C ATOM 2559 O CYS B 68 10.597 10.850 -21.985 1.00 0.00 O ATOM 2560 CB CYS B 68 8.891 13.501 -22.213 1.00 0.00 C ATOM 2561 SG CYS B 68 8.015 12.042 -21.584 1.00 0.00 S ATOM 0 H CYS B 68 9.624 11.783 -24.205 1.00 0.00 H new ATOM 0 HA CYS B 68 10.931 14.008 -22.628 1.00 0.00 H new ATOM 0 HB2 CYS B 68 8.959 14.257 -21.430 1.00 0.00 H new ATOM 0 HB3 CYS B 68 8.329 13.943 -23.035 1.00 0.00 H new ATOM 0 HG CYS B 68 8.850 11.053 -21.464 1.00 0.00 H new ATOM 2567 N ASP B 69 11.789 12.360 -20.938 1.00 0.00 N ATOM 2568 CA ASP B 69 12.438 11.325 -20.084 1.00 0.00 C ATOM 2569 C ASP B 69 11.530 10.992 -18.905 1.00 0.00 C ATOM 2570 O ASP B 69 10.523 11.633 -18.684 1.00 0.00 O ATOM 2571 CB ASP B 69 13.786 11.848 -19.582 1.00 0.00 C ATOM 2572 CG ASP B 69 13.562 13.050 -18.669 1.00 0.00 C ATOM 2573 OD1 ASP B 69 12.416 13.419 -18.485 1.00 0.00 O ATOM 2574 OD2 ASP B 69 14.540 13.584 -18.173 1.00 0.00 O ATOM 0 H ASP B 69 12.090 13.318 -20.761 1.00 0.00 H new ATOM 0 HA ASP B 69 12.604 10.420 -20.669 1.00 0.00 H new ATOM 0 HB2 ASP B 69 14.314 11.062 -19.042 1.00 0.00 H new ATOM 0 HB3 ASP B 69 14.414 12.132 -20.426 1.00 0.00 H new ATOM 2579 N PHE B 70 11.874 9.989 -18.147 1.00 0.00 N ATOM 2580 CA PHE B 70 11.031 9.613 -16.992 1.00 0.00 C ATOM 2581 C PHE B 70 10.782 10.858 -16.138 1.00 0.00 C ATOM 2582 O PHE B 70 9.695 11.069 -15.651 1.00 0.00 O ATOM 2583 CB PHE B 70 11.768 8.531 -16.188 1.00 0.00 C ATOM 2584 CG PHE B 70 11.176 8.396 -14.802 1.00 0.00 C ATOM 2585 CD1 PHE B 70 9.794 8.250 -14.638 1.00 0.00 C ATOM 2586 CD2 PHE B 70 12.014 8.413 -13.680 1.00 0.00 C ATOM 2587 CE1 PHE B 70 9.253 8.124 -13.357 1.00 0.00 C ATOM 2588 CE2 PHE B 70 11.473 8.285 -12.403 1.00 0.00 C ATOM 2589 CZ PHE B 70 10.091 8.141 -12.237 1.00 0.00 C ATOM 0 H PHE B 70 12.706 9.415 -18.283 1.00 0.00 H new ATOM 0 HA PHE B 70 10.069 9.218 -17.318 1.00 0.00 H new ATOM 0 HB2 PHE B 70 11.704 7.576 -16.710 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.826 8.784 -16.114 1.00 0.00 H new ATOM 0 HD1 PHE B 70 9.146 8.235 -15.502 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.081 8.525 -13.805 1.00 0.00 H new ATOM 0 HE1 PHE B 70 8.186 8.013 -13.231 1.00 0.00 H new ATOM 0 HE2 PHE B 70 12.121 8.297 -11.539 1.00 0.00 H new ATOM 0 HZ PHE B 70 9.672 8.043 -11.246 1.00 0.00 H new ATOM 2599 N GLN B 71 11.775 11.684 -15.965 1.00 0.00 N ATOM 2600 CA GLN B 71 11.586 12.923 -15.155 1.00 0.00 C ATOM 2601 C GLN B 71 10.501 13.817 -15.781 1.00 0.00 C ATOM 2602 O GLN B 71 9.582 14.251 -15.111 1.00 0.00 O ATOM 2603 CB GLN B 71 12.934 13.676 -15.093 1.00 0.00 C ATOM 2604 CG GLN B 71 12.719 15.175 -14.822 1.00 0.00 C ATOM 2605 CD GLN B 71 14.055 15.823 -14.445 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.954 15.155 -13.976 1.00 0.00 O ATOM 2607 NE2 GLN B 71 14.228 17.104 -14.637 1.00 0.00 N ATOM 0 H GLN B 71 12.711 11.556 -16.349 1.00 0.00 H new ATOM 0 HA GLN B 71 11.261 12.660 -14.149 1.00 0.00 H new ATOM 0 HB2 GLN B 71 13.558 13.247 -14.309 1.00 0.00 H new ATOM 0 HB3 GLN B 71 13.470 13.546 -16.033 1.00 0.00 H new ATOM 0 HG2 GLN B 71 12.304 15.659 -15.706 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.997 15.310 -14.017 1.00 0.00 H new ATOM 0 HE21 GLN B 71 13.474 17.667 -15.031 1.00 0.00 H new ATOM 0 HE22 GLN B 71 15.117 17.541 -14.393 1.00 0.00 H new ATOM 2616 N GLU B 72 10.606 14.115 -17.046 1.00 0.00 N ATOM 2617 CA GLU B 72 9.588 14.998 -17.677 1.00 0.00 C ATOM 2618 C GLU B 72 8.205 14.348 -17.609 1.00 0.00 C ATOM 2619 O GLU B 72 7.212 14.995 -17.339 1.00 0.00 O ATOM 2620 CB GLU B 72 9.971 15.234 -19.131 1.00 0.00 C ATOM 2621 CG GLU B 72 11.193 16.150 -19.212 1.00 0.00 C ATOM 2622 CD GLU B 72 11.556 16.369 -20.683 1.00 0.00 C ATOM 2623 OE1 GLU B 72 10.718 16.088 -21.525 1.00 0.00 O ATOM 2624 OE2 GLU B 72 12.659 16.818 -20.942 1.00 0.00 O ATOM 0 H GLU B 72 11.347 13.788 -17.666 1.00 0.00 H new ATOM 0 HA GLU B 72 9.553 15.947 -17.142 1.00 0.00 H new ATOM 0 HB2 GLU B 72 10.187 14.283 -19.617 1.00 0.00 H new ATOM 0 HB3 GLU B 72 9.135 15.683 -19.667 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.980 17.105 -18.731 1.00 0.00 H new ATOM 0 HG3 GLU B 72 12.033 15.705 -18.679 1.00 0.00 H new ATOM 2631 N PHE B 73 8.138 13.072 -17.846 1.00 0.00 N ATOM 2632 CA PHE B 73 6.832 12.364 -17.798 1.00 0.00 C ATOM 2633 C PHE B 73 6.223 12.486 -16.403 1.00 0.00 C ATOM 2634 O PHE B 73 5.022 12.550 -16.245 1.00 0.00 O ATOM 2635 CB PHE B 73 7.027 10.886 -18.151 1.00 0.00 C ATOM 2636 CG PHE B 73 5.721 10.160 -17.939 1.00 0.00 C ATOM 2637 CD1 PHE B 73 4.800 10.056 -18.986 1.00 0.00 C ATOM 2638 CD2 PHE B 73 5.425 9.608 -16.687 1.00 0.00 C ATOM 2639 CE1 PHE B 73 3.582 9.400 -18.781 1.00 0.00 C ATOM 2640 CE2 PHE B 73 4.209 8.949 -16.482 1.00 0.00 C ATOM 2641 CZ PHE B 73 3.287 8.846 -17.529 1.00 0.00 C ATOM 0 H PHE B 73 8.939 12.483 -18.073 1.00 0.00 H new ATOM 0 HA PHE B 73 6.156 12.819 -18.522 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.351 10.785 -19.187 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.807 10.449 -17.528 1.00 0.00 H new ATOM 0 HD1 PHE B 73 5.029 10.482 -19.952 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.137 9.691 -15.879 1.00 0.00 H new ATOM 0 HE1 PHE B 73 2.869 9.321 -19.588 1.00 0.00 H new ATOM 0 HE2 PHE B 73 3.982 8.520 -15.517 1.00 0.00 H new ATOM 0 HZ PHE B 73 2.347 8.339 -17.372 1.00 0.00 H new ATOM 2651 N MET B 74 7.039 12.498 -15.392 1.00 0.00 N ATOM 2652 CA MET B 74 6.509 12.590 -14.011 1.00 0.00 C ATOM 2653 C MET B 74 5.714 13.874 -13.850 1.00 0.00 C ATOM 2654 O MET B 74 4.725 13.918 -13.146 1.00 0.00 O ATOM 2655 CB MET B 74 7.673 12.584 -13.008 1.00 0.00 C ATOM 2656 CG MET B 74 8.334 11.182 -12.930 1.00 0.00 C ATOM 2657 SD MET B 74 8.452 10.653 -11.199 1.00 0.00 S ATOM 2658 CE MET B 74 6.676 10.653 -10.834 1.00 0.00 C ATOM 0 H MET B 74 8.055 12.448 -15.464 1.00 0.00 H new ATOM 0 HA MET B 74 5.860 11.735 -13.821 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.416 13.324 -13.304 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.309 12.874 -12.022 1.00 0.00 H new ATOM 0 HG2 MET B 74 7.748 10.462 -13.501 1.00 0.00 H new ATOM 0 HG3 MET B 74 9.327 11.213 -13.379 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.453 11.439 -10.113 1.00 0.00 H new ATOM 0 HE2 MET B 74 6.116 10.833 -11.752 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.390 9.687 -10.418 1.00 0.00 H new ATOM 2668 N ALA B 75 6.142 14.928 -14.468 1.00 0.00 N ATOM 2669 CA ALA B 75 5.400 16.207 -14.308 1.00 0.00 C ATOM 2670 C ALA B 75 4.031 16.149 -14.994 1.00 0.00 C ATOM 2671 O ALA B 75 3.075 16.735 -14.527 1.00 0.00 O ATOM 2672 CB ALA B 75 6.223 17.359 -14.887 1.00 0.00 C ATOM 0 H ALA B 75 6.963 14.966 -15.072 1.00 0.00 H new ATOM 0 HA ALA B 75 5.236 16.372 -13.243 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.675 18.294 -14.767 1.00 0.00 H new ATOM 0 HB2 ALA B 75 7.175 17.427 -14.361 1.00 0.00 H new ATOM 0 HB3 ALA B 75 6.406 17.179 -15.946 1.00 0.00 H new ATOM 2678 N PHE B 76 3.920 15.462 -16.091 1.00 0.00 N ATOM 2679 CA PHE B 76 2.595 15.391 -16.792 1.00 0.00 C ATOM 2680 C PHE B 76 1.547 14.777 -15.878 1.00 0.00 C ATOM 2681 O PHE B 76 0.408 15.179 -15.856 1.00 0.00 O ATOM 2682 CB PHE B 76 2.728 14.530 -18.047 1.00 0.00 C ATOM 2683 CG PHE B 76 1.392 14.434 -18.748 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.810 15.580 -19.302 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.738 13.198 -18.850 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -0.425 15.492 -19.957 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -0.495 13.110 -19.506 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.077 14.257 -20.059 1.00 0.00 C ATOM 0 H PHE B 76 4.679 14.947 -16.537 1.00 0.00 H new ATOM 0 HA PHE B 76 2.287 16.401 -17.063 1.00 0.00 H new ATOM 0 HB2 PHE B 76 3.471 14.962 -18.718 1.00 0.00 H new ATOM 0 HB3 PHE B 76 3.081 13.534 -17.780 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.313 16.532 -19.224 1.00 0.00 H new ATOM 0 HD2 PHE B 76 1.186 12.313 -18.422 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.874 16.377 -20.383 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -0.998 12.157 -19.586 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.029 14.189 -20.564 1.00 0.00 H new ATOM 2698 N VAL B 77 1.931 13.786 -15.156 1.00 0.00 N ATOM 2699 CA VAL B 77 0.988 13.079 -14.242 1.00 0.00 C ATOM 2700 C VAL B 77 0.524 14.034 -13.147 1.00 0.00 C ATOM 2701 O VAL B 77 -0.597 13.978 -12.695 1.00 0.00 O ATOM 2702 CB VAL B 77 1.712 11.859 -13.623 1.00 0.00 C ATOM 2703 CG1 VAL B 77 0.755 10.664 -13.514 1.00 0.00 C ATOM 2704 CG2 VAL B 77 2.901 11.485 -14.512 1.00 0.00 C ATOM 0 H VAL B 77 2.882 13.417 -15.152 1.00 0.00 H new ATOM 0 HA VAL B 77 0.114 12.737 -14.796 1.00 0.00 H new ATOM 0 HB VAL B 77 2.058 12.117 -12.622 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.281 9.815 -13.077 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.091 10.932 -12.881 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.394 10.395 -14.507 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.419 10.626 -14.085 1.00 0.00 H new ATOM 0 HG22 VAL B 77 2.544 11.234 -15.511 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.588 12.329 -14.574 1.00 0.00 H new ATOM 2714 N SER B 78 1.388 14.891 -12.705 1.00 0.00 N ATOM 2715 CA SER B 78 1.007 15.835 -11.629 1.00 0.00 C ATOM 2716 C SER B 78 -0.105 16.761 -12.119 1.00 0.00 C ATOM 2717 O SER B 78 -1.023 17.085 -11.391 1.00 0.00 O ATOM 2718 CB SER B 78 2.233 16.666 -11.237 1.00 0.00 C ATOM 2719 OG SER B 78 1.819 17.935 -10.747 1.00 0.00 O ATOM 0 H SER B 78 2.346 14.980 -13.043 1.00 0.00 H new ATOM 0 HA SER B 78 0.647 15.277 -10.765 1.00 0.00 H new ATOM 0 HB2 SER B 78 2.810 16.142 -10.475 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.887 16.795 -12.099 1.00 0.00 H new ATOM 0 HG SER B 78 2.202 18.643 -11.307 1.00 0.00 H new ATOM 2725 N MET B 79 -0.020 17.211 -13.336 1.00 0.00 N ATOM 2726 CA MET B 79 -1.062 18.142 -13.852 1.00 0.00 C ATOM 2727 C MET B 79 -2.378 17.409 -14.140 1.00 0.00 C ATOM 2728 O MET B 79 -3.449 17.895 -13.830 1.00 0.00 O ATOM 2729 CB MET B 79 -0.550 18.787 -15.136 1.00 0.00 C ATOM 2730 CG MET B 79 0.693 19.631 -14.844 1.00 0.00 C ATOM 2731 SD MET B 79 1.621 19.883 -16.381 1.00 0.00 S ATOM 2732 CE MET B 79 0.227 20.332 -17.449 1.00 0.00 C ATOM 0 H MET B 79 0.722 16.977 -13.996 1.00 0.00 H new ATOM 0 HA MET B 79 -1.259 18.898 -13.092 1.00 0.00 H new ATOM 0 HB2 MET B 79 -0.311 18.016 -15.869 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.329 19.412 -15.573 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.403 20.592 -14.419 1.00 0.00 H new ATOM 0 HG3 MET B 79 1.320 19.132 -14.105 1.00 0.00 H new ATOM 0 HE1 MET B 79 0.602 20.799 -18.360 1.00 0.00 H new ATOM 0 HE2 MET B 79 -0.337 19.436 -17.707 1.00 0.00 H new ATOM 0 HE3 MET B 79 -0.423 21.032 -16.924 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.311 16.255 -14.739 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.566 15.508 -15.059 1.00 0.00 C ATOM 2744 C VAL B 80 -4.312 15.171 -13.771 1.00 0.00 C ATOM 2745 O VAL B 80 -5.525 15.203 -13.714 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.244 14.216 -15.810 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.544 13.440 -16.053 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.594 14.553 -17.154 1.00 0.00 C ATOM 0 H VAL B 80 -1.446 15.794 -15.022 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.191 16.139 -15.691 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.557 13.610 -15.219 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.322 12.517 -16.588 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.010 13.202 -15.097 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.226 14.049 -16.647 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.365 13.631 -17.689 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.280 15.156 -17.749 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -1.674 15.112 -16.983 1.00 0.00 H new ATOM 2758 N THR B 81 -3.594 14.834 -12.743 1.00 0.00 N ATOM 2759 CA THR B 81 -4.248 14.476 -11.455 1.00 0.00 C ATOM 2760 C THR B 81 -5.058 15.670 -10.978 1.00 0.00 C ATOM 2761 O THR B 81 -6.145 15.533 -10.454 1.00 0.00 O ATOM 2762 CB THR B 81 -3.184 14.142 -10.409 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.405 13.045 -10.861 1.00 0.00 O ATOM 2764 CG2 THR B 81 -3.859 13.779 -9.081 1.00 0.00 C ATOM 0 H THR B 81 -2.575 14.790 -12.737 1.00 0.00 H new ATOM 0 HA THR B 81 -4.894 13.610 -11.597 1.00 0.00 H new ATOM 0 HB THR B 81 -2.540 15.009 -10.259 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.751 13.358 -11.521 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.097 13.542 -8.339 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.455 14.623 -8.733 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.506 12.914 -9.226 1.00 0.00 H new ATOM 2772 N THR B 82 -4.531 16.843 -11.158 1.00 0.00 N ATOM 2773 CA THR B 82 -5.258 18.058 -10.721 1.00 0.00 C ATOM 2774 C THR B 82 -6.652 18.029 -11.352 1.00 0.00 C ATOM 2775 O THR B 82 -7.641 18.338 -10.717 1.00 0.00 O ATOM 2776 CB THR B 82 -4.487 19.292 -11.204 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.096 19.080 -11.005 1.00 0.00 O ATOM 2778 CG2 THR B 82 -4.921 20.518 -10.409 1.00 0.00 C ATOM 0 H THR B 82 -3.623 17.013 -11.591 1.00 0.00 H new ATOM 0 HA THR B 82 -5.346 18.094 -9.635 1.00 0.00 H new ATOM 0 HB THR B 82 -4.694 19.454 -12.262 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.957 18.575 -10.177 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.369 21.391 -10.757 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.989 20.684 -10.550 1.00 0.00 H new ATOM 0 HG23 THR B 82 -4.715 20.357 -9.351 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.739 17.621 -12.589 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.068 17.525 -13.250 1.00 0.00 C ATOM 2788 C ALA B 83 -8.921 16.535 -12.458 1.00 0.00 C ATOM 2789 O ALA B 83 -10.110 16.714 -12.286 1.00 0.00 O ATOM 2790 CB ALA B 83 -7.894 17.039 -14.695 1.00 0.00 C ATOM 0 H ALA B 83 -5.945 17.350 -13.169 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.554 18.500 -13.273 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -8.870 16.970 -15.176 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.269 17.744 -15.243 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.420 16.058 -14.694 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.309 15.488 -11.973 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.062 14.476 -11.188 1.00 0.00 C ATOM 2798 C CYS B 84 -9.706 15.165 -9.979 1.00 0.00 C ATOM 2799 O CYS B 84 -10.793 14.816 -9.566 1.00 0.00 O ATOM 2800 CB CYS B 84 -8.102 13.376 -10.714 1.00 0.00 C ATOM 2801 SG CYS B 84 -9.040 11.869 -10.355 1.00 0.00 S ATOM 0 H CYS B 84 -7.315 15.292 -12.089 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.837 14.025 -11.807 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.353 13.177 -11.481 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -7.567 13.705 -9.823 1.00 0.00 H new ATOM 0 HG CYS B 84 -8.227 10.937 -9.955 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.052 16.150 -9.411 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.653 16.850 -8.241 1.00 0.00 C ATOM 2809 C HIS B 85 -10.982 17.459 -8.675 1.00 0.00 C ATOM 2810 O HIS B 85 -11.967 17.405 -7.965 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.711 17.961 -7.771 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.311 18.654 -6.581 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -10.161 19.744 -6.705 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -9.190 18.424 -5.233 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -10.515 20.125 -5.463 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -9.949 19.353 -4.534 1.00 0.00 N ATOM 0 H HIS B 85 -8.138 16.494 -9.706 1.00 0.00 H new ATOM 0 HA HIS B 85 -9.811 16.147 -7.423 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.739 17.542 -7.510 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.544 18.676 -8.576 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -8.596 17.641 -4.785 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -11.175 20.952 -5.246 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -10.052 19.429 -3.522 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.021 18.018 -9.850 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.288 18.608 -10.353 1.00 0.00 C ATOM 2827 C GLU B 86 -13.341 17.503 -10.436 1.00 0.00 C ATOM 2828 O GLU B 86 -14.495 17.699 -10.109 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.050 19.219 -11.737 1.00 0.00 C ATOM 2830 CG GLU B 86 -13.348 19.842 -12.257 1.00 0.00 C ATOM 2831 CD GLU B 86 -13.076 20.560 -13.581 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -11.917 20.673 -13.945 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -14.032 20.990 -14.206 1.00 0.00 O ATOM 0 H GLU B 86 -10.226 18.092 -10.485 1.00 0.00 H new ATOM 0 HA GLU B 86 -12.635 19.392 -9.680 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.269 19.977 -11.681 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.701 18.452 -12.428 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -14.103 19.069 -12.399 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -13.745 20.545 -11.525 1.00 0.00 H new ATOM 2840 N PHE B 87 -12.944 16.337 -10.869 1.00 0.00 N ATOM 2841 CA PHE B 87 -13.907 15.210 -10.971 1.00 0.00 C ATOM 2842 C PHE B 87 -14.300 14.775 -9.567 1.00 0.00 C ATOM 2843 O PHE B 87 -15.452 14.509 -9.284 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.255 14.035 -11.698 1.00 0.00 C ATOM 2845 CG PHE B 87 -14.266 12.929 -11.847 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -15.081 12.888 -12.981 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -14.393 11.950 -10.854 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -16.024 11.867 -13.127 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -15.338 10.928 -10.999 1.00 0.00 C ATOM 2850 CZ PHE B 87 -16.154 10.886 -12.137 1.00 0.00 C ATOM 0 H PHE B 87 -11.990 16.119 -11.157 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.788 15.530 -11.527 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -12.895 14.351 -12.677 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -12.389 13.681 -11.139 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -14.982 13.645 -13.745 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -13.763 11.984 -9.978 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -16.653 11.835 -14.004 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -15.438 10.172 -10.234 1.00 0.00 H new ATOM 0 HZ PHE B 87 -16.883 10.097 -12.250 1.00 0.00 H new ATOM 2860 N PHE B 88 -13.346 14.716 -8.676 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.654 14.317 -7.275 1.00 0.00 C ATOM 2862 C PHE B 88 -13.898 15.577 -6.461 1.00 0.00 C ATOM 2863 O PHE B 88 -13.109 15.966 -5.623 1.00 0.00 O ATOM 2864 CB PHE B 88 -12.484 13.517 -6.682 1.00 0.00 C ATOM 2865 CG PHE B 88 -12.579 12.073 -7.130 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -13.697 11.307 -6.772 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -11.561 11.503 -7.907 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -13.796 9.974 -7.189 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -11.662 10.172 -8.325 1.00 0.00 C ATOM 2870 CZ PHE B 88 -12.779 9.407 -7.966 1.00 0.00 C ATOM 0 H PHE B 88 -12.365 14.928 -8.860 1.00 0.00 H new ATOM 0 HA PHE B 88 -14.541 13.684 -7.254 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -11.536 13.947 -7.004 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -12.506 13.573 -5.594 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -14.482 11.745 -6.174 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.699 12.092 -8.183 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -14.657 9.384 -6.911 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -10.878 9.734 -8.925 1.00 0.00 H new ATOM 0 HZ PHE B 88 -12.856 8.379 -8.289 1.00 0.00 H new ATOM 3114 N ARG X 104 20.763 18.756 4.150 1.00 0.00 N ATOM 3115 CA ARG X 104 19.679 17.879 3.626 1.00 0.00 C ATOM 3116 C ARG X 104 19.045 18.504 2.373 1.00 0.00 C ATOM 3117 O ARG X 104 18.646 17.807 1.453 1.00 0.00 O ATOM 3118 CB ARG X 104 18.608 17.700 4.711 1.00 0.00 C ATOM 3119 CG ARG X 104 18.001 19.057 5.084 1.00 0.00 C ATOM 3120 CD ARG X 104 16.964 18.861 6.193 1.00 0.00 C ATOM 3121 NE ARG X 104 16.029 17.742 5.828 1.00 0.00 N ATOM 3122 CZ ARG X 104 15.345 17.749 4.712 1.00 0.00 C ATOM 3123 NH1 ARG X 104 15.305 18.812 3.960 1.00 0.00 N ATOM 3124 NH2 ARG X 104 14.646 16.701 4.376 1.00 0.00 N ATOM 0 HA ARG X 104 20.101 16.910 3.358 1.00 0.00 H new ATOM 0 HB2 ARG X 104 17.826 17.030 4.354 1.00 0.00 H new ATOM 0 HB3 ARG X 104 19.048 17.235 5.593 1.00 0.00 H new ATOM 0 HG2 ARG X 104 18.783 19.738 5.418 1.00 0.00 H new ATOM 0 HG3 ARG X 104 17.534 19.512 4.210 1.00 0.00 H new ATOM 0 HD2 ARG X 104 17.464 18.636 7.135 1.00 0.00 H new ATOM 0 HD3 ARG X 104 16.401 19.782 6.343 1.00 0.00 H new ATOM 0 HE ARG X 104 15.925 16.955 6.468 1.00 0.00 H new ATOM 0 HH11 ARG X 104 15.811 19.653 4.238 1.00 0.00 H new ATOM 0 HH12 ARG X 104 14.768 18.803 3.093 1.00 0.00 H new ATOM 0 HH21 ARG X 104 14.634 15.880 4.982 1.00 0.00 H new ATOM 0 HH22 ARG X 104 14.111 16.702 3.507 1.00 0.00 H new ATOM 3138 N HIS X 105 18.942 19.804 2.324 1.00 0.00 N ATOM 3139 CA HIS X 105 18.324 20.449 1.132 1.00 0.00 C ATOM 3140 C HIS X 105 19.129 20.090 -0.116 1.00 0.00 C ATOM 3141 O HIS X 105 18.577 19.849 -1.168 1.00 0.00 O ATOM 3142 CB HIS X 105 18.277 21.974 1.315 1.00 0.00 C ATOM 3143 CG HIS X 105 19.653 22.576 1.175 1.00 0.00 C ATOM 3144 ND1 HIS X 105 20.375 22.511 -0.009 1.00 0.00 N ATOM 3145 CD2 HIS X 105 20.443 23.277 2.055 1.00 0.00 C ATOM 3146 CE1 HIS X 105 21.542 23.153 0.190 1.00 0.00 C ATOM 3147 NE2 HIS X 105 21.630 23.637 1.429 1.00 0.00 N ATOM 0 H HIS X 105 19.257 20.444 3.053 1.00 0.00 H new ATOM 0 HA HIS X 105 17.303 20.085 1.017 1.00 0.00 H new ATOM 0 HB2 HIS X 105 17.607 22.412 0.575 1.00 0.00 H new ATOM 0 HB3 HIS X 105 17.869 22.214 2.297 1.00 0.00 H new ATOM 0 HD2 HIS X 105 20.181 23.512 3.076 1.00 0.00 H new ATOM 0 HE1 HIS X 105 22.311 23.262 -0.561 1.00 0.00 H new ATOM 0 HE2 HIS X 105 22.406 24.162 1.833 1.00 0.00 H new ATOM 3156 N LYS X 106 20.426 20.047 -0.003 1.00 0.00 N ATOM 3157 CA LYS X 106 21.268 19.705 -1.183 1.00 0.00 C ATOM 3158 C LYS X 106 20.891 18.311 -1.682 1.00 0.00 C ATOM 3159 O LYS X 106 20.967 18.024 -2.861 1.00 0.00 O ATOM 3160 CB LYS X 106 22.746 19.716 -0.782 1.00 0.00 C ATOM 3161 CG LYS X 106 23.622 19.436 -2.013 1.00 0.00 C ATOM 3162 CD LYS X 106 25.103 19.381 -1.603 1.00 0.00 C ATOM 3163 CE LYS X 106 25.429 18.014 -0.984 1.00 0.00 C ATOM 3164 NZ LYS X 106 26.907 17.864 -0.854 1.00 0.00 N ATOM 0 H LYS X 106 20.941 20.234 0.857 1.00 0.00 H new ATOM 0 HA LYS X 106 21.102 20.438 -1.972 1.00 0.00 H new ATOM 0 HB2 LYS X 106 23.008 20.682 -0.350 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.930 18.964 -0.015 1.00 0.00 H new ATOM 0 HG2 LYS X 106 23.328 18.492 -2.472 1.00 0.00 H new ATOM 0 HG3 LYS X 106 23.472 20.214 -2.761 1.00 0.00 H new ATOM 0 HD2 LYS X 106 25.736 19.555 -2.473 1.00 0.00 H new ATOM 0 HD3 LYS X 106 25.320 20.174 -0.887 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.957 17.924 -0.006 1.00 0.00 H new ATOM 0 HE3 LYS X 106 25.026 17.216 -1.607 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 27.126 16.938 -0.435 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 27.347 17.931 -1.794 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 27.280 18.618 -0.242 1.00 0.00 H new ATOM 3178 N LYS X 107 20.498 17.434 -0.801 1.00 0.00 N ATOM 3179 CA LYS X 107 20.143 16.063 -1.252 1.00 0.00 C ATOM 3180 C LYS X 107 18.994 16.147 -2.260 1.00 0.00 C ATOM 3181 O LYS X 107 19.010 15.485 -3.279 1.00 0.00 O ATOM 3182 CB LYS X 107 19.713 15.227 -0.043 1.00 0.00 C ATOM 3183 CG LYS X 107 19.410 13.794 -0.488 1.00 0.00 C ATOM 3184 CD LYS X 107 18.987 12.959 0.722 1.00 0.00 C ATOM 3185 CE LYS X 107 18.706 11.521 0.276 1.00 0.00 C ATOM 3186 NZ LYS X 107 17.494 11.489 -0.590 1.00 0.00 N ATOM 0 H LYS X 107 20.408 17.605 0.200 1.00 0.00 H new ATOM 0 HA LYS X 107 21.006 15.593 -1.725 1.00 0.00 H new ATOM 0 HB2 LYS X 107 20.502 15.225 0.709 1.00 0.00 H new ATOM 0 HB3 LYS X 107 18.831 15.668 0.421 1.00 0.00 H new ATOM 0 HG2 LYS X 107 18.618 13.795 -1.237 1.00 0.00 H new ATOM 0 HG3 LYS X 107 20.291 13.354 -0.956 1.00 0.00 H new ATOM 0 HD2 LYS X 107 19.773 12.970 1.478 1.00 0.00 H new ATOM 0 HD3 LYS X 107 18.097 13.389 1.181 1.00 0.00 H new ATOM 0 HE2 LYS X 107 19.564 11.125 -0.268 1.00 0.00 H new ATOM 0 HE3 LYS X 107 18.559 10.883 1.147 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 17.149 10.511 -0.668 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 16.752 12.086 -0.171 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 17.734 11.848 -1.536 1.00 0.00 H new ATOM 3200 N LEU X 108 18.008 16.963 -2.007 1.00 0.00 N ATOM 3201 CA LEU X 108 16.884 17.081 -2.987 1.00 0.00 C ATOM 3202 C LEU X 108 17.357 17.867 -4.225 1.00 0.00 C ATOM 3203 O LEU X 108 16.833 17.704 -5.306 1.00 0.00 O ATOM 3204 CB LEU X 108 15.675 17.786 -2.325 1.00 0.00 C ATOM 3205 CG LEU X 108 14.605 16.751 -1.915 1.00 0.00 C ATOM 3206 CD1 LEU X 108 13.702 17.342 -0.831 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.735 16.383 -3.125 1.00 0.00 C ATOM 0 H LEU X 108 17.929 17.548 -1.175 1.00 0.00 H new ATOM 0 HA LEU X 108 16.572 16.085 -3.301 1.00 0.00 H new ATOM 0 HB2 LEU X 108 16.006 18.343 -1.448 1.00 0.00 H new ATOM 0 HB3 LEU X 108 15.244 18.509 -3.017 1.00 0.00 H new ATOM 0 HG LEU X 108 15.110 15.861 -1.539 1.00 0.00 H new ATOM 0 HD11 LEU X 108 12.949 16.608 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU X 108 14.303 17.604 0.040 1.00 0.00 H new ATOM 0 HD13 LEU X 108 13.210 18.236 -1.215 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.984 15.653 -2.824 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.240 17.278 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU X 108 14.362 15.957 -3.908 1.00 0.00 H new ATOM 3219 N MET X 109 18.337 18.715 -4.084 1.00 0.00 N ATOM 3220 CA MET X 109 18.809 19.496 -5.262 1.00 0.00 C ATOM 3221 C MET X 109 19.232 18.539 -6.373 1.00 0.00 C ATOM 3222 O MET X 109 19.248 18.898 -7.530 1.00 0.00 O ATOM 3223 CB MET X 109 19.987 20.400 -4.878 1.00 0.00 C ATOM 3224 CG MET X 109 19.516 21.514 -3.931 1.00 0.00 C ATOM 3225 SD MET X 109 18.283 22.568 -4.751 1.00 0.00 S ATOM 3226 CE MET X 109 16.821 22.017 -3.826 1.00 0.00 C ATOM 0 H MET X 109 18.829 18.901 -3.210 1.00 0.00 H new ATOM 0 HA MET X 109 17.992 20.126 -5.613 1.00 0.00 H new ATOM 0 HB2 MET X 109 20.766 19.809 -4.397 1.00 0.00 H new ATOM 0 HB3 MET X 109 20.427 20.837 -5.775 1.00 0.00 H new ATOM 0 HG2 MET X 109 19.087 21.076 -3.030 1.00 0.00 H new ATOM 0 HG3 MET X 109 20.368 22.117 -3.618 1.00 0.00 H new ATOM 0 HE1 MET X 109 15.919 22.340 -4.345 1.00 0.00 H new ATOM 0 HE2 MET X 109 16.827 20.930 -3.751 1.00 0.00 H new ATOM 0 HE3 MET X 109 16.839 22.450 -2.826 1.00 0.00 H new ATOM 3236 N PHE X 110 19.594 17.328 -6.043 1.00 0.00 N ATOM 3237 CA PHE X 110 20.030 16.372 -7.109 1.00 0.00 C ATOM 3238 C PHE X 110 19.055 16.466 -8.296 1.00 0.00 C ATOM 3239 O PHE X 110 19.453 16.478 -9.444 1.00 0.00 O ATOM 3240 CB PHE X 110 20.056 14.933 -6.541 1.00 0.00 C ATOM 3241 CG PHE X 110 18.712 14.249 -6.735 1.00 0.00 C ATOM 3242 CD1 PHE X 110 17.596 14.650 -5.987 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.585 13.228 -7.685 1.00 0.00 C ATOM 3244 CE1 PHE X 110 16.358 14.028 -6.191 1.00 0.00 C ATOM 3245 CE2 PHE X 110 17.350 12.606 -7.885 1.00 0.00 C ATOM 3246 CZ PHE X 110 16.237 13.006 -7.141 1.00 0.00 C ATOM 0 H PHE X 110 19.608 16.959 -5.092 1.00 0.00 H new ATOM 0 HA PHE X 110 21.034 16.627 -7.449 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.837 14.356 -7.036 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.305 14.961 -5.480 1.00 0.00 H new ATOM 0 HD1 PHE X 110 17.691 15.438 -5.254 1.00 0.00 H new ATOM 0 HD2 PHE X 110 19.443 12.921 -8.264 1.00 0.00 H new ATOM 0 HE1 PHE X 110 15.497 14.336 -5.616 1.00 0.00 H new ATOM 0 HE2 PHE X 110 17.256 11.816 -8.615 1.00 0.00 H new ATOM 0 HZ PHE X 110 15.282 12.527 -7.299 1.00 0.00 H new ATOM 3256 N LYS X 111 17.782 16.558 -8.016 1.00 0.00 N ATOM 3257 CA LYS X 111 16.784 16.680 -9.116 1.00 0.00 C ATOM 3258 C LYS X 111 16.943 18.058 -9.768 1.00 0.00 C ATOM 3259 O LYS X 111 16.705 18.229 -10.941 1.00 0.00 O ATOM 3260 CB LYS X 111 15.371 16.558 -8.527 1.00 0.00 C ATOM 3261 CG LYS X 111 15.020 17.851 -7.773 1.00 0.00 C ATOM 3262 CD LYS X 111 13.969 17.594 -6.703 1.00 0.00 C ATOM 3263 CE LYS X 111 13.782 18.881 -5.898 1.00 0.00 C ATOM 3264 NZ LYS X 111 12.494 18.825 -5.152 1.00 0.00 N ATOM 0 H LYS X 111 17.391 16.554 -7.074 1.00 0.00 H new ATOM 0 HA LYS X 111 16.940 15.895 -9.856 1.00 0.00 H new ATOM 0 HB2 LYS X 111 14.647 16.380 -9.322 1.00 0.00 H new ATOM 0 HB3 LYS X 111 15.319 15.704 -7.851 1.00 0.00 H new ATOM 0 HG2 LYS X 111 15.918 18.263 -7.313 1.00 0.00 H new ATOM 0 HG3 LYS X 111 14.652 18.597 -8.477 1.00 0.00 H new ATOM 0 HD2 LYS X 111 13.027 17.291 -7.160 1.00 0.00 H new ATOM 0 HD3 LYS X 111 14.282 16.779 -6.050 1.00 0.00 H new ATOM 0 HE2 LYS X 111 14.611 19.009 -5.202 1.00 0.00 H new ATOM 0 HE3 LYS X 111 13.790 19.743 -6.565 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 11.846 19.549 -5.524 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 12.066 17.884 -5.268 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 12.669 19.003 -4.142 1.00 0.00 H new ATOM 3278 N THR X 112 17.318 19.044 -8.990 1.00 0.00 N ATOM 3279 CA THR X 112 17.475 20.423 -9.538 1.00 0.00 C ATOM 3280 C THR X 112 18.542 20.411 -10.631 1.00 0.00 C ATOM 3281 O THR X 112 18.412 21.061 -11.649 1.00 0.00 O ATOM 3282 CB THR X 112 17.895 21.382 -8.417 1.00 0.00 C ATOM 3283 OG1 THR X 112 16.917 21.361 -7.388 1.00 0.00 O ATOM 3284 CG2 THR X 112 18.006 22.798 -8.974 1.00 0.00 C ATOM 0 H THR X 112 17.522 18.950 -7.995 1.00 0.00 H new ATOM 0 HA THR X 112 16.526 20.759 -9.957 1.00 0.00 H new ATOM 0 HB THR X 112 18.859 21.070 -8.015 1.00 0.00 H new ATOM 0 HG1 THR X 112 17.258 21.837 -6.603 1.00 0.00 H new ATOM 0 HG21 THR X 112 18.304 23.480 -8.178 1.00 0.00 H new ATOM 0 HG22 THR X 112 18.752 22.819 -9.768 1.00 0.00 H new ATOM 0 HG23 THR X 112 17.041 23.108 -9.374 1.00 0.00 H new ATOM 3292 N GLU X 113 19.598 19.677 -10.424 1.00 0.00 N ATOM 3293 CA GLU X 113 20.685 19.616 -11.441 1.00 0.00 C ATOM 3294 CB GLU X 113 20.108 19.252 -12.828 1.00 0.00 C ATOM 3295 CG GLU X 113 18.866 18.342 -12.684 1.00 0.00 C ATOM 3296 CD GLU X 113 18.773 17.388 -13.882 1.00 0.00 C ATOM 3297 OE1 GLU X 113 19.121 17.805 -14.974 1.00 0.00 O ATOM 3298 OE2 GLU X 113 18.352 16.260 -13.685 1.00 0.00 O ATOM 0 H GLU X 113 19.757 19.113 -9.589 1.00 0.00 H new ATOM 0 HB2 GLU X 113 19.838 20.161 -13.365 1.00 0.00 H new ATOM 0 HB3 GLU X 113 20.869 18.745 -13.422 1.00 0.00 H new ATOM 0 HG2 GLU X 113 18.929 17.771 -11.758 1.00 0.00 H new ATOM 0 HG3 GLU X 113 17.964 18.951 -12.622 1.00 0.00 H new ATOM 3493 N ARG Y 104 -10.675 17.177 -28.231 1.00 0.00 N ATOM 3494 CA ARG Y 104 -10.363 16.584 -26.899 1.00 0.00 C ATOM 3495 C ARG Y 104 -9.105 17.235 -26.307 1.00 0.00 C ATOM 3496 O ARG Y 104 -8.994 17.418 -25.105 1.00 0.00 O ATOM 3497 CB ARG Y 104 -10.135 15.073 -27.059 1.00 0.00 C ATOM 3498 CG ARG Y 104 -8.956 14.811 -28.006 1.00 0.00 C ATOM 3499 CD ARG Y 104 -8.760 13.304 -28.178 1.00 0.00 C ATOM 3500 NE ARG Y 104 -8.768 12.629 -26.838 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -7.936 12.965 -25.888 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -6.956 13.795 -26.120 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -8.059 12.423 -24.711 1.00 0.00 N ATOM 0 HA ARG Y 104 -11.200 16.762 -26.224 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -9.936 14.623 -26.086 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -11.037 14.601 -27.450 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -9.144 15.276 -28.974 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -8.048 15.263 -27.606 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -9.552 12.895 -28.805 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -7.817 13.107 -28.688 1.00 0.00 H new ATOM 0 HE ARG Y 104 -9.444 11.885 -26.663 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -6.832 14.190 -27.052 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -6.314 14.049 -25.369 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -8.799 11.743 -24.537 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -7.415 12.678 -23.962 1.00 0.00 H new ATOM 3517 N HIS Y 105 -8.151 17.584 -27.129 1.00 0.00 N ATOM 3518 CA HIS Y 105 -6.910 18.208 -26.591 1.00 0.00 C ATOM 3519 C HIS Y 105 -7.267 19.500 -25.858 1.00 0.00 C ATOM 3520 O HIS Y 105 -6.710 19.806 -24.826 1.00 0.00 O ATOM 3521 CB HIS Y 105 -5.923 18.499 -27.733 1.00 0.00 C ATOM 3522 CG HIS Y 105 -6.388 19.667 -28.563 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -6.517 20.947 -28.041 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -6.737 19.766 -29.886 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -6.928 21.752 -29.040 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -7.076 21.080 -30.181 1.00 0.00 N ATOM 0 H HIS Y 105 -8.178 17.465 -28.142 1.00 0.00 H new ATOM 0 HA HIS Y 105 -6.435 17.519 -25.893 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -4.936 18.711 -27.321 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -5.822 17.617 -28.365 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -6.747 18.947 -30.590 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -7.114 22.810 -28.930 1.00 0.00 H new ATOM 0 HE2 HIS Y 105 -7.375 21.453 -31.082 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.193 20.253 -26.379 1.00 0.00 N ATOM 3536 CA LYS Y 106 -8.584 21.525 -25.713 1.00 0.00 C ATOM 3537 C LYS Y 106 -9.101 21.218 -24.307 1.00 0.00 C ATOM 3538 O LYS Y 106 -8.948 22.009 -23.396 1.00 0.00 O ATOM 3539 CB LYS Y 106 -9.691 22.212 -26.522 1.00 0.00 C ATOM 3540 CG LYS Y 106 -10.053 23.558 -25.874 1.00 0.00 C ATOM 3541 CD LYS Y 106 -11.202 24.227 -26.649 1.00 0.00 C ATOM 3542 CE LYS Y 106 -12.547 23.620 -26.226 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -13.659 24.433 -26.800 1.00 0.00 N ATOM 0 H LYS Y 106 -8.698 20.042 -27.240 1.00 0.00 H new ATOM 0 HA LYS Y 106 -7.718 22.185 -25.653 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -9.359 22.370 -27.548 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -10.572 21.571 -26.567 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -10.346 23.403 -24.836 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -9.181 24.212 -25.865 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -11.203 25.300 -26.459 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -11.055 24.093 -27.721 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -12.619 22.589 -26.573 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -12.622 23.597 -25.139 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -14.571 24.024 -26.515 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -13.593 25.409 -26.448 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -13.589 24.433 -27.838 1.00 0.00 H new ATOM 3557 N LYS Y 107 -9.723 20.086 -24.116 1.00 0.00 N ATOM 3558 CA LYS Y 107 -10.255 19.766 -22.760 1.00 0.00 C ATOM 3559 C LYS Y 107 -9.099 19.758 -21.755 1.00 0.00 C ATOM 3560 O LYS Y 107 -9.213 20.292 -20.669 1.00 0.00 O ATOM 3561 CB LYS Y 107 -10.916 18.384 -22.784 1.00 0.00 C ATOM 3562 CG LYS Y 107 -11.546 18.084 -21.421 1.00 0.00 C ATOM 3563 CD LYS Y 107 -12.201 16.700 -21.462 1.00 0.00 C ATOM 3564 CE LYS Y 107 -12.840 16.389 -20.107 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -11.780 16.298 -19.064 1.00 0.00 N ATOM 0 H LYS Y 107 -9.885 19.376 -24.831 1.00 0.00 H new ATOM 0 HA LYS Y 107 -10.991 20.516 -22.469 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -11.678 18.349 -23.562 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -10.176 17.622 -23.028 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -10.786 18.117 -20.641 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -12.288 18.844 -21.175 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -12.957 16.668 -22.247 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -11.456 15.942 -21.706 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -13.557 17.167 -19.844 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -13.393 15.451 -20.161 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -12.149 15.784 -18.238 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -10.957 15.791 -19.448 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -11.493 17.255 -18.776 1.00 0.00 H new ATOM 3579 N LEU Y 108 -7.981 19.179 -22.103 1.00 0.00 N ATOM 3580 CA LEU Y 108 -6.827 19.175 -21.150 1.00 0.00 C ATOM 3581 C LEU Y 108 -6.205 20.582 -21.090 1.00 0.00 C ATOM 3582 O LEU Y 108 -5.603 20.956 -20.107 1.00 0.00 O ATOM 3583 CB LEU Y 108 -5.770 18.132 -21.597 1.00 0.00 C ATOM 3584 CG LEU Y 108 -5.891 16.842 -20.754 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -5.268 15.662 -21.511 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -5.150 17.021 -19.422 1.00 0.00 C ATOM 0 H LEU Y 108 -7.815 18.713 -22.995 1.00 0.00 H new ATOM 0 HA LEU Y 108 -7.180 18.901 -20.156 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -5.906 17.897 -22.653 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -4.769 18.551 -21.490 1.00 0.00 H new ATOM 0 HG LEU Y 108 -6.946 16.643 -20.568 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -5.357 14.757 -20.911 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -5.789 15.522 -22.458 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -4.215 15.868 -21.703 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -5.238 16.109 -18.831 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.097 17.227 -19.616 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -5.587 17.854 -18.871 1.00 0.00 H new ATOM 3598 N MET Y 109 -6.338 21.366 -22.124 1.00 0.00 N ATOM 3599 CA MET Y 109 -5.735 22.729 -22.093 1.00 0.00 C ATOM 3600 C MET Y 109 -6.283 23.504 -20.897 1.00 0.00 C ATOM 3601 O MET Y 109 -5.662 24.427 -20.418 1.00 0.00 O ATOM 3602 CB MET Y 109 -6.040 23.490 -23.390 1.00 0.00 C ATOM 3603 CG MET Y 109 -5.303 22.837 -24.568 1.00 0.00 C ATOM 3604 SD MET Y 109 -3.505 22.936 -24.321 1.00 0.00 S ATOM 3605 CE MET Y 109 -3.197 21.176 -23.996 1.00 0.00 C ATOM 0 H MET Y 109 -6.834 21.125 -22.982 1.00 0.00 H new ATOM 0 HA MET Y 109 -4.654 22.629 -22.000 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -7.114 23.490 -23.577 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -5.734 24.531 -23.291 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -5.607 21.795 -24.663 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -5.577 23.335 -25.498 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.186 21.049 -23.609 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -3.915 20.811 -23.262 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -3.305 20.611 -24.922 1.00 0.00 H new ATOM 3615 N PHE Y 110 -7.445 23.155 -20.413 1.00 0.00 N ATOM 3616 CA PHE Y 110 -8.017 23.903 -19.247 1.00 0.00 C ATOM 3617 C PHE Y 110 -6.909 24.131 -18.204 1.00 0.00 C ATOM 3618 O PHE Y 110 -6.780 25.199 -17.640 1.00 0.00 O ATOM 3619 CB PHE Y 110 -9.183 23.097 -18.629 1.00 0.00 C ATOM 3620 CG PHE Y 110 -8.681 22.158 -17.544 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -7.921 21.030 -17.881 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -8.966 22.430 -16.199 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -7.450 20.178 -16.877 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -8.496 21.576 -15.197 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -7.737 20.451 -15.536 1.00 0.00 C ATOM 0 H PHE Y 110 -8.021 22.392 -20.768 1.00 0.00 H new ATOM 0 HA PHE Y 110 -8.402 24.868 -19.578 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -9.921 23.781 -18.210 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -9.686 22.523 -19.407 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -7.699 20.818 -18.917 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -9.549 23.300 -15.936 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -6.864 19.309 -17.138 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -8.719 21.785 -14.161 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -7.372 19.793 -14.761 1.00 0.00 H new ATOM 3635 N LYS Y 111 -6.096 23.134 -17.970 1.00 0.00 N ATOM 3636 CA LYS Y 111 -4.983 23.294 -16.991 1.00 0.00 C ATOM 3637 C LYS Y 111 -3.950 24.263 -17.578 1.00 0.00 C ATOM 3638 O LYS Y 111 -3.296 24.992 -16.868 1.00 0.00 O ATOM 3639 CB LYS Y 111 -4.322 21.927 -16.759 1.00 0.00 C ATOM 3640 CG LYS Y 111 -3.478 21.555 -17.988 1.00 0.00 C ATOM 3641 CD LYS Y 111 -3.301 20.048 -18.094 1.00 0.00 C ATOM 3642 CE LYS Y 111 -2.578 19.741 -19.405 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -2.036 18.353 -19.368 1.00 0.00 N ATOM 0 H LYS Y 111 -6.155 22.218 -18.414 1.00 0.00 H new ATOM 0 HA LYS Y 111 -5.363 23.682 -16.046 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -3.694 21.961 -15.869 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -5.084 21.167 -16.583 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -3.958 21.932 -18.891 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -2.502 22.035 -17.922 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -2.727 19.673 -17.247 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -4.270 19.549 -18.069 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -3.265 19.851 -20.244 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -1.768 20.454 -19.560 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -1.001 18.382 -19.462 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -2.289 17.905 -18.464 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -2.439 17.802 -20.152 1.00 0.00 H new ATOM 3657 N THR Y 112 -3.789 24.242 -18.878 1.00 0.00 N ATOM 3658 CA THR Y 112 -2.790 25.136 -19.537 1.00 0.00 C ATOM 3659 C THR Y 112 -3.145 26.593 -19.237 1.00 0.00 C ATOM 3660 O THR Y 112 -2.285 27.417 -19.000 1.00 0.00 O ATOM 3661 CB THR Y 112 -2.807 24.906 -21.055 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -2.530 23.540 -21.332 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.739 25.773 -21.716 1.00 0.00 C ATOM 0 H THR Y 112 -4.311 23.639 -19.514 1.00 0.00 H new ATOM 0 HA THR Y 112 -1.794 24.913 -19.153 1.00 0.00 H new ATOM 0 HB THR Y 112 -3.790 25.170 -21.446 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -2.686 23.361 -22.283 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.752 25.609 -22.793 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -1.942 26.823 -21.507 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -0.759 25.507 -21.321 1.00 0.00 H new ATOM 3671 N GLU Y 113 -4.409 26.917 -19.254 1.00 0.00 N ATOM 3672 CA GLU Y 113 -4.836 28.319 -18.979 1.00 0.00 C ATOM 3673 CB GLU Y 113 -4.239 28.817 -17.642 1.00 0.00 C ATOM 3674 CG GLU Y 113 -4.051 27.640 -16.658 1.00 0.00 C ATOM 3675 CD GLU Y 113 -4.233 28.129 -15.215 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -3.822 29.243 -14.933 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -4.776 27.381 -14.419 1.00 0.00 O ATOM 0 H GLU Y 113 -5.170 26.266 -19.448 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -3.280 29.302 -17.824 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -4.897 29.566 -17.200 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -4.772 26.853 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -3.058 27.207 -16.782 1.00 0.00 H new