USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1666 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 55 SER OG : rot 130:sc= 1.14 USER MOD Set 1.2: B 85 LYS NZ :NH3+ -122:sc= 1.15 (180deg=-0.336) USER MOD Set 2.1: A 7 THR OG1 : rot -130:sc= 0 USER MOD Set 2.2: B 44 GLN : amide:sc= 0.855 K(o=1.7,f=-3.4) USER MOD Set 2.3: B 45 GLN : amide:sc= 0.808 K(o=1.7,f=-3.4!) USER MOD Set 3.1: B 36 ASN : amide:sc= 0.979 K(o=3.3,f=-10!) USER MOD Set 3.2: B 39 LYS NZ :NH3+ -148:sc= 2.27 (180deg=-0.24) USER MOD Set 4.1: A 61 LYS NZ :NH3+ -147:sc= 2.23 (180deg=-0.771!) USER MOD Set 4.2: A 62 SER OG : rot -170:sc= 0.84 USER MOD Set 5.1: A 55 SER OG : rot -80:sc= 1.45 USER MOD Set 5.2: A 85 LYS NZ :NH3+ -174:sc= 1.48 (180deg=0.134) USER MOD Set 6.1: A 44 GLN : amide:sc= 0.699 K(o=2.5,f=-4.2) USER MOD Set 6.2: A 45 GLN : amide:sc= 1.8 K(o=2.5,f=-4.2!) USER MOD Set 7.1: A 39 LYS NZ :NH3+ 153:sc= 1.02 (180deg=0.271) USER MOD Set 7.2: A 43 THR OG1 : rot -170:sc= 0.952 USER MOD Set 8.1: A 1 MET N :NH3+ 159:sc= 2.31 (180deg=2.1) USER MOD Set 8.2: A 15 THR OG1 : rot 86:sc= 1.16 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc=-0.00272 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 71:sc= 1.11 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0912 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 179:sc= 1.13 (180deg=1.11) USER MOD Single : A 32 SER OG : rot -61:sc= 1.32 USER MOD Single : A 34 SER OG : rot 70:sc= 1.19 USER MOD Single : A 36 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.26) USER MOD Single : A 48 HIS : no HE2:sc= -2.63 K(o=-2.6,f=-11!) USER MOD Single : A 51 LYS NZ :NH3+ -138:sc= 1.2 (180deg=0.893) USER MOD Single : A 59 LYS NZ :NH3+ 178:sc= -2.04! (180deg=-2.09!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.138 X(o=-0.14,f=-0.078) USER MOD Single : A 67 GLN : amide:sc= -1.4! C(o=-1.4!,f=-1.5!) USER MOD Single : A 69 SER OG : rot -21:sc= 0.285 USER MOD Single : A 72 LYS NZ :NH3+ 172:sc= 0.958 (180deg=-0.0265) USER MOD Single : A 74 ASN : amide:sc= -0.41 X(o=-0.41,f=-0.064) USER MOD Single : A 76 TYR OH : rot 172:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 179:sc= -0.795 (180deg=-0.797) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -157:sc= 1.22 (180deg=-1.06!) USER MOD Single : A 94 LYS NZ :NH3+ 162:sc= 2.04 (180deg=1.45) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 130:sc= 1.01 (180deg=-1.14!) USER MOD Single : B 1 MET CE :methyl 178:sc= -0.0857 (180deg=-0.104) USER MOD Single : B 1 MET N :NH3+ 173:sc= 1.95 (180deg=1.75) USER MOD Single : B 7 THR OG1 : rot 124:sc= 1.25 USER MOD Single : B 12 SER OG : rot -98:sc= 0.838 USER MOD Single : B 15 THR OG1 : rot 77:sc= 1.23 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 79:sc= 0.948 USER MOD Single : B 22 THR OG1 : rot -43:sc= 1.2 USER MOD Single : B 26 GLN : amide:sc= 0.26 X(o=0.26,f=-0.00073) USER MOD Single : B 30 LYS NZ :NH3+ 170:sc= 1.07 (180deg=0.678) USER MOD Single : B 32 SER OG : rot 85:sc= 1.41 USER MOD Single : B 34 SER OG : rot 73:sc= 1.22 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 HIS : no HD1:sc= -0.995 K(o=-0.99,f=-4!) USER MOD Single : B 51 LYS NZ :NH3+ 173:sc= 1.21 (180deg=1.2) USER MOD Single : B 59 LYS NZ :NH3+ -158:sc= -0.0811 (180deg=-2.33!) USER MOD Single : B 60 MET CE :methyl 179:sc= -0.253 (180deg=-0.257) USER MOD Single : B 61 LYS NZ :NH3+ -113:sc= 1.99 (180deg=-3.65!) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.303 K(o=-0.3,f=-1.6) USER MOD Single : B 67 GLN : amide:sc= -0.356 K(o=-0.36,f=-3.1!) USER MOD Single : B 69 SER OG : rot 91:sc= 1.18 USER MOD Single : B 72 LYS NZ :NH3+ 148:sc= 1.03 (180deg=-0.242!) USER MOD Single : B 74 ASN : amide:sc= 0.763 K(o=0.76,f=-7!) USER MOD Single : B 76 TYR OH : rot 165:sc=-0.00971 USER MOD Single : B 89 LYS NZ :NH3+ -119:sc= 0.848 (180deg=-2.46!) USER MOD Single : B 90 LYS NZ :NH3+ 158:sc= 1.19 (180deg=0.882) USER MOD Single : B 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 LYS NZ :NH3+ 159:sc= 2.14 (180deg=1.48) USER MOD Single : B 97 LYS NZ :NH3+ 177:sc= 1.06 (180deg=0.991) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.793 -12.169 6.040 1.00 11.02 N ATOM 2 CA MET A 1 -4.105 -13.107 7.135 1.00 9.59 C ATOM 3 C MET A 1 -5.587 -12.976 7.530 1.00 7.65 C ATOM 4 O MET A 1 -5.914 -12.818 8.709 1.00 6.57 O ATOM 5 CB MET A 1 -3.177 -12.835 8.335 1.00 10.23 C ATOM 6 CG MET A 1 -3.263 -13.899 9.443 1.00 9.96 C ATOM 7 SD MET A 1 -3.144 -13.229 11.125 1.00 10.46 S ATOM 8 CE MET A 1 -3.385 -14.744 12.079 1.00 10.03 C ATOM 0 H1 MET A 1 -2.768 -11.995 6.014 1.00 11.02 H new ATOM 0 H2 MET A 1 -4.098 -12.579 5.134 1.00 11.02 H new ATOM 0 H3 MET A 1 -4.293 -11.271 6.199 1.00 11.02 H new ATOM 0 HA MET A 1 -3.935 -14.130 6.801 1.00 9.59 H new ATOM 0 HB2 MET A 1 -2.148 -12.776 7.980 1.00 10.23 H new ATOM 0 HB3 MET A 1 -3.424 -11.862 8.759 1.00 10.23 H new ATOM 0 HG2 MET A 1 -4.206 -14.436 9.343 1.00 9.96 H new ATOM 0 HG3 MET A 1 -2.465 -14.626 9.296 1.00 9.96 H new ATOM 0 HE1 MET A 1 -3.341 -14.514 13.144 1.00 10.03 H new ATOM 0 HE2 MET A 1 -4.358 -15.174 11.840 1.00 10.03 H new ATOM 0 HE3 MET A 1 -2.601 -15.459 11.830 1.00 10.03 H new ATOM 20 N ALA A 2 -6.504 -13.036 6.568 1.00 7.39 N ATOM 21 CA ALA A 2 -7.854 -12.538 6.784 1.00 5.96 C ATOM 22 C ALA A 2 -8.744 -13.555 7.499 1.00 4.94 C ATOM 23 O ALA A 2 -8.459 -14.751 7.505 1.00 5.00 O ATOM 24 CB ALA A 2 -8.452 -12.180 5.431 1.00 6.24 C ATOM 0 H ALA A 2 -6.336 -13.422 5.639 1.00 7.39 H new ATOM 0 HA ALA A 2 -7.800 -11.662 7.430 1.00 5.96 H new ATOM 0 HB1 ALA A 2 -9.466 -11.804 5.569 1.00 6.24 H new ATOM 0 HB2 ALA A 2 -7.842 -11.412 4.955 1.00 6.24 H new ATOM 0 HB3 ALA A 2 -8.477 -13.067 4.798 1.00 6.24 H new ATOM 30 N ALA A 3 -9.841 -13.069 8.090 1.00 4.34 N ATOM 31 CA ALA A 3 -10.935 -13.909 8.560 1.00 3.76 C ATOM 32 C ALA A 3 -12.235 -13.101 8.556 1.00 3.02 C ATOM 33 O ALA A 3 -12.973 -13.070 9.537 1.00 3.35 O ATOM 34 CB ALA A 3 -10.607 -14.439 9.962 1.00 4.80 C ATOM 0 H ALA A 3 -9.990 -12.073 8.254 1.00 4.34 H new ATOM 0 HA ALA A 3 -11.065 -14.764 7.897 1.00 3.76 H new ATOM 0 HB1 ALA A 3 -11.425 -15.067 10.314 1.00 4.80 H new ATOM 0 HB2 ALA A 3 -9.689 -15.026 9.924 1.00 4.80 H new ATOM 0 HB3 ALA A 3 -10.473 -13.601 10.646 1.00 4.80 H new ATOM 40 N GLU A 4 -12.556 -12.533 7.392 1.00 2.28 N ATOM 41 CA GLU A 4 -13.817 -11.870 7.092 1.00 1.51 C ATOM 42 C GLU A 4 -14.074 -12.083 5.596 1.00 1.34 C ATOM 43 O GLU A 4 -13.157 -12.540 4.909 1.00 1.56 O ATOM 44 CB GLU A 4 -13.737 -10.390 7.513 1.00 1.28 C ATOM 45 CG GLU A 4 -12.954 -9.470 6.569 1.00 2.38 C ATOM 46 CD GLU A 4 -13.264 -7.999 6.830 1.00 4.02 C ATOM 47 OE1 GLU A 4 -14.458 -7.658 6.698 1.00 5.06 O ATOM 48 OE2 GLU A 4 -12.312 -7.251 7.144 1.00 4.76 O ATOM 0 H GLU A 4 -11.912 -12.525 6.601 1.00 2.28 H new ATOM 0 HA GLU A 4 -14.659 -12.281 7.649 1.00 1.51 H new ATOM 0 HB2 GLU A 4 -14.752 -10.003 7.608 1.00 1.28 H new ATOM 0 HB3 GLU A 4 -13.282 -10.337 8.502 1.00 1.28 H new ATOM 0 HG2 GLU A 4 -11.885 -9.645 6.694 1.00 2.38 H new ATOM 0 HG3 GLU A 4 -13.198 -9.716 5.536 1.00 2.38 H new ATOM 55 N PRO A 5 -15.261 -11.769 5.049 1.00 1.19 N ATOM 56 CA PRO A 5 -15.567 -12.047 3.652 1.00 1.26 C ATOM 57 C PRO A 5 -14.975 -10.964 2.735 1.00 1.37 C ATOM 58 O PRO A 5 -15.658 -10.450 1.851 1.00 1.68 O ATOM 59 CB PRO A 5 -17.097 -12.110 3.610 1.00 1.52 C ATOM 60 CG PRO A 5 -17.506 -11.069 4.653 1.00 1.55 C ATOM 61 CD PRO A 5 -16.407 -11.169 5.715 1.00 1.27 C ATOM 0 HA PRO A 5 -15.128 -12.976 3.288 1.00 1.26 H new ATOM 0 HB2 PRO A 5 -17.485 -11.866 2.621 1.00 1.52 H new ATOM 0 HB3 PRO A 5 -17.468 -13.103 3.862 1.00 1.52 H new ATOM 0 HG2 PRO A 5 -17.557 -10.069 4.222 1.00 1.55 H new ATOM 0 HG3 PRO A 5 -18.489 -11.286 5.072 1.00 1.55 H new ATOM 0 HD2 PRO A 5 -16.157 -10.185 6.112 1.00 1.27 H new ATOM 0 HD3 PRO A 5 -16.733 -11.779 6.557 1.00 1.27 H new ATOM 69 N LEU A 6 -13.702 -10.618 2.947 1.00 1.44 N ATOM 70 CA LEU A 6 -12.973 -9.639 2.155 1.00 1.75 C ATOM 71 C LEU A 6 -12.364 -10.266 0.893 1.00 1.52 C ATOM 72 O LEU A 6 -12.495 -11.468 0.663 1.00 1.55 O ATOM 73 CB LEU A 6 -11.948 -8.904 3.031 1.00 2.17 C ATOM 74 CG LEU A 6 -10.889 -9.771 3.745 1.00 2.10 C ATOM 75 CD1 LEU A 6 -10.000 -10.544 2.765 1.00 2.61 C ATOM 76 CD2 LEU A 6 -10.000 -8.882 4.627 1.00 3.21 C ATOM 0 H LEU A 6 -13.141 -11.025 3.695 1.00 1.44 H new ATOM 0 HA LEU A 6 -13.674 -8.888 1.790 1.00 1.75 H new ATOM 0 HB2 LEU A 6 -11.427 -8.178 2.407 1.00 2.17 H new ATOM 0 HB3 LEU A 6 -12.492 -8.340 3.789 1.00 2.17 H new ATOM 0 HG LEU A 6 -11.430 -10.499 4.349 1.00 2.10 H new ATOM 0 HD11 LEU A 6 -9.274 -11.136 3.322 1.00 2.61 H new ATOM 0 HD12 LEU A 6 -10.618 -11.205 2.157 1.00 2.61 H new ATOM 0 HD13 LEU A 6 -9.475 -9.841 2.118 1.00 2.61 H new ATOM 0 HD21 LEU A 6 -9.254 -9.498 5.129 1.00 3.21 H new ATOM 0 HD22 LEU A 6 -9.499 -8.139 4.007 1.00 3.21 H new ATOM 0 HD23 LEU A 6 -10.615 -8.378 5.372 1.00 3.21 H new ATOM 88 N THR A 7 -11.718 -9.443 0.062 1.00 1.44 N ATOM 89 CA THR A 7 -11.007 -9.859 -1.146 1.00 1.18 C ATOM 90 C THR A 7 -9.511 -9.535 -1.010 1.00 0.94 C ATOM 91 O THR A 7 -9.142 -8.695 -0.189 1.00 1.03 O ATOM 92 CB THR A 7 -11.609 -9.086 -2.327 1.00 1.44 C ATOM 93 OG1 THR A 7 -13.021 -9.042 -2.247 1.00 1.86 O ATOM 94 CG2 THR A 7 -11.228 -9.692 -3.679 1.00 1.72 C ATOM 0 H THR A 7 -11.675 -8.436 0.219 1.00 1.44 H new ATOM 0 HA THR A 7 -11.109 -10.933 -1.302 1.00 1.18 H new ATOM 0 HB THR A 7 -11.196 -8.080 -2.260 1.00 1.44 H new ATOM 0 HG1 THR A 7 -13.406 -9.317 -3.105 1.00 1.86 H new ATOM 0 HG21 THR A 7 -11.680 -9.107 -4.480 1.00 1.72 H new ATOM 0 HG22 THR A 7 -10.144 -9.682 -3.790 1.00 1.72 H new ATOM 0 HG23 THR A 7 -11.589 -10.719 -3.732 1.00 1.72 H new ATOM 102 N GLU A 8 -8.664 -10.140 -1.854 1.00 0.82 N ATOM 103 CA GLU A 8 -7.212 -9.960 -1.914 1.00 0.78 C ATOM 104 C GLU A 8 -6.780 -8.505 -1.699 1.00 0.75 C ATOM 105 O GLU A 8 -5.843 -8.239 -0.950 1.00 0.75 O ATOM 106 CB GLU A 8 -6.653 -10.455 -3.265 1.00 0.93 C ATOM 107 CG GLU A 8 -7.000 -11.914 -3.597 1.00 1.07 C ATOM 108 CD GLU A 8 -8.335 -12.040 -4.317 1.00 1.58 C ATOM 109 OE1 GLU A 8 -9.351 -12.091 -3.590 1.00 2.55 O ATOM 110 OE2 GLU A 8 -8.321 -12.022 -5.565 1.00 2.22 O ATOM 0 H GLU A 8 -8.996 -10.806 -2.552 1.00 0.82 H new ATOM 0 HA GLU A 8 -6.803 -10.555 -1.097 1.00 0.78 H new ATOM 0 HB2 GLU A 8 -7.034 -9.813 -4.059 1.00 0.93 H new ATOM 0 HB3 GLU A 8 -5.569 -10.344 -3.259 1.00 0.93 H new ATOM 0 HG2 GLU A 8 -6.213 -12.340 -4.219 1.00 1.07 H new ATOM 0 HG3 GLU A 8 -7.030 -12.497 -2.676 1.00 1.07 H new ATOM 117 N LEU A 9 -7.462 -7.562 -2.363 1.00 0.81 N ATOM 118 CA LEU A 9 -7.134 -6.147 -2.276 1.00 0.85 C ATOM 119 C LEU A 9 -7.156 -5.733 -0.803 1.00 0.86 C ATOM 120 O LEU A 9 -6.148 -5.276 -0.266 1.00 0.88 O ATOM 121 CB LEU A 9 -8.120 -5.299 -3.100 1.00 0.91 C ATOM 122 CG LEU A 9 -8.153 -5.523 -4.624 1.00 0.98 C ATOM 123 CD1 LEU A 9 -6.805 -5.238 -5.295 1.00 1.77 C ATOM 124 CD2 LEU A 9 -8.669 -6.907 -5.039 1.00 1.95 C ATOM 0 H LEU A 9 -8.254 -7.766 -2.973 1.00 0.81 H new ATOM 0 HA LEU A 9 -6.141 -5.976 -2.691 1.00 0.85 H new ATOM 0 HB2 LEU A 9 -9.123 -5.478 -2.712 1.00 0.91 H new ATOM 0 HB3 LEU A 9 -7.892 -4.249 -2.920 1.00 0.91 H new ATOM 0 HG LEU A 9 -8.877 -4.792 -4.984 1.00 0.98 H new ATOM 0 HD11 LEU A 9 -6.888 -5.413 -6.368 1.00 1.77 H new ATOM 0 HD12 LEU A 9 -6.522 -4.200 -5.117 1.00 1.77 H new ATOM 0 HD13 LEU A 9 -6.044 -5.898 -4.878 1.00 1.77 H new ATOM 0 HD21 LEU A 9 -8.662 -6.987 -6.126 1.00 1.95 H new ATOM 0 HD22 LEU A 9 -8.026 -7.678 -4.614 1.00 1.95 H new ATOM 0 HD23 LEU A 9 -9.687 -7.041 -4.672 1.00 1.95 H new ATOM 136 N GLU A 10 -8.304 -5.937 -0.148 1.00 0.88 N ATOM 137 CA GLU A 10 -8.410 -5.755 1.297 1.00 0.89 C ATOM 138 C GLU A 10 -7.359 -6.593 2.036 1.00 0.84 C ATOM 139 O GLU A 10 -6.682 -6.072 2.914 1.00 0.80 O ATOM 140 CB GLU A 10 -9.817 -6.071 1.817 1.00 1.02 C ATOM 141 CG GLU A 10 -10.411 -4.970 2.713 1.00 1.62 C ATOM 142 CD GLU A 10 -9.579 -4.625 3.942 1.00 2.30 C ATOM 143 OE1 GLU A 10 -9.031 -5.558 4.553 1.00 2.90 O ATOM 144 OE2 GLU A 10 -9.520 -3.415 4.265 1.00 3.45 O ATOM 0 H GLU A 10 -9.171 -6.228 -0.599 1.00 0.88 H new ATOM 0 HA GLU A 10 -8.218 -4.701 1.499 1.00 0.89 H new ATOM 0 HB2 GLU A 10 -10.480 -6.232 0.967 1.00 1.02 H new ATOM 0 HB3 GLU A 10 -9.785 -7.005 2.378 1.00 1.02 H new ATOM 0 HG2 GLU A 10 -10.542 -4.067 2.116 1.00 1.62 H new ATOM 0 HG3 GLU A 10 -11.403 -5.283 3.040 1.00 1.62 H new ATOM 151 N GLU A 11 -7.175 -7.873 1.695 1.00 0.86 N ATOM 152 CA GLU A 11 -6.216 -8.678 2.454 1.00 0.80 C ATOM 153 C GLU A 11 -4.813 -8.044 2.482 1.00 0.71 C ATOM 154 O GLU A 11 -4.119 -8.112 3.501 1.00 0.75 O ATOM 155 CB GLU A 11 -6.200 -10.152 2.029 1.00 0.87 C ATOM 156 CG GLU A 11 -5.414 -10.969 3.075 1.00 0.99 C ATOM 157 CD GLU A 11 -5.758 -12.450 3.105 1.00 2.20 C ATOM 158 OE1 GLU A 11 -6.404 -12.934 2.155 1.00 2.99 O ATOM 159 OE2 GLU A 11 -5.371 -13.066 4.127 1.00 3.20 O ATOM 0 H GLU A 11 -7.653 -8.356 0.934 1.00 0.86 H new ATOM 0 HA GLU A 11 -6.570 -8.679 3.485 1.00 0.80 H new ATOM 0 HB2 GLU A 11 -7.219 -10.530 1.944 1.00 0.87 H new ATOM 0 HB3 GLU A 11 -5.739 -10.255 1.047 1.00 0.87 H new ATOM 0 HG2 GLU A 11 -4.348 -10.860 2.876 1.00 0.99 H new ATOM 0 HG3 GLU A 11 -5.599 -10.546 4.062 1.00 0.99 H new ATOM 166 N SER A 12 -4.397 -7.361 1.410 1.00 0.67 N ATOM 167 CA SER A 12 -3.145 -6.619 1.456 1.00 0.63 C ATOM 168 C SER A 12 -3.200 -5.561 2.561 1.00 0.62 C ATOM 169 O SER A 12 -2.248 -5.392 3.325 1.00 0.74 O ATOM 170 CB SER A 12 -2.869 -5.949 0.110 1.00 0.73 C ATOM 171 OG SER A 12 -2.886 -6.906 -0.928 1.00 1.51 O ATOM 0 H SER A 12 -4.898 -7.310 0.523 1.00 0.67 H new ATOM 0 HA SER A 12 -2.337 -7.319 1.671 1.00 0.63 H new ATOM 0 HB2 SER A 12 -3.619 -5.181 -0.082 1.00 0.73 H new ATOM 0 HB3 SER A 12 -1.901 -5.449 0.137 1.00 0.73 H new ATOM 0 HG SER A 12 -2.710 -6.463 -1.784 1.00 1.51 H new ATOM 177 N ILE A 13 -4.319 -4.836 2.621 1.00 0.56 N ATOM 178 CA ILE A 13 -4.545 -3.746 3.551 1.00 0.59 C ATOM 179 C ILE A 13 -4.560 -4.254 4.984 1.00 0.69 C ATOM 180 O ILE A 13 -3.816 -3.719 5.805 1.00 0.75 O ATOM 181 CB ILE A 13 -5.857 -3.023 3.206 1.00 0.60 C ATOM 182 CG1 ILE A 13 -5.696 -2.203 1.926 1.00 0.73 C ATOM 183 CG2 ILE A 13 -6.371 -2.074 4.294 1.00 0.84 C ATOM 184 CD1 ILE A 13 -6.992 -2.203 1.131 1.00 0.58 C ATOM 0 H ILE A 13 -5.112 -5.002 2.002 1.00 0.56 H new ATOM 0 HA ILE A 13 -3.725 -3.033 3.462 1.00 0.59 H new ATOM 0 HB ILE A 13 -6.586 -3.825 3.092 1.00 0.60 H new ATOM 0 HG12 ILE A 13 -5.414 -1.180 2.175 1.00 0.73 H new ATOM 0 HG13 ILE A 13 -4.890 -2.617 1.320 1.00 0.73 H new ATOM 0 HG21 ILE A 13 -7.300 -1.610 3.963 1.00 0.84 H new ATOM 0 HG22 ILE A 13 -6.553 -2.636 5.210 1.00 0.84 H new ATOM 0 HG23 ILE A 13 -5.626 -1.301 4.484 1.00 0.84 H new ATOM 0 HD11 ILE A 13 -6.862 -1.615 0.222 1.00 0.58 H new ATOM 0 HD12 ILE A 13 -7.256 -3.227 0.866 1.00 0.58 H new ATOM 0 HD13 ILE A 13 -7.789 -1.767 1.734 1.00 0.58 H new ATOM 196 N GLU A 14 -5.410 -5.245 5.289 1.00 0.75 N ATOM 197 CA GLU A 14 -5.533 -5.782 6.639 1.00 0.91 C ATOM 198 C GLU A 14 -4.139 -6.155 7.152 1.00 0.95 C ATOM 199 O GLU A 14 -3.727 -5.750 8.242 1.00 1.02 O ATOM 200 CB GLU A 14 -6.590 -6.901 6.706 1.00 1.03 C ATOM 201 CG GLU A 14 -6.122 -8.308 6.335 1.00 1.39 C ATOM 202 CD GLU A 14 -5.388 -9.034 7.458 1.00 2.39 C ATOM 203 OE1 GLU A 14 -5.263 -8.462 8.561 1.00 2.63 O ATOM 204 OE2 GLU A 14 -4.983 -10.186 7.204 1.00 3.60 O ATOM 0 H GLU A 14 -6.025 -5.690 4.607 1.00 0.75 H new ATOM 0 HA GLU A 14 -5.920 -5.028 7.325 1.00 0.91 H new ATOM 0 HB2 GLU A 14 -6.990 -6.931 7.719 1.00 1.03 H new ATOM 0 HB3 GLU A 14 -7.414 -6.631 6.046 1.00 1.03 H new ATOM 0 HG2 GLU A 14 -6.987 -8.901 6.037 1.00 1.39 H new ATOM 0 HG3 GLU A 14 -5.465 -8.244 5.467 1.00 1.39 H new ATOM 211 N THR A 15 -3.376 -6.825 6.284 1.00 0.91 N ATOM 212 CA THR A 15 -1.997 -7.183 6.550 1.00 0.96 C ATOM 213 C THR A 15 -1.189 -5.922 6.888 1.00 1.00 C ATOM 214 O THR A 15 -0.678 -5.840 8.000 1.00 1.27 O ATOM 215 CB THR A 15 -1.428 -8.044 5.412 1.00 0.98 C ATOM 216 OG1 THR A 15 -2.255 -9.181 5.227 1.00 1.06 O ATOM 217 CG2 THR A 15 -0.009 -8.529 5.727 1.00 1.11 C ATOM 0 H THR A 15 -3.710 -7.133 5.371 1.00 0.91 H new ATOM 0 HA THR A 15 -1.928 -7.819 7.432 1.00 0.96 H new ATOM 0 HB THR A 15 -1.398 -7.429 4.513 1.00 0.98 H new ATOM 0 HG1 THR A 15 -2.990 -8.956 4.619 1.00 1.06 H new ATOM 0 HG21 THR A 15 0.361 -9.135 4.900 1.00 1.11 H new ATOM 0 HG22 THR A 15 0.646 -7.670 5.868 1.00 1.11 H new ATOM 0 HG23 THR A 15 -0.023 -9.128 6.637 1.00 1.11 H new ATOM 225 N VAL A 16 -1.116 -4.901 6.019 1.00 0.82 N ATOM 226 CA VAL A 16 -0.390 -3.677 6.348 1.00 0.86 C ATOM 227 C VAL A 16 -0.791 -3.149 7.730 1.00 0.94 C ATOM 228 O VAL A 16 0.061 -2.950 8.598 1.00 1.03 O ATOM 229 CB VAL A 16 -0.611 -2.587 5.284 1.00 0.81 C ATOM 230 CG1 VAL A 16 -0.007 -1.275 5.779 1.00 0.85 C ATOM 231 CG2 VAL A 16 0.047 -2.922 3.946 1.00 0.79 C ATOM 0 H VAL A 16 -1.548 -4.903 5.095 1.00 0.82 H new ATOM 0 HA VAL A 16 0.670 -3.929 6.366 1.00 0.86 H new ATOM 0 HB VAL A 16 -1.687 -2.511 5.129 1.00 0.81 H new ATOM 0 HG11 VAL A 16 -0.160 -0.498 5.030 1.00 0.85 H new ATOM 0 HG12 VAL A 16 -0.490 -0.981 6.711 1.00 0.85 H new ATOM 0 HG13 VAL A 16 1.061 -1.408 5.951 1.00 0.85 H new ATOM 0 HG21 VAL A 16 -0.143 -2.117 3.236 1.00 0.79 H new ATOM 0 HG22 VAL A 16 1.122 -3.035 4.087 1.00 0.79 H new ATOM 0 HG23 VAL A 16 -0.368 -3.853 3.559 1.00 0.79 H new ATOM 241 N VAL A 17 -2.086 -2.875 7.925 1.00 0.92 N ATOM 242 CA VAL A 17 -2.536 -2.224 9.146 1.00 1.04 C ATOM 243 C VAL A 17 -2.204 -3.071 10.381 1.00 1.14 C ATOM 244 O VAL A 17 -1.871 -2.505 11.424 1.00 1.31 O ATOM 245 CB VAL A 17 -4.005 -1.772 9.083 1.00 1.05 C ATOM 246 CG1 VAL A 17 -4.242 -0.751 7.962 1.00 1.03 C ATOM 247 CG2 VAL A 17 -4.979 -2.929 8.922 1.00 1.03 C ATOM 0 H VAL A 17 -2.827 -3.093 7.259 1.00 0.92 H new ATOM 0 HA VAL A 17 -1.972 -1.297 9.245 1.00 1.04 H new ATOM 0 HB VAL A 17 -4.199 -1.300 10.046 1.00 1.05 H new ATOM 0 HG11 VAL A 17 -5.292 -0.458 7.952 1.00 1.03 H new ATOM 0 HG12 VAL A 17 -3.622 0.129 8.134 1.00 1.03 H new ATOM 0 HG13 VAL A 17 -3.981 -1.197 7.002 1.00 1.03 H new ATOM 0 HG21 VAL A 17 -5.998 -2.544 8.884 1.00 1.03 H new ATOM 0 HG22 VAL A 17 -4.759 -3.464 7.998 1.00 1.03 H new ATOM 0 HG23 VAL A 17 -4.879 -3.609 9.768 1.00 1.03 H new ATOM 257 N THR A 18 -2.266 -4.404 10.276 1.00 1.10 N ATOM 258 CA THR A 18 -1.883 -5.280 11.375 1.00 1.32 C ATOM 259 C THR A 18 -0.363 -5.261 11.587 1.00 1.34 C ATOM 260 O THR A 18 0.092 -5.192 12.730 1.00 1.45 O ATOM 261 CB THR A 18 -2.485 -6.698 11.209 1.00 1.42 C ATOM 262 OG1 THR A 18 -2.959 -7.158 12.460 1.00 1.75 O ATOM 263 CG2 THR A 18 -1.519 -7.761 10.672 1.00 1.34 C ATOM 0 H THR A 18 -2.579 -4.894 9.438 1.00 1.10 H new ATOM 0 HA THR A 18 -2.316 -4.895 12.299 1.00 1.32 H new ATOM 0 HB THR A 18 -3.275 -6.579 10.468 1.00 1.42 H new ATOM 0 HG1 THR A 18 -3.342 -8.054 12.355 1.00 1.75 H new ATOM 0 HG21 THR A 18 -2.037 -8.717 10.593 1.00 1.34 H new ATOM 0 HG22 THR A 18 -1.158 -7.461 9.688 1.00 1.34 H new ATOM 0 HG23 THR A 18 -0.674 -7.862 11.353 1.00 1.34 H new ATOM 271 N THR A 19 0.435 -5.305 10.511 1.00 1.26 N ATOM 272 CA THR A 19 1.877 -5.508 10.589 1.00 1.36 C ATOM 273 C THR A 19 2.541 -4.482 11.507 1.00 1.32 C ATOM 274 O THR A 19 3.376 -4.862 12.327 1.00 1.58 O ATOM 275 CB THR A 19 2.487 -5.531 9.181 1.00 1.31 C ATOM 276 OG1 THR A 19 1.961 -6.624 8.460 1.00 1.79 O ATOM 277 CG2 THR A 19 4.011 -5.682 9.200 1.00 1.52 C ATOM 0 H THR A 19 0.089 -5.199 9.557 1.00 1.26 H new ATOM 0 HA THR A 19 2.069 -6.481 11.042 1.00 1.36 H new ATOM 0 HB THR A 19 2.237 -4.578 8.716 1.00 1.31 H new ATOM 0 HG1 THR A 19 1.021 -6.452 8.244 1.00 1.79 H new ATOM 0 HG21 THR A 19 4.388 -5.692 8.177 1.00 1.52 H new ATOM 0 HG22 THR A 19 4.453 -4.846 9.741 1.00 1.52 H new ATOM 0 HG23 THR A 19 4.278 -6.616 9.695 1.00 1.52 H new ATOM 285 N PHE A 20 2.143 -3.204 11.429 1.00 1.09 N ATOM 286 CA PHE A 20 2.636 -2.170 12.341 1.00 1.06 C ATOM 287 C PHE A 20 2.663 -2.644 13.796 1.00 1.15 C ATOM 288 O PHE A 20 3.581 -2.305 14.540 1.00 1.20 O ATOM 289 CB PHE A 20 1.762 -0.915 12.279 1.00 1.05 C ATOM 290 CG PHE A 20 1.776 -0.188 10.955 1.00 1.02 C ATOM 291 CD1 PHE A 20 2.895 0.579 10.581 1.00 1.50 C ATOM 292 CD2 PHE A 20 0.628 -0.192 10.148 1.00 1.97 C ATOM 293 CE1 PHE A 20 2.858 1.345 9.405 1.00 1.40 C ATOM 294 CE2 PHE A 20 0.583 0.586 8.981 1.00 2.14 C ATOM 295 CZ PHE A 20 1.698 1.357 8.614 1.00 1.20 C ATOM 0 H PHE A 20 1.476 -2.863 10.737 1.00 1.09 H new ATOM 0 HA PHE A 20 3.651 -1.947 12.013 1.00 1.06 H new ATOM 0 HB2 PHE A 20 0.734 -1.195 12.511 1.00 1.05 H new ATOM 0 HB3 PHE A 20 2.088 -0.225 13.058 1.00 1.05 H new ATOM 0 HD1 PHE A 20 3.781 0.578 11.198 1.00 1.50 H new ATOM 0 HD2 PHE A 20 -0.223 -0.796 10.426 1.00 1.97 H new ATOM 0 HE1 PHE A 20 3.720 1.924 9.109 1.00 1.40 H new ATOM 0 HE2 PHE A 20 -0.306 0.592 8.367 1.00 2.14 H new ATOM 0 HZ PHE A 20 1.663 1.962 7.720 1.00 1.20 H new ATOM 305 N PHE A 21 1.633 -3.391 14.212 1.00 1.23 N ATOM 306 CA PHE A 21 1.500 -3.864 15.580 1.00 1.39 C ATOM 307 C PHE A 21 2.716 -4.688 15.995 1.00 1.54 C ATOM 308 O PHE A 21 3.182 -4.572 17.126 1.00 1.93 O ATOM 309 CB PHE A 21 0.186 -4.637 15.767 1.00 1.35 C ATOM 310 CG PHE A 21 -0.349 -4.620 17.191 1.00 1.67 C ATOM 311 CD1 PHE A 21 0.285 -5.372 18.199 1.00 2.21 C ATOM 312 CD2 PHE A 21 -1.534 -3.919 17.490 1.00 2.97 C ATOM 313 CE1 PHE A 21 -0.280 -5.450 19.485 1.00 2.64 C ATOM 314 CE2 PHE A 21 -2.117 -4.028 18.765 1.00 3.54 C ATOM 315 CZ PHE A 21 -1.497 -4.805 19.759 1.00 2.93 C ATOM 0 H PHE A 21 0.870 -3.681 13.601 1.00 1.23 H new ATOM 0 HA PHE A 21 1.461 -2.998 16.241 1.00 1.39 H new ATOM 0 HB2 PHE A 21 -0.568 -4.216 15.102 1.00 1.35 H new ATOM 0 HB3 PHE A 21 0.339 -5.672 15.460 1.00 1.35 H new ATOM 0 HD1 PHE A 21 1.208 -5.890 17.984 1.00 2.21 H new ATOM 0 HD2 PHE A 21 -1.996 -3.296 16.738 1.00 2.97 H new ATOM 0 HE1 PHE A 21 0.223 -6.006 20.262 1.00 2.64 H new ATOM 0 HE2 PHE A 21 -3.042 -3.514 18.981 1.00 3.54 H new ATOM 0 HZ PHE A 21 -1.956 -4.906 20.732 1.00 2.93 H new ATOM 325 N THR A 22 3.216 -5.518 15.076 1.00 1.41 N ATOM 326 CA THR A 22 4.315 -6.435 15.307 1.00 1.71 C ATOM 327 C THR A 22 5.288 -6.313 14.132 1.00 1.67 C ATOM 328 O THR A 22 5.416 -7.190 13.283 1.00 2.00 O ATOM 329 CB THR A 22 3.767 -7.843 15.596 1.00 2.37 C ATOM 330 OG1 THR A 22 4.829 -8.725 15.887 1.00 3.21 O ATOM 331 CG2 THR A 22 2.878 -8.422 14.486 1.00 2.37 C ATOM 0 H THR A 22 2.850 -5.565 14.125 1.00 1.41 H new ATOM 0 HA THR A 22 4.892 -6.190 16.199 1.00 1.71 H new ATOM 0 HB THR A 22 3.115 -7.736 16.463 1.00 2.37 H new ATOM 0 HG1 THR A 22 4.471 -9.618 16.071 1.00 3.21 H new ATOM 0 HG21 THR A 22 2.537 -9.416 14.775 1.00 2.37 H new ATOM 0 HG22 THR A 22 2.016 -7.772 14.334 1.00 2.37 H new ATOM 0 HG23 THR A 22 3.449 -8.489 13.560 1.00 2.37 H new ATOM 339 N PHE A 23 6.020 -5.198 14.117 1.00 2.03 N ATOM 340 CA PHE A 23 6.791 -4.779 12.954 1.00 2.47 C ATOM 341 C PHE A 23 8.099 -5.574 12.869 1.00 2.81 C ATOM 342 O PHE A 23 8.628 -5.778 11.780 1.00 3.91 O ATOM 343 CB PHE A 23 7.053 -3.270 13.095 1.00 3.03 C ATOM 344 CG PHE A 23 7.907 -2.646 12.009 1.00 3.84 C ATOM 345 CD1 PHE A 23 9.311 -2.686 12.112 1.00 4.39 C ATOM 346 CD2 PHE A 23 7.307 -1.986 10.922 1.00 5.02 C ATOM 347 CE1 PHE A 23 10.109 -2.121 11.103 1.00 5.65 C ATOM 348 CE2 PHE A 23 8.107 -1.387 9.932 1.00 6.36 C ATOM 349 CZ PHE A 23 9.508 -1.467 10.014 1.00 6.53 C ATOM 0 H PHE A 23 6.093 -4.563 14.912 1.00 2.03 H new ATOM 0 HA PHE A 23 6.244 -4.972 12.031 1.00 2.47 H new ATOM 0 HB2 PHE A 23 6.093 -2.754 13.118 1.00 3.03 H new ATOM 0 HB3 PHE A 23 7.534 -3.092 14.057 1.00 3.03 H new ATOM 0 HD1 PHE A 23 9.775 -3.152 12.969 1.00 4.39 H new ATOM 0 HD2 PHE A 23 6.231 -1.939 10.847 1.00 5.02 H new ATOM 0 HE1 PHE A 23 11.185 -2.189 11.164 1.00 5.65 H new ATOM 0 HE2 PHE A 23 7.644 -0.865 9.108 1.00 6.36 H new ATOM 0 HZ PHE A 23 10.121 -1.027 9.242 1.00 6.53 H new ATOM 359 N ALA A 24 8.607 -6.060 14.007 1.00 2.52 N ATOM 360 CA ALA A 24 9.759 -6.952 14.057 1.00 3.03 C ATOM 361 C ALA A 24 9.637 -7.847 15.292 1.00 3.50 C ATOM 362 O ALA A 24 10.489 -7.801 16.174 1.00 4.07 O ATOM 363 CB ALA A 24 11.047 -6.119 14.078 1.00 3.19 C ATOM 0 H ALA A 24 8.222 -5.840 14.926 1.00 2.52 H new ATOM 0 HA ALA A 24 9.793 -7.591 13.175 1.00 3.03 H new ATOM 0 HB1 ALA A 24 11.910 -6.784 14.115 1.00 3.19 H new ATOM 0 HB2 ALA A 24 11.099 -5.507 13.177 1.00 3.19 H new ATOM 0 HB3 ALA A 24 11.048 -5.473 14.956 1.00 3.19 H new ATOM 369 N ARG A 25 8.547 -8.623 15.367 1.00 3.92 N ATOM 370 CA ARG A 25 8.115 -9.320 16.578 1.00 4.64 C ATOM 371 C ARG A 25 8.237 -8.372 17.780 1.00 4.27 C ATOM 372 O ARG A 25 9.061 -8.576 18.670 1.00 4.70 O ATOM 373 CB ARG A 25 8.838 -10.672 16.767 1.00 5.94 C ATOM 374 CG ARG A 25 8.039 -11.693 17.614 1.00 6.71 C ATOM 375 CD ARG A 25 7.686 -11.151 19.007 1.00 6.83 C ATOM 376 NE ARG A 25 6.899 -12.063 19.855 1.00 8.02 N ATOM 377 CZ ARG A 25 6.256 -11.602 20.948 1.00 8.86 C ATOM 378 NH1 ARG A 25 6.504 -10.367 21.381 1.00 8.76 N ATOM 379 NH2 ARG A 25 5.354 -12.328 21.612 1.00 10.22 N ATOM 0 H ARG A 25 7.931 -8.784 14.570 1.00 3.92 H new ATOM 0 HA ARG A 25 7.064 -9.593 16.482 1.00 4.64 H new ATOM 0 HB2 ARG A 25 9.041 -11.105 15.788 1.00 5.94 H new ATOM 0 HB3 ARG A 25 9.803 -10.495 17.243 1.00 5.94 H new ATOM 0 HG2 ARG A 25 7.122 -11.959 17.088 1.00 6.71 H new ATOM 0 HG3 ARG A 25 8.622 -12.608 17.720 1.00 6.71 H new ATOM 0 HD2 ARG A 25 8.611 -10.904 19.528 1.00 6.83 H new ATOM 0 HD3 ARG A 25 7.130 -10.221 18.887 1.00 6.83 H new ATOM 0 HE ARG A 25 6.840 -13.052 19.614 1.00 8.02 H new ATOM 0 HH11 ARG A 25 7.175 -9.779 20.887 1.00 8.76 H new ATOM 0 HH12 ARG A 25 6.023 -10.010 22.206 1.00 8.76 H new ATOM 0 HH21 ARG A 25 5.127 -13.271 21.297 1.00 10.22 H new ATOM 0 HH22 ARG A 25 4.892 -11.939 22.434 1.00 10.22 H new ATOM 393 N GLN A 26 7.378 -7.353 17.820 1.00 4.21 N ATOM 394 CA GLN A 26 7.326 -6.409 18.926 1.00 4.31 C ATOM 395 C GLN A 26 5.900 -6.313 19.451 1.00 4.46 C ATOM 396 O GLN A 26 4.962 -6.786 18.811 1.00 5.37 O ATOM 397 CB GLN A 26 7.881 -5.041 18.503 1.00 5.06 C ATOM 398 CG GLN A 26 7.031 -4.359 17.425 1.00 5.93 C ATOM 399 CD GLN A 26 7.568 -2.977 17.066 1.00 7.36 C ATOM 400 OE1 GLN A 26 6.905 -1.968 17.281 1.00 8.24 O ATOM 401 NE2 GLN A 26 8.771 -2.923 16.502 1.00 8.09 N ATOM 0 H GLN A 26 6.699 -7.163 17.083 1.00 4.21 H new ATOM 0 HA GLN A 26 7.960 -6.767 19.737 1.00 4.31 H new ATOM 0 HB2 GLN A 26 7.939 -4.392 19.377 1.00 5.06 H new ATOM 0 HB3 GLN A 26 8.898 -5.166 18.131 1.00 5.06 H new ATOM 0 HG2 GLN A 26 7.009 -4.983 16.532 1.00 5.93 H new ATOM 0 HG3 GLN A 26 6.003 -4.269 17.776 1.00 5.93 H new ATOM 0 HE21 GLN A 26 9.296 -3.782 16.337 1.00 8.09 H new ATOM 0 HE22 GLN A 26 9.169 -2.023 16.234 1.00 8.09 H new ATOM 410 N GLU A 27 5.774 -5.679 20.613 1.00 4.07 N ATOM 411 CA GLU A 27 4.536 -5.304 21.259 1.00 4.42 C ATOM 412 C GLU A 27 4.770 -3.852 21.690 1.00 3.86 C ATOM 413 O GLU A 27 5.918 -3.449 21.872 1.00 4.05 O ATOM 414 CB GLU A 27 4.272 -6.258 22.439 1.00 5.62 C ATOM 415 CG GLU A 27 4.132 -7.720 21.964 1.00 6.93 C ATOM 416 CD GLU A 27 3.967 -8.725 23.101 1.00 8.52 C ATOM 417 OE1 GLU A 27 3.365 -8.337 24.123 1.00 8.99 O ATOM 418 OE2 GLU A 27 4.460 -9.868 22.919 1.00 9.64 O ATOM 0 H GLU A 27 6.590 -5.399 21.157 1.00 4.07 H new ATOM 0 HA GLU A 27 3.652 -5.376 20.625 1.00 4.42 H new ATOM 0 HB2 GLU A 27 5.088 -6.184 23.157 1.00 5.62 H new ATOM 0 HB3 GLU A 27 3.363 -5.954 22.958 1.00 5.62 H new ATOM 0 HG2 GLU A 27 3.272 -7.795 21.298 1.00 6.93 H new ATOM 0 HG3 GLU A 27 5.012 -7.988 21.380 1.00 6.93 H new ATOM 425 N GLY A 28 3.715 -3.041 21.800 1.00 3.88 N ATOM 426 CA GLY A 28 3.871 -1.633 22.148 1.00 3.80 C ATOM 427 C GLY A 28 4.459 -0.811 20.995 1.00 3.47 C ATOM 428 O GLY A 28 5.426 -0.063 21.165 1.00 4.10 O ATOM 0 H GLY A 28 2.750 -3.336 21.653 1.00 3.88 H new ATOM 0 HA2 GLY A 28 2.902 -1.221 22.428 1.00 3.80 H new ATOM 0 HA3 GLY A 28 4.518 -1.546 23.021 1.00 3.80 H new ATOM 432 N ARG A 29 3.806 -0.859 19.832 1.00 2.95 N ATOM 433 CA ARG A 29 4.203 -0.082 18.665 1.00 2.74 C ATOM 434 C ARG A 29 3.697 1.353 18.806 1.00 2.52 C ATOM 435 O ARG A 29 2.785 1.614 19.596 1.00 2.91 O ATOM 436 CB ARG A 29 3.663 -0.730 17.378 1.00 2.73 C ATOM 437 CG ARG A 29 2.171 -0.494 17.070 1.00 2.78 C ATOM 438 CD ARG A 29 1.195 -1.182 18.039 1.00 4.15 C ATOM 439 NE ARG A 29 0.994 -0.385 19.254 1.00 4.94 N ATOM 440 CZ ARG A 29 0.380 -0.805 20.367 1.00 6.15 C ATOM 441 NH1 ARG A 29 -0.185 -2.018 20.405 1.00 6.82 N ATOM 442 NH2 ARG A 29 0.361 -0.007 21.439 1.00 7.06 N ATOM 0 H ARG A 29 2.984 -1.442 19.677 1.00 2.95 H new ATOM 0 HA ARG A 29 5.291 -0.065 18.600 1.00 2.74 H new ATOM 0 HB2 ARG A 29 4.249 -0.360 16.537 1.00 2.73 H new ATOM 0 HB3 ARG A 29 3.834 -1.805 17.438 1.00 2.73 H new ATOM 0 HG2 ARG A 29 1.977 0.579 17.082 1.00 2.78 H new ATOM 0 HG3 ARG A 29 1.964 -0.844 16.059 1.00 2.78 H new ATOM 0 HD2 ARG A 29 0.237 -1.339 17.543 1.00 4.15 H new ATOM 0 HD3 ARG A 29 1.580 -2.166 18.307 1.00 4.15 H new ATOM 0 HE ARG A 29 1.352 0.570 19.251 1.00 4.94 H new ATOM 0 HH11 ARG A 29 -0.148 -2.624 19.585 1.00 6.82 H new ATOM 0 HH12 ARG A 29 -0.652 -2.337 21.254 1.00 6.82 H new ATOM 0 HH21 ARG A 29 0.810 0.908 21.402 1.00 7.06 H new ATOM 0 HH22 ARG A 29 -0.103 -0.313 22.294 1.00 7.06 H new ATOM 456 N LYS A 30 4.323 2.281 18.077 1.00 2.23 N ATOM 457 CA LYS A 30 3.869 3.656 17.950 1.00 2.17 C ATOM 458 C LYS A 30 2.755 3.684 16.891 1.00 1.99 C ATOM 459 O LYS A 30 1.687 3.126 17.135 1.00 2.79 O ATOM 460 CB LYS A 30 5.067 4.579 17.652 1.00 2.40 C ATOM 461 CG LYS A 30 5.976 4.849 18.869 1.00 3.46 C ATOM 462 CD LYS A 30 7.303 4.062 18.935 1.00 4.97 C ATOM 463 CE LYS A 30 7.227 2.568 19.298 1.00 6.09 C ATOM 464 NZ LYS A 30 6.438 2.313 20.522 1.00 6.94 N ATOM 0 H LYS A 30 5.175 2.087 17.551 1.00 2.23 H new ATOM 0 HA LYS A 30 3.443 4.040 18.877 1.00 2.17 H new ATOM 0 HB2 LYS A 30 5.666 4.133 16.857 1.00 2.40 H new ATOM 0 HB3 LYS A 30 4.693 5.530 17.274 1.00 2.40 H new ATOM 0 HG2 LYS A 30 6.211 5.913 18.888 1.00 3.46 H new ATOM 0 HG3 LYS A 30 5.407 4.632 19.773 1.00 3.46 H new ATOM 0 HD2 LYS A 30 7.793 4.148 17.965 1.00 4.97 H new ATOM 0 HD3 LYS A 30 7.949 4.552 19.663 1.00 4.97 H new ATOM 0 HE2 LYS A 30 6.785 2.019 18.466 1.00 6.09 H new ATOM 0 HE3 LYS A 30 8.237 2.181 19.435 1.00 6.09 H new ATOM 0 HZ1 LYS A 30 6.407 1.290 20.708 1.00 6.94 H new ATOM 0 HZ2 LYS A 30 6.881 2.798 21.328 1.00 6.94 H new ATOM 0 HZ3 LYS A 30 5.470 2.671 20.392 1.00 6.94 H new ATOM 478 N ASP A 31 3.003 4.278 15.718 1.00 1.48 N ATOM 479 CA ASP A 31 2.089 4.246 14.577 1.00 1.34 C ATOM 480 C ASP A 31 2.841 3.839 13.317 1.00 1.18 C ATOM 481 O ASP A 31 2.420 2.922 12.612 1.00 1.54 O ATOM 482 CB ASP A 31 1.426 5.601 14.366 1.00 1.53 C ATOM 483 CG ASP A 31 0.455 5.552 13.198 1.00 1.62 C ATOM 484 OD1 ASP A 31 -0.374 4.618 13.146 1.00 2.55 O ATOM 485 OD2 ASP A 31 0.530 6.497 12.386 1.00 2.47 O ATOM 0 H ASP A 31 3.859 4.802 15.535 1.00 1.48 H new ATOM 0 HA ASP A 31 1.311 3.513 14.788 1.00 1.34 H new ATOM 0 HB2 ASP A 31 0.897 5.897 15.272 1.00 1.53 H new ATOM 0 HB3 ASP A 31 2.188 6.358 14.180 1.00 1.53 H new ATOM 490 N SER A 32 3.942 4.529 13.018 1.00 1.10 N ATOM 491 CA SER A 32 4.822 4.170 11.919 1.00 0.92 C ATOM 492 C SER A 32 6.278 4.426 12.326 1.00 0.95 C ATOM 493 O SER A 32 6.761 3.733 13.219 1.00 1.69 O ATOM 494 CB SER A 32 4.350 4.861 10.635 1.00 0.98 C ATOM 495 OG SER A 32 3.102 4.329 10.230 1.00 2.36 O ATOM 0 H SER A 32 4.245 5.354 13.536 1.00 1.10 H new ATOM 0 HA SER A 32 4.778 3.105 11.692 1.00 0.92 H new ATOM 0 HB2 SER A 32 4.260 5.934 10.802 1.00 0.98 H new ATOM 0 HB3 SER A 32 5.088 4.722 9.845 1.00 0.98 H new ATOM 0 HG SER A 32 3.198 3.370 10.052 1.00 2.36 H new ATOM 501 N LEU A 33 6.996 5.331 11.652 1.00 0.97 N ATOM 502 CA LEU A 33 8.455 5.399 11.704 1.00 1.00 C ATOM 503 C LEU A 33 8.905 6.844 11.535 1.00 0.93 C ATOM 504 O LEU A 33 8.132 7.666 11.049 1.00 1.07 O ATOM 505 CB LEU A 33 9.054 4.571 10.551 1.00 1.46 C ATOM 506 CG LEU A 33 8.707 3.075 10.545 1.00 1.62 C ATOM 507 CD1 LEU A 33 9.173 2.438 9.234 1.00 3.99 C ATOM 508 CD2 LEU A 33 9.409 2.367 11.701 1.00 1.77 C ATOM 0 H LEU A 33 6.575 6.040 11.052 1.00 0.97 H new ATOM 0 HA LEU A 33 8.792 5.008 12.664 1.00 1.00 H new ATOM 0 HB2 LEU A 33 8.721 5.005 9.608 1.00 1.46 H new ATOM 0 HB3 LEU A 33 10.139 4.672 10.583 1.00 1.46 H new ATOM 0 HG LEU A 33 7.627 2.972 10.649 1.00 1.62 H new ATOM 0 HD11 LEU A 33 8.924 1.377 9.236 1.00 3.99 H new ATOM 0 HD12 LEU A 33 8.676 2.926 8.396 1.00 3.99 H new ATOM 0 HD13 LEU A 33 10.252 2.557 9.135 1.00 3.99 H new ATOM 0 HD21 LEU A 33 9.155 1.307 11.686 1.00 1.77 H new ATOM 0 HD22 LEU A 33 10.488 2.483 11.598 1.00 1.77 H new ATOM 0 HD23 LEU A 33 9.086 2.804 12.646 1.00 1.77 H new ATOM 520 N SER A 34 10.162 7.135 11.868 1.00 0.80 N ATOM 521 CA SER A 34 10.837 8.351 11.439 1.00 0.81 C ATOM 522 C SER A 34 11.014 8.296 9.913 1.00 0.73 C ATOM 523 O SER A 34 11.079 7.214 9.331 1.00 0.75 O ATOM 524 CB SER A 34 12.172 8.462 12.188 1.00 0.98 C ATOM 525 OG SER A 34 12.929 9.569 11.747 1.00 2.84 O ATOM 0 H SER A 34 10.741 6.527 12.447 1.00 0.80 H new ATOM 0 HA SER A 34 10.255 9.243 11.673 1.00 0.81 H new ATOM 0 HB2 SER A 34 11.982 8.554 13.257 1.00 0.98 H new ATOM 0 HB3 SER A 34 12.747 7.547 12.044 1.00 0.98 H new ATOM 0 HG SER A 34 12.492 10.399 12.033 1.00 2.84 H new ATOM 531 N VAL A 35 11.061 9.441 9.230 1.00 0.72 N ATOM 532 CA VAL A 35 11.127 9.451 7.769 1.00 0.74 C ATOM 533 C VAL A 35 12.350 8.704 7.220 1.00 0.66 C ATOM 534 O VAL A 35 12.214 7.873 6.317 1.00 0.66 O ATOM 535 CB VAL A 35 11.095 10.869 7.193 1.00 0.94 C ATOM 536 CG1 VAL A 35 10.602 10.818 5.741 1.00 0.85 C ATOM 537 CG2 VAL A 35 10.173 11.849 7.930 1.00 1.25 C ATOM 0 H VAL A 35 11.055 10.365 9.661 1.00 0.72 H new ATOM 0 HA VAL A 35 10.232 8.921 7.444 1.00 0.74 H new ATOM 0 HB VAL A 35 12.117 11.233 7.295 1.00 0.94 H new ATOM 0 HG11 VAL A 35 10.579 11.827 5.329 1.00 0.85 H new ATOM 0 HG12 VAL A 35 11.277 10.200 5.149 1.00 0.85 H new ATOM 0 HG13 VAL A 35 9.600 10.391 5.712 1.00 0.85 H new ATOM 0 HG21 VAL A 35 10.219 12.825 7.447 1.00 1.25 H new ATOM 0 HG22 VAL A 35 9.149 11.478 7.900 1.00 1.25 H new ATOM 0 HG23 VAL A 35 10.495 11.942 8.967 1.00 1.25 H new ATOM 547 N ASN A 36 13.555 9.028 7.707 1.00 0.76 N ATOM 548 CA ASN A 36 14.763 8.413 7.146 1.00 0.88 C ATOM 549 C ASN A 36 14.700 6.903 7.367 1.00 0.89 C ATOM 550 O ASN A 36 14.765 6.118 6.419 1.00 0.97 O ATOM 551 CB ASN A 36 16.062 9.005 7.713 1.00 1.19 C ATOM 552 CG ASN A 36 17.026 9.342 6.576 1.00 2.23 C ATOM 553 OD1 ASN A 36 17.472 8.470 5.841 1.00 3.06 O ATOM 554 ND2 ASN A 36 17.318 10.625 6.372 1.00 2.50 N ATOM 0 H ASN A 36 13.717 9.691 8.465 1.00 0.76 H new ATOM 0 HA ASN A 36 14.786 8.632 6.078 1.00 0.88 H new ATOM 0 HB2 ASN A 36 15.840 9.903 8.290 1.00 1.19 H new ATOM 0 HB3 ASN A 36 16.527 8.294 8.396 1.00 1.19 H new ATOM 0 HD21 ASN A 36 17.921 10.893 5.594 1.00 2.50 H new ATOM 0 HD22 ASN A 36 16.938 11.339 6.993 1.00 2.50 H new ATOM 561 N GLU A 37 14.454 6.553 8.636 1.00 0.90 N ATOM 562 CA GLU A 37 14.194 5.210 9.120 1.00 0.92 C ATOM 563 C GLU A 37 13.239 4.501 8.163 1.00 0.86 C ATOM 564 O GLU A 37 13.523 3.397 7.719 1.00 0.95 O ATOM 565 CB GLU A 37 13.625 5.321 10.542 1.00 0.98 C ATOM 566 CG GLU A 37 13.253 3.985 11.193 1.00 1.42 C ATOM 567 CD GLU A 37 12.598 4.184 12.556 1.00 2.18 C ATOM 568 OE1 GLU A 37 11.795 5.138 12.669 1.00 3.48 O ATOM 569 OE2 GLU A 37 12.896 3.372 13.456 1.00 2.97 O ATOM 0 H GLU A 37 14.432 7.244 9.386 1.00 0.90 H new ATOM 0 HA GLU A 37 15.106 4.614 9.158 1.00 0.92 H new ATOM 0 HB2 GLU A 37 14.358 5.825 11.173 1.00 0.98 H new ATOM 0 HB3 GLU A 37 12.739 5.955 10.515 1.00 0.98 H new ATOM 0 HG2 GLU A 37 12.573 3.438 10.539 1.00 1.42 H new ATOM 0 HG3 GLU A 37 14.148 3.373 11.305 1.00 1.42 H new ATOM 576 N PHE A 38 12.120 5.134 7.807 1.00 0.84 N ATOM 577 CA PHE A 38 11.196 4.583 6.831 1.00 0.85 C ATOM 578 C PHE A 38 11.888 4.251 5.507 1.00 0.85 C ATOM 579 O PHE A 38 11.843 3.087 5.108 1.00 0.85 O ATOM 580 CB PHE A 38 9.970 5.487 6.665 1.00 0.82 C ATOM 581 CG PHE A 38 9.160 5.229 5.414 1.00 0.91 C ATOM 582 CD1 PHE A 38 8.152 4.250 5.410 1.00 1.62 C ATOM 583 CD2 PHE A 38 9.565 5.819 4.206 1.00 1.92 C ATOM 584 CE1 PHE A 38 7.569 3.853 4.196 1.00 1.71 C ATOM 585 CE2 PHE A 38 9.130 5.273 2.992 1.00 1.94 C ATOM 586 CZ PHE A 38 8.106 4.311 2.982 1.00 1.12 C ATOM 0 H PHE A 38 11.836 6.037 8.188 1.00 0.84 H new ATOM 0 HA PHE A 38 10.831 3.630 7.213 1.00 0.85 H new ATOM 0 HB2 PHE A 38 9.323 5.362 7.533 1.00 0.82 H new ATOM 0 HB3 PHE A 38 10.299 6.526 6.660 1.00 0.82 H new ATOM 0 HD1 PHE A 38 7.827 3.804 6.338 1.00 1.62 H new ATOM 0 HD2 PHE A 38 10.207 6.687 4.213 1.00 1.92 H new ATOM 0 HE1 PHE A 38 6.711 3.198 4.196 1.00 1.71 H new ATOM 0 HE2 PHE A 38 9.581 5.591 2.064 1.00 1.94 H new ATOM 0 HZ PHE A 38 7.733 3.925 2.045 1.00 1.12 H new ATOM 596 N LYS A 39 12.498 5.227 4.808 1.00 0.93 N ATOM 597 CA LYS A 39 13.049 4.946 3.477 1.00 1.08 C ATOM 598 C LYS A 39 14.020 3.769 3.620 1.00 1.09 C ATOM 599 O LYS A 39 13.849 2.742 2.961 1.00 1.14 O ATOM 600 CB LYS A 39 13.707 6.168 2.788 1.00 1.33 C ATOM 601 CG LYS A 39 13.640 6.093 1.240 1.00 2.15 C ATOM 602 CD LYS A 39 14.371 4.906 0.567 1.00 3.57 C ATOM 603 CE LYS A 39 14.170 4.875 -0.965 1.00 5.08 C ATOM 604 NZ LYS A 39 14.855 3.737 -1.634 1.00 6.64 N ATOM 0 H LYS A 39 12.618 6.186 5.133 1.00 0.93 H new ATOM 0 HA LYS A 39 12.227 4.691 2.808 1.00 1.08 H new ATOM 0 HB2 LYS A 39 13.213 7.079 3.125 1.00 1.33 H new ATOM 0 HB3 LYS A 39 14.749 6.237 3.099 1.00 1.33 H new ATOM 0 HG2 LYS A 39 12.591 6.056 0.947 1.00 2.15 H new ATOM 0 HG3 LYS A 39 14.052 7.018 0.837 1.00 2.15 H new ATOM 0 HD2 LYS A 39 15.436 4.968 0.789 1.00 3.57 H new ATOM 0 HD3 LYS A 39 14.010 3.971 0.996 1.00 3.57 H new ATOM 0 HE2 LYS A 39 13.103 4.824 -1.182 1.00 5.08 H new ATOM 0 HE3 LYS A 39 14.537 5.809 -1.390 1.00 5.08 H new ATOM 0 HZ1 LYS A 39 14.350 3.495 -2.511 1.00 6.64 H new ATOM 0 HZ2 LYS A 39 15.834 4.006 -1.861 1.00 6.64 H new ATOM 0 HZ3 LYS A 39 14.861 2.913 -0.999 1.00 6.64 H new ATOM 618 N GLU A 40 14.990 3.901 4.528 1.00 1.17 N ATOM 619 CA GLU A 40 15.978 2.872 4.814 1.00 1.18 C ATOM 620 C GLU A 40 15.311 1.510 5.041 1.00 1.23 C ATOM 621 O GLU A 40 15.591 0.542 4.335 1.00 1.53 O ATOM 622 CB GLU A 40 16.802 3.302 6.034 1.00 1.23 C ATOM 623 CG GLU A 40 17.647 4.544 5.725 1.00 1.13 C ATOM 624 CD GLU A 40 18.363 5.032 6.978 1.00 1.57 C ATOM 625 OE1 GLU A 40 17.688 5.686 7.803 1.00 2.83 O ATOM 626 OE2 GLU A 40 19.566 4.714 7.099 1.00 2.01 O ATOM 0 H GLU A 40 15.108 4.743 5.092 1.00 1.17 H new ATOM 0 HA GLU A 40 16.641 2.758 3.956 1.00 1.18 H new ATOM 0 HB2 GLU A 40 16.135 3.512 6.870 1.00 1.23 H new ATOM 0 HB3 GLU A 40 17.453 2.484 6.343 1.00 1.23 H new ATOM 0 HG2 GLU A 40 18.377 4.310 4.950 1.00 1.13 H new ATOM 0 HG3 GLU A 40 17.009 5.336 5.333 1.00 1.13 H new ATOM 633 N LEU A 41 14.410 1.429 6.018 1.00 0.95 N ATOM 634 CA LEU A 41 13.779 0.180 6.399 1.00 0.85 C ATOM 635 C LEU A 41 12.934 -0.408 5.273 1.00 0.83 C ATOM 636 O LEU A 41 12.868 -1.629 5.179 1.00 1.09 O ATOM 637 CB LEU A 41 12.976 0.299 7.701 1.00 0.80 C ATOM 638 CG LEU A 41 13.841 0.491 8.962 1.00 1.36 C ATOM 639 CD1 LEU A 41 12.914 0.577 10.179 1.00 2.02 C ATOM 640 CD2 LEU A 41 14.833 -0.658 9.198 1.00 2.54 C ATOM 0 H LEU A 41 14.101 2.232 6.565 1.00 0.95 H new ATOM 0 HA LEU A 41 14.592 -0.520 6.592 1.00 0.85 H new ATOM 0 HB2 LEU A 41 12.288 1.140 7.615 1.00 0.80 H new ATOM 0 HB3 LEU A 41 12.369 -0.598 7.824 1.00 0.80 H new ATOM 0 HG LEU A 41 14.422 1.402 8.817 1.00 1.36 H new ATOM 0 HD11 LEU A 41 13.510 0.713 11.081 1.00 2.02 H new ATOM 0 HD12 LEU A 41 12.236 1.422 10.061 1.00 2.02 H new ATOM 0 HD13 LEU A 41 12.336 -0.343 10.262 1.00 2.02 H new ATOM 0 HD21 LEU A 41 15.410 -0.460 10.101 1.00 2.54 H new ATOM 0 HD22 LEU A 41 14.285 -1.593 9.315 1.00 2.54 H new ATOM 0 HD23 LEU A 41 15.508 -0.737 8.346 1.00 2.54 H new ATOM 652 N VAL A 42 12.295 0.382 4.404 1.00 0.74 N ATOM 653 CA VAL A 42 11.550 -0.240 3.309 1.00 0.82 C ATOM 654 C VAL A 42 12.534 -0.740 2.256 1.00 0.99 C ATOM 655 O VAL A 42 12.431 -1.874 1.801 1.00 1.04 O ATOM 656 CB VAL A 42 10.402 0.619 2.758 1.00 0.91 C ATOM 657 CG1 VAL A 42 9.396 0.911 3.876 1.00 1.70 C ATOM 658 CG2 VAL A 42 10.834 1.914 2.065 1.00 1.32 C ATOM 0 H VAL A 42 12.277 1.401 4.432 1.00 0.74 H new ATOM 0 HA VAL A 42 11.015 -1.103 3.704 1.00 0.82 H new ATOM 0 HB VAL A 42 9.939 0.027 1.969 1.00 0.91 H new ATOM 0 HG11 VAL A 42 8.582 1.521 3.483 1.00 1.70 H new ATOM 0 HG12 VAL A 42 8.994 -0.027 4.258 1.00 1.70 H new ATOM 0 HG13 VAL A 42 9.895 1.448 4.683 1.00 1.70 H new ATOM 0 HG21 VAL A 42 9.953 2.449 1.711 1.00 1.32 H new ATOM 0 HG22 VAL A 42 11.379 2.540 2.771 1.00 1.32 H new ATOM 0 HG23 VAL A 42 11.478 1.676 1.218 1.00 1.32 H new ATOM 668 N THR A 43 13.548 0.066 1.939 1.00 1.10 N ATOM 669 CA THR A 43 14.688 -0.371 1.141 1.00 1.13 C ATOM 670 C THR A 43 15.239 -1.714 1.666 1.00 1.16 C ATOM 671 O THR A 43 15.583 -2.596 0.886 1.00 1.27 O ATOM 672 CB THR A 43 15.720 0.782 1.090 1.00 1.14 C ATOM 673 OG1 THR A 43 15.597 1.498 -0.136 1.00 2.07 O ATOM 674 CG2 THR A 43 17.164 0.356 1.361 1.00 1.49 C ATOM 0 H THR A 43 13.599 1.042 2.230 1.00 1.10 H new ATOM 0 HA THR A 43 14.397 -0.581 0.112 1.00 1.13 H new ATOM 0 HB THR A 43 15.476 1.446 1.919 1.00 1.14 H new ATOM 0 HG1 THR A 43 16.349 2.119 -0.229 1.00 2.07 H new ATOM 0 HG21 THR A 43 17.817 1.227 1.305 1.00 1.49 H new ATOM 0 HG22 THR A 43 17.233 -0.086 2.355 1.00 1.49 H new ATOM 0 HG23 THR A 43 17.473 -0.377 0.616 1.00 1.49 H new ATOM 682 N GLN A 44 15.301 -1.877 2.989 1.00 1.13 N ATOM 683 CA GLN A 44 15.870 -3.041 3.656 1.00 1.08 C ATOM 684 C GLN A 44 14.903 -4.232 3.665 1.00 1.00 C ATOM 685 O GLN A 44 15.335 -5.366 3.462 1.00 1.05 O ATOM 686 CB GLN A 44 16.315 -2.625 5.063 1.00 1.09 C ATOM 687 CG GLN A 44 16.963 -3.754 5.872 1.00 1.57 C ATOM 688 CD GLN A 44 15.929 -4.492 6.722 1.00 2.78 C ATOM 689 OE1 GLN A 44 15.551 -4.018 7.790 1.00 3.32 O ATOM 690 NE2 GLN A 44 15.410 -5.617 6.245 1.00 4.23 N ATOM 0 H GLN A 44 14.945 -1.179 3.642 1.00 1.13 H new ATOM 0 HA GLN A 44 16.740 -3.391 3.101 1.00 1.08 H new ATOM 0 HB2 GLN A 44 17.022 -1.800 4.980 1.00 1.09 H new ATOM 0 HB3 GLN A 44 15.450 -2.250 5.610 1.00 1.09 H new ATOM 0 HG2 GLN A 44 17.449 -4.457 5.195 1.00 1.57 H new ATOM 0 HG3 GLN A 44 17.740 -3.343 6.516 1.00 1.57 H new ATOM 0 HE21 GLN A 44 15.739 -5.993 5.356 1.00 4.23 H new ATOM 0 HE22 GLN A 44 14.683 -6.105 6.768 1.00 4.23 H new ATOM 699 N GLN A 45 13.614 -4.000 3.934 1.00 0.96 N ATOM 700 CA GLN A 45 12.556 -5.005 3.800 1.00 0.98 C ATOM 701 C GLN A 45 12.395 -5.405 2.328 1.00 1.03 C ATOM 702 O GLN A 45 11.827 -6.454 2.034 1.00 1.19 O ATOM 703 CB GLN A 45 11.238 -4.488 4.406 1.00 0.97 C ATOM 704 CG GLN A 45 11.034 -4.839 5.890 1.00 1.08 C ATOM 705 CD GLN A 45 12.296 -4.802 6.757 1.00 1.21 C ATOM 706 OE1 GLN A 45 12.781 -5.839 7.200 1.00 2.64 O ATOM 707 NE2 GLN A 45 12.859 -3.631 7.014 1.00 1.51 N ATOM 0 H GLN A 45 13.272 -3.095 4.256 1.00 0.96 H new ATOM 0 HA GLN A 45 12.836 -5.899 4.358 1.00 0.98 H new ATOM 0 HB2 GLN A 45 11.203 -3.404 4.294 1.00 0.97 H new ATOM 0 HB3 GLN A 45 10.405 -4.895 3.832 1.00 0.97 H new ATOM 0 HG2 GLN A 45 10.304 -4.148 6.312 1.00 1.08 H new ATOM 0 HG3 GLN A 45 10.601 -5.837 5.953 1.00 1.08 H new ATOM 0 HE21 GLN A 45 12.448 -2.775 6.641 1.00 1.51 H new ATOM 0 HE22 GLN A 45 13.703 -3.585 7.585 1.00 1.51 H new ATOM 716 N LEU A 46 12.901 -4.566 1.421 1.00 0.91 N ATOM 717 CA LEU A 46 13.097 -4.811 0.003 1.00 0.86 C ATOM 718 C LEU A 46 14.345 -5.509 -0.575 1.00 1.12 C ATOM 719 O LEU A 46 14.867 -4.963 -1.547 1.00 1.41 O ATOM 720 CB LEU A 46 11.969 -4.453 -0.982 1.00 1.49 C ATOM 721 CG LEU A 46 10.506 -4.469 -0.526 1.00 1.64 C ATOM 722 CD1 LEU A 46 10.120 -3.376 0.484 1.00 1.61 C ATOM 723 CD2 LEU A 46 9.656 -4.253 -1.789 1.00 2.05 C ATOM 0 H LEU A 46 13.205 -3.629 1.686 1.00 0.91 H new ATOM 0 HA LEU A 46 13.832 -4.165 0.483 1.00 0.86 H new ATOM 0 HB2 LEU A 46 12.177 -3.452 -1.360 1.00 1.49 H new ATOM 0 HB3 LEU A 46 12.050 -5.137 -1.827 1.00 1.49 H new ATOM 0 HG LEU A 46 10.340 -5.418 -0.017 1.00 1.64 H new ATOM 0 HD11 LEU A 46 9.066 -3.475 0.742 1.00 1.61 H new ATOM 0 HD12 LEU A 46 10.725 -3.482 1.384 1.00 1.61 H new ATOM 0 HD13 LEU A 46 10.295 -2.395 0.043 1.00 1.61 H new ATOM 0 HD21 LEU A 46 8.599 -4.255 -1.521 1.00 2.05 H new ATOM 0 HD22 LEU A 46 9.913 -3.295 -2.241 1.00 2.05 H new ATOM 0 HD23 LEU A 46 9.852 -5.055 -2.501 1.00 2.05 H new ATOM 735 N PRO A 47 14.805 -6.713 -0.182 1.00 1.24 N ATOM 736 CA PRO A 47 16.068 -7.247 -0.697 1.00 1.46 C ATOM 737 C PRO A 47 15.900 -7.980 -2.043 1.00 1.72 C ATOM 738 O PRO A 47 16.435 -9.071 -2.246 1.00 2.33 O ATOM 739 CB PRO A 47 16.612 -8.129 0.428 1.00 1.52 C ATOM 740 CG PRO A 47 15.339 -8.685 1.054 1.00 1.61 C ATOM 741 CD PRO A 47 14.329 -7.545 0.907 1.00 1.29 C ATOM 0 HA PRO A 47 16.776 -6.456 -0.943 1.00 1.46 H new ATOM 0 HB2 PRO A 47 17.257 -8.921 0.047 1.00 1.52 H new ATOM 0 HB3 PRO A 47 17.200 -7.556 1.145 1.00 1.52 H new ATOM 0 HG2 PRO A 47 15.002 -9.586 0.541 1.00 1.61 H new ATOM 0 HG3 PRO A 47 15.491 -8.952 2.100 1.00 1.61 H new ATOM 0 HD2 PRO A 47 13.334 -7.934 0.692 1.00 1.29 H new ATOM 0 HD3 PRO A 47 14.255 -6.971 1.830 1.00 1.29 H new ATOM 749 N HIS A 48 15.199 -7.334 -2.977 1.00 1.37 N ATOM 750 CA HIS A 48 15.179 -7.630 -4.400 1.00 1.35 C ATOM 751 C HIS A 48 16.430 -6.954 -5.021 1.00 1.46 C ATOM 752 O HIS A 48 17.504 -6.945 -4.423 1.00 2.43 O ATOM 753 CB HIS A 48 13.840 -7.132 -4.981 1.00 1.32 C ATOM 754 CG HIS A 48 13.676 -5.632 -5.053 1.00 2.25 C ATOM 755 ND1 HIS A 48 13.660 -4.746 -4.002 1.00 4.08 N ATOM 756 CD2 HIS A 48 13.711 -4.893 -6.202 1.00 3.15 C ATOM 757 CE1 HIS A 48 13.681 -3.505 -4.513 1.00 5.74 C ATOM 758 NE2 HIS A 48 13.756 -3.545 -5.852 1.00 5.20 N ATOM 0 H HIS A 48 14.597 -6.545 -2.740 1.00 1.37 H new ATOM 0 HA HIS A 48 15.232 -8.695 -4.624 1.00 1.35 H new ATOM 0 HB2 HIS A 48 13.726 -7.540 -5.985 1.00 1.32 H new ATOM 0 HB3 HIS A 48 13.029 -7.539 -4.377 1.00 1.32 H new ATOM 0 HD1 HIS A 48 13.636 -4.988 -3.011 1.00 4.08 H new ATOM 0 HD2 HIS A 48 13.705 -5.286 -7.208 1.00 3.15 H new ATOM 0 HE1 HIS A 48 13.643 -2.599 -3.927 1.00 5.74 H new ATOM 766 N LEU A 49 16.283 -6.309 -6.185 1.00 1.49 N ATOM 767 CA LEU A 49 17.298 -5.502 -6.856 1.00 1.41 C ATOM 768 C LEU A 49 17.631 -4.172 -6.146 1.00 1.39 C ATOM 769 O LEU A 49 18.799 -3.972 -5.830 1.00 1.65 O ATOM 770 CB LEU A 49 16.875 -5.224 -8.310 1.00 1.31 C ATOM 771 CG LEU A 49 16.841 -6.432 -9.267 1.00 2.42 C ATOM 772 CD1 LEU A 49 18.206 -7.118 -9.385 1.00 2.94 C ATOM 773 CD2 LEU A 49 15.762 -7.471 -8.934 1.00 4.42 C ATOM 0 H LEU A 49 15.407 -6.340 -6.707 1.00 1.49 H new ATOM 0 HA LEU A 49 18.212 -6.095 -6.826 1.00 1.41 H new ATOM 0 HB2 LEU A 49 15.882 -4.775 -8.295 1.00 1.31 H new ATOM 0 HB3 LEU A 49 17.555 -4.480 -8.725 1.00 1.31 H new ATOM 0 HG LEU A 49 16.575 -5.999 -10.232 1.00 2.42 H new ATOM 0 HD11 LEU A 49 18.131 -7.963 -10.070 1.00 2.94 H new ATOM 0 HD12 LEU A 49 18.939 -6.407 -9.765 1.00 2.94 H new ATOM 0 HD13 LEU A 49 18.521 -7.473 -8.404 1.00 2.94 H new ATOM 0 HD21 LEU A 49 15.807 -8.287 -9.656 1.00 4.42 H new ATOM 0 HD22 LEU A 49 15.932 -7.863 -7.931 1.00 4.42 H new ATOM 0 HD23 LEU A 49 14.779 -7.002 -8.978 1.00 4.42 H new ATOM 785 N LEU A 50 16.664 -3.249 -5.970 1.00 1.22 N ATOM 786 CA LEU A 50 16.864 -1.842 -5.568 1.00 1.25 C ATOM 787 C LEU A 50 17.333 -1.055 -6.787 1.00 1.36 C ATOM 788 O LEU A 50 18.495 -0.668 -6.884 1.00 1.74 O ATOM 789 CB LEU A 50 17.829 -1.579 -4.385 1.00 1.49 C ATOM 790 CG LEU A 50 17.381 -1.964 -2.970 1.00 1.72 C ATOM 791 CD1 LEU A 50 16.160 -1.154 -2.519 1.00 2.40 C ATOM 792 CD2 LEU A 50 17.166 -3.468 -2.808 1.00 2.64 C ATOM 0 H LEU A 50 15.679 -3.474 -6.110 1.00 1.22 H new ATOM 0 HA LEU A 50 15.894 -1.516 -5.192 1.00 1.25 H new ATOM 0 HB2 LEU A 50 18.759 -2.109 -4.593 1.00 1.49 H new ATOM 0 HB3 LEU A 50 18.063 -0.514 -4.380 1.00 1.49 H new ATOM 0 HG LEU A 50 18.203 -1.703 -2.304 1.00 1.72 H new ATOM 0 HD11 LEU A 50 15.874 -1.457 -1.512 1.00 2.40 H new ATOM 0 HD12 LEU A 50 16.406 -0.092 -2.523 1.00 2.40 H new ATOM 0 HD13 LEU A 50 15.330 -1.336 -3.202 1.00 2.40 H new ATOM 0 HD21 LEU A 50 16.850 -3.682 -1.787 1.00 2.64 H new ATOM 0 HD22 LEU A 50 16.397 -3.803 -3.504 1.00 2.64 H new ATOM 0 HD23 LEU A 50 18.098 -3.993 -3.017 1.00 2.64 H new ATOM 804 N LYS A 51 16.436 -0.852 -7.754 1.00 1.24 N ATOM 805 CA LYS A 51 16.793 -0.128 -8.970 1.00 1.38 C ATOM 806 C LYS A 51 16.741 1.395 -8.749 1.00 1.20 C ATOM 807 O LYS A 51 17.526 2.141 -9.325 1.00 1.31 O ATOM 808 CB LYS A 51 15.910 -0.640 -10.113 1.00 1.54 C ATOM 809 CG LYS A 51 14.468 -0.138 -9.995 1.00 1.34 C ATOM 810 CD LYS A 51 14.348 1.236 -10.691 1.00 1.31 C ATOM 811 CE LYS A 51 13.560 1.222 -12.015 1.00 1.91 C ATOM 812 NZ LYS A 51 12.312 2.013 -11.929 1.00 4.14 N ATOM 0 H LYS A 51 15.469 -1.175 -7.718 1.00 1.24 H new ATOM 0 HA LYS A 51 17.829 -0.321 -9.250 1.00 1.38 H new ATOM 0 HB2 LYS A 51 16.329 -0.318 -11.066 1.00 1.54 H new ATOM 0 HB3 LYS A 51 15.915 -1.730 -10.114 1.00 1.54 H new ATOM 0 HG2 LYS A 51 13.783 -0.852 -10.453 1.00 1.34 H new ATOM 0 HG3 LYS A 51 14.185 -0.053 -8.946 1.00 1.34 H new ATOM 0 HD2 LYS A 51 13.867 1.934 -10.006 1.00 1.31 H new ATOM 0 HD3 LYS A 51 15.350 1.618 -10.885 1.00 1.31 H new ATOM 0 HE2 LYS A 51 14.186 1.620 -12.813 1.00 1.91 H new ATOM 0 HE3 LYS A 51 13.319 0.193 -12.282 1.00 1.91 H new ATOM 0 HZ1 LYS A 51 11.542 1.499 -12.403 1.00 4.14 H new ATOM 0 HZ2 LYS A 51 12.065 2.164 -10.930 1.00 4.14 H new ATOM 0 HZ3 LYS A 51 12.451 2.933 -12.394 1.00 4.14 H new ATOM 826 N ASP A 52 15.755 1.820 -7.955 1.00 1.03 N ATOM 827 CA ASP A 52 15.535 3.118 -7.341 1.00 1.00 C ATOM 828 C ASP A 52 15.780 4.347 -8.214 1.00 0.94 C ATOM 829 O ASP A 52 16.887 4.874 -8.264 1.00 1.16 O ATOM 830 CB ASP A 52 16.165 3.195 -5.941 1.00 1.32 C ATOM 831 CG ASP A 52 15.585 2.182 -4.952 1.00 1.54 C ATOM 832 OD1 ASP A 52 15.148 1.100 -5.415 1.00 2.37 O ATOM 833 OD2 ASP A 52 15.592 2.505 -3.740 1.00 2.41 O ATOM 0 H ASP A 52 15.004 1.178 -7.701 1.00 1.03 H new ATOM 0 HA ASP A 52 14.454 3.176 -7.216 1.00 1.00 H new ATOM 0 HB2 ASP A 52 17.240 3.033 -6.026 1.00 1.32 H new ATOM 0 HB3 ASP A 52 16.024 4.200 -5.543 1.00 1.32 H new ATOM 838 N VAL A 53 14.718 4.842 -8.870 1.00 0.89 N ATOM 839 CA VAL A 53 14.785 6.085 -9.623 1.00 0.95 C ATOM 840 C VAL A 53 13.428 6.789 -9.625 1.00 1.04 C ATOM 841 O VAL A 53 12.394 6.121 -9.576 1.00 1.60 O ATOM 842 CB VAL A 53 15.347 5.826 -11.034 1.00 1.40 C ATOM 843 CG1 VAL A 53 14.450 4.902 -11.864 1.00 1.94 C ATOM 844 CG2 VAL A 53 15.567 7.137 -11.792 1.00 2.03 C ATOM 0 H VAL A 53 13.803 4.391 -8.888 1.00 0.89 H new ATOM 0 HA VAL A 53 15.479 6.770 -9.136 1.00 0.95 H new ATOM 0 HB VAL A 53 16.304 5.325 -10.890 1.00 1.40 H new ATOM 0 HG11 VAL A 53 14.893 4.753 -12.849 1.00 1.94 H new ATOM 0 HG12 VAL A 53 14.353 3.940 -11.360 1.00 1.94 H new ATOM 0 HG13 VAL A 53 13.464 5.354 -11.974 1.00 1.94 H new ATOM 0 HG21 VAL A 53 15.964 6.922 -12.784 1.00 2.03 H new ATOM 0 HG22 VAL A 53 14.619 7.666 -11.888 1.00 2.03 H new ATOM 0 HG23 VAL A 53 16.275 7.759 -11.245 1.00 2.03 H new ATOM 854 N GLY A 54 13.440 8.130 -9.649 1.00 1.11 N ATOM 855 CA GLY A 54 12.269 9.000 -9.737 1.00 1.37 C ATOM 856 C GLY A 54 11.454 8.982 -8.445 1.00 1.43 C ATOM 857 O GLY A 54 11.393 9.951 -7.695 1.00 1.66 O ATOM 0 H GLY A 54 14.312 8.658 -9.605 1.00 1.11 H new ATOM 0 HA2 GLY A 54 12.588 10.020 -9.952 1.00 1.37 H new ATOM 0 HA3 GLY A 54 11.640 8.681 -10.568 1.00 1.37 H new ATOM 861 N SER A 55 10.853 7.834 -8.158 1.00 1.38 N ATOM 862 CA SER A 55 10.238 7.563 -6.875 1.00 1.64 C ATOM 863 C SER A 55 11.245 7.748 -5.741 1.00 1.27 C ATOM 864 O SER A 55 10.889 8.235 -4.662 1.00 1.29 O ATOM 865 CB SER A 55 9.717 6.144 -6.927 1.00 2.12 C ATOM 866 OG SER A 55 8.651 6.124 -7.842 1.00 2.50 O ATOM 0 H SER A 55 10.781 7.061 -8.819 1.00 1.38 H new ATOM 0 HA SER A 55 9.422 8.258 -6.679 1.00 1.64 H new ATOM 0 HB2 SER A 55 10.504 5.457 -7.238 1.00 2.12 H new ATOM 0 HB3 SER A 55 9.383 5.821 -5.941 1.00 2.12 H new ATOM 0 HG SER A 55 7.841 6.466 -7.408 1.00 2.50 H new ATOM 872 N LEU A 56 12.497 7.366 -6.012 1.00 1.00 N ATOM 873 CA LEU A 56 13.640 7.626 -5.156 1.00 0.83 C ATOM 874 C LEU A 56 13.573 9.074 -4.678 1.00 0.91 C ATOM 875 O LEU A 56 13.393 9.323 -3.490 1.00 0.96 O ATOM 876 CB LEU A 56 14.916 7.346 -5.970 1.00 0.78 C ATOM 877 CG LEU A 56 16.212 7.898 -5.356 1.00 1.27 C ATOM 878 CD1 LEU A 56 16.369 7.453 -3.902 1.00 2.11 C ATOM 879 CD2 LEU A 56 17.416 7.420 -6.175 1.00 3.02 C ATOM 0 H LEU A 56 12.741 6.853 -6.859 1.00 1.00 H new ATOM 0 HA LEU A 56 13.643 6.984 -4.275 1.00 0.83 H new ATOM 0 HB2 LEU A 56 15.021 6.268 -6.094 1.00 0.78 H new ATOM 0 HB3 LEU A 56 14.794 7.771 -6.966 1.00 0.78 H new ATOM 0 HG LEU A 56 16.161 8.987 -5.375 1.00 1.27 H new ATOM 0 HD11 LEU A 56 17.295 7.859 -3.495 1.00 2.11 H new ATOM 0 HD12 LEU A 56 15.525 7.818 -3.317 1.00 2.11 H new ATOM 0 HD13 LEU A 56 16.399 6.364 -3.856 1.00 2.11 H new ATOM 0 HD21 LEU A 56 18.333 7.813 -5.737 1.00 3.02 H new ATOM 0 HD22 LEU A 56 17.450 6.331 -6.170 1.00 3.02 H new ATOM 0 HD23 LEU A 56 17.322 7.776 -7.201 1.00 3.02 H new ATOM 891 N ASP A 57 13.636 10.001 -5.633 1.00 1.07 N ATOM 892 CA ASP A 57 13.557 11.441 -5.393 1.00 1.36 C ATOM 893 C ASP A 57 12.323 11.786 -4.560 1.00 1.50 C ATOM 894 O ASP A 57 12.452 12.399 -3.501 1.00 1.54 O ATOM 895 CB ASP A 57 13.573 12.236 -6.703 1.00 1.68 C ATOM 896 CG ASP A 57 13.314 13.710 -6.415 1.00 2.43 C ATOM 897 OD1 ASP A 57 14.307 14.417 -6.147 1.00 2.56 O ATOM 898 OD2 ASP A 57 12.123 14.090 -6.435 1.00 3.96 O ATOM 0 H ASP A 57 13.746 9.765 -6.619 1.00 1.07 H new ATOM 0 HA ASP A 57 14.444 11.728 -4.827 1.00 1.36 H new ATOM 0 HB2 ASP A 57 14.536 12.117 -7.200 1.00 1.68 H new ATOM 0 HB3 ASP A 57 12.814 11.850 -7.383 1.00 1.68 H new ATOM 903 N GLU A 58 11.143 11.348 -5.019 1.00 1.68 N ATOM 904 CA GLU A 58 9.866 11.553 -4.332 1.00 1.95 C ATOM 905 C GLU A 58 10.002 11.336 -2.818 1.00 1.69 C ATOM 906 O GLU A 58 9.523 12.153 -2.034 1.00 1.86 O ATOM 907 CB GLU A 58 8.770 10.650 -4.931 1.00 2.27 C ATOM 908 CG GLU A 58 7.625 11.407 -5.626 1.00 2.84 C ATOM 909 CD GLU A 58 6.606 11.981 -4.649 1.00 3.99 C ATOM 910 OE1 GLU A 58 7.044 12.752 -3.769 1.00 4.33 O ATOM 911 OE2 GLU A 58 5.410 11.630 -4.778 1.00 5.27 O ATOM 0 H GLU A 58 11.050 10.832 -5.894 1.00 1.68 H new ATOM 0 HA GLU A 58 9.568 12.590 -4.485 1.00 1.95 H new ATOM 0 HB2 GLU A 58 9.229 9.972 -5.651 1.00 2.27 H new ATOM 0 HB3 GLU A 58 8.350 10.034 -4.136 1.00 2.27 H new ATOM 0 HG2 GLU A 58 8.043 12.218 -6.223 1.00 2.84 H new ATOM 0 HG3 GLU A 58 7.118 10.732 -6.316 1.00 2.84 H new ATOM 918 N LYS A 59 10.672 10.255 -2.399 1.00 1.37 N ATOM 919 CA LYS A 59 10.952 10.043 -0.983 1.00 1.14 C ATOM 920 C LYS A 59 12.134 10.886 -0.511 1.00 0.77 C ATOM 921 O LYS A 59 11.972 11.703 0.391 1.00 0.67 O ATOM 922 CB LYS A 59 11.139 8.545 -0.694 1.00 1.38 C ATOM 923 CG LYS A 59 9.800 7.999 -0.176 1.00 1.11 C ATOM 924 CD LYS A 59 9.531 6.508 -0.417 1.00 1.23 C ATOM 925 CE LYS A 59 8.952 6.244 -1.786 1.00 1.72 C ATOM 926 NZ LYS A 59 9.813 6.648 -2.904 1.00 1.63 N ATOM 0 H LYS A 59 11.025 9.524 -3.017 1.00 1.37 H new ATOM 0 HA LYS A 59 10.092 10.381 -0.405 1.00 1.14 H new ATOM 0 HB2 LYS A 59 11.444 8.016 -1.597 1.00 1.38 H new ATOM 0 HB3 LYS A 59 11.926 8.393 0.045 1.00 1.38 H new ATOM 0 HG2 LYS A 59 9.747 8.187 0.896 1.00 1.11 H new ATOM 0 HG3 LYS A 59 8.996 8.570 -0.640 1.00 1.11 H new ATOM 0 HD2 LYS A 59 10.461 5.951 -0.305 1.00 1.23 H new ATOM 0 HD3 LYS A 59 8.843 6.138 0.343 1.00 1.23 H new ATOM 0 HE2 LYS A 59 8.738 5.179 -1.876 1.00 1.72 H new ATOM 0 HE3 LYS A 59 8.000 6.768 -1.870 1.00 1.72 H new ATOM 0 HZ1 LYS A 59 9.353 6.400 -3.803 1.00 1.63 H new ATOM 0 HZ2 LYS A 59 9.970 7.675 -2.867 1.00 1.63 H new ATOM 0 HZ3 LYS A 59 10.726 6.155 -2.835 1.00 1.63 H new ATOM 940 N MET A 60 13.311 10.672 -1.093 1.00 0.82 N ATOM 941 CA MET A 60 14.573 11.305 -0.720 1.00 0.70 C ATOM 942 C MET A 60 14.412 12.795 -0.400 1.00 0.74 C ATOM 943 O MET A 60 14.853 13.243 0.655 1.00 0.78 O ATOM 944 CB MET A 60 15.614 11.070 -1.822 1.00 0.84 C ATOM 945 CG MET A 60 17.001 11.593 -1.433 1.00 1.00 C ATOM 946 SD MET A 60 18.299 11.230 -2.644 1.00 1.75 S ATOM 947 CE MET A 60 19.710 12.009 -1.827 1.00 2.37 C ATOM 0 H MET A 60 13.416 10.023 -1.873 1.00 0.82 H new ATOM 0 HA MET A 60 14.923 10.840 0.202 1.00 0.70 H new ATOM 0 HB2 MET A 60 15.678 10.003 -2.037 1.00 0.84 H new ATOM 0 HB3 MET A 60 15.287 11.561 -2.738 1.00 0.84 H new ATOM 0 HG2 MET A 60 16.943 12.672 -1.292 1.00 1.00 H new ATOM 0 HG3 MET A 60 17.284 11.160 -0.473 1.00 1.00 H new ATOM 0 HE1 MET A 60 20.602 11.880 -2.440 1.00 2.37 H new ATOM 0 HE2 MET A 60 19.512 13.073 -1.694 1.00 2.37 H new ATOM 0 HE3 MET A 60 19.869 11.545 -0.854 1.00 2.37 H new ATOM 957 N LYS A 61 13.770 13.560 -1.286 1.00 0.87 N ATOM 958 CA LYS A 61 13.520 14.979 -1.068 1.00 1.01 C ATOM 959 C LYS A 61 12.769 15.192 0.256 1.00 0.86 C ATOM 960 O LYS A 61 13.131 16.004 1.101 1.00 0.97 O ATOM 961 CB LYS A 61 12.756 15.549 -2.279 1.00 1.41 C ATOM 962 CG LYS A 61 11.275 15.137 -2.287 1.00 2.15 C ATOM 963 CD LYS A 61 10.582 15.378 -3.619 1.00 2.60 C ATOM 964 CE LYS A 61 9.065 15.546 -3.436 1.00 4.56 C ATOM 965 NZ LYS A 61 8.431 14.496 -2.602 1.00 6.13 N ATOM 0 H LYS A 61 13.410 13.209 -2.174 1.00 0.87 H new ATOM 0 HA LYS A 61 14.463 15.519 -0.982 1.00 1.01 H new ATOM 0 HB2 LYS A 61 12.827 16.637 -2.270 1.00 1.41 H new ATOM 0 HB3 LYS A 61 13.230 15.206 -3.198 1.00 1.41 H new ATOM 0 HG2 LYS A 61 11.200 14.079 -2.034 1.00 2.15 H new ATOM 0 HG3 LYS A 61 10.749 15.689 -1.508 1.00 2.15 H new ATOM 0 HD2 LYS A 61 10.995 16.270 -4.090 1.00 2.60 H new ATOM 0 HD3 LYS A 61 10.779 14.542 -4.291 1.00 2.60 H new ATOM 0 HE2 LYS A 61 8.871 16.519 -2.984 1.00 4.56 H new ATOM 0 HE3 LYS A 61 8.591 15.550 -4.417 1.00 4.56 H new ATOM 0 HZ1 LYS A 61 7.466 14.316 -2.945 1.00 6.13 H new ATOM 0 HZ2 LYS A 61 8.989 13.620 -2.663 1.00 6.13 H new ATOM 0 HZ3 LYS A 61 8.393 14.814 -1.613 1.00 6.13 H new ATOM 979 N SER A 62 11.682 14.445 0.430 1.00 0.85 N ATOM 980 CA SER A 62 10.800 14.544 1.572 1.00 0.95 C ATOM 981 C SER A 62 11.496 14.053 2.846 1.00 0.95 C ATOM 982 O SER A 62 11.211 14.569 3.924 1.00 1.13 O ATOM 983 CB SER A 62 9.496 13.817 1.231 1.00 1.04 C ATOM 984 OG SER A 62 8.926 14.436 0.082 1.00 1.59 O ATOM 0 H SER A 62 11.389 13.737 -0.243 1.00 0.85 H new ATOM 0 HA SER A 62 10.545 15.581 1.789 1.00 0.95 H new ATOM 0 HB2 SER A 62 9.689 12.762 1.037 1.00 1.04 H new ATOM 0 HB3 SER A 62 8.803 13.865 2.071 1.00 1.04 H new ATOM 0 HG SER A 62 8.019 14.092 -0.059 1.00 1.59 H new ATOM 990 N LEU A 63 12.440 13.110 2.727 1.00 0.85 N ATOM 991 CA LEU A 63 13.373 12.825 3.810 1.00 1.01 C ATOM 992 C LEU A 63 14.164 14.114 4.095 1.00 1.02 C ATOM 993 O LEU A 63 14.070 14.652 5.195 1.00 1.12 O ATOM 994 CB LEU A 63 14.296 11.618 3.504 1.00 1.13 C ATOM 995 CG LEU A 63 13.775 10.201 3.773 1.00 1.40 C ATOM 996 CD1 LEU A 63 12.566 9.850 2.898 1.00 1.67 C ATOM 997 CD2 LEU A 63 14.953 9.261 3.475 1.00 2.12 C ATOM 0 H LEU A 63 12.573 12.537 1.893 1.00 0.85 H new ATOM 0 HA LEU A 63 12.820 12.525 4.700 1.00 1.01 H new ATOM 0 HB2 LEU A 63 14.573 11.673 2.451 1.00 1.13 H new ATOM 0 HB3 LEU A 63 15.211 11.748 4.082 1.00 1.13 H new ATOM 0 HG LEU A 63 13.427 10.110 4.802 1.00 1.40 H new ATOM 0 HD11 LEU A 63 12.234 8.837 3.126 1.00 1.67 H new ATOM 0 HD12 LEU A 63 11.756 10.551 3.099 1.00 1.67 H new ATOM 0 HD13 LEU A 63 12.847 9.912 1.847 1.00 1.67 H new ATOM 0 HD21 LEU A 63 14.648 8.229 3.648 1.00 2.12 H new ATOM 0 HD22 LEU A 63 15.259 9.380 2.436 1.00 2.12 H new ATOM 0 HD23 LEU A 63 15.789 9.506 4.130 1.00 2.12 H new ATOM 1009 N ASP A 64 14.905 14.636 3.111 1.00 1.00 N ATOM 1010 CA ASP A 64 15.757 15.818 3.273 1.00 1.15 C ATOM 1011 C ASP A 64 15.053 16.953 4.034 1.00 1.15 C ATOM 1012 O ASP A 64 15.625 17.512 4.969 1.00 1.33 O ATOM 1013 CB ASP A 64 16.285 16.283 1.910 1.00 1.20 C ATOM 1014 CG ASP A 64 17.162 17.518 2.052 1.00 1.49 C ATOM 1015 OD1 ASP A 64 18.379 17.328 2.258 1.00 1.88 O ATOM 1016 OD2 ASP A 64 16.597 18.626 1.936 1.00 2.58 O ATOM 0 H ASP A 64 14.930 14.245 2.169 1.00 1.00 H new ATOM 0 HA ASP A 64 16.608 15.530 3.890 1.00 1.15 H new ATOM 0 HB2 ASP A 64 16.856 15.480 1.445 1.00 1.20 H new ATOM 0 HB3 ASP A 64 15.447 16.503 1.248 1.00 1.20 H new ATOM 1021 N VAL A 65 13.793 17.237 3.675 1.00 1.02 N ATOM 1022 CA VAL A 65 12.973 18.276 4.304 1.00 1.07 C ATOM 1023 C VAL A 65 12.966 18.164 5.834 1.00 1.03 C ATOM 1024 O VAL A 65 13.479 19.039 6.525 1.00 1.15 O ATOM 1025 CB VAL A 65 11.538 18.234 3.742 1.00 1.19 C ATOM 1026 CG1 VAL A 65 10.564 19.149 4.498 1.00 1.84 C ATOM 1027 CG2 VAL A 65 11.532 18.683 2.285 1.00 1.88 C ATOM 0 H VAL A 65 13.309 16.741 2.926 1.00 1.02 H new ATOM 0 HA VAL A 65 13.421 19.240 4.062 1.00 1.07 H new ATOM 0 HB VAL A 65 11.209 17.201 3.853 1.00 1.19 H new ATOM 0 HG11 VAL A 65 9.572 19.072 4.052 1.00 1.84 H new ATOM 0 HG12 VAL A 65 10.516 18.845 5.544 1.00 1.84 H new ATOM 0 HG13 VAL A 65 10.911 20.180 4.436 1.00 1.84 H new ATOM 0 HG21 VAL A 65 10.514 18.649 1.898 1.00 1.88 H new ATOM 0 HG22 VAL A 65 11.913 19.702 2.217 1.00 1.88 H new ATOM 0 HG23 VAL A 65 12.165 18.019 1.697 1.00 1.88 H new ATOM 1037 N ASN A 66 12.315 17.124 6.362 1.00 0.94 N ATOM 1038 CA ASN A 66 12.179 16.917 7.812 1.00 0.95 C ATOM 1039 C ASN A 66 12.299 15.439 8.155 1.00 0.98 C ATOM 1040 O ASN A 66 11.393 14.856 8.752 1.00 1.11 O ATOM 1041 CB ASN A 66 10.856 17.490 8.364 1.00 1.11 C ATOM 1042 CG ASN A 66 10.898 19.005 8.544 1.00 1.44 C ATOM 1043 OD1 ASN A 66 11.743 19.529 9.262 1.00 2.10 O ATOM 1044 ND2 ASN A 66 9.971 19.732 7.926 1.00 2.34 N ATOM 0 H ASN A 66 11.867 16.401 5.800 1.00 0.94 H new ATOM 0 HA ASN A 66 12.993 17.462 8.290 1.00 0.95 H new ATOM 0 HB2 ASN A 66 10.042 17.232 7.686 1.00 1.11 H new ATOM 0 HB3 ASN A 66 10.634 17.021 9.322 1.00 1.11 H new ATOM 0 HD21 ASN A 66 9.954 20.745 8.045 1.00 2.34 H new ATOM 0 HD22 ASN A 66 9.277 19.277 7.333 1.00 2.34 H new ATOM 1051 N GLN A 67 13.434 14.825 7.811 1.00 1.01 N ATOM 1052 CA GLN A 67 13.569 13.385 7.949 1.00 1.14 C ATOM 1053 C GLN A 67 13.315 12.854 9.362 1.00 1.27 C ATOM 1054 O GLN A 67 12.986 11.682 9.537 1.00 1.49 O ATOM 1055 CB GLN A 67 14.915 12.839 7.472 1.00 1.23 C ATOM 1056 CG GLN A 67 16.117 13.642 8.001 1.00 1.28 C ATOM 1057 CD GLN A 67 16.562 14.681 6.980 1.00 2.14 C ATOM 1058 OE1 GLN A 67 17.211 14.328 6.001 1.00 2.98 O ATOM 1059 NE2 GLN A 67 16.203 15.947 7.183 1.00 2.66 N ATOM 0 H GLN A 67 14.258 15.300 7.441 1.00 1.01 H new ATOM 0 HA GLN A 67 12.779 13.020 7.293 1.00 1.14 H new ATOM 0 HB2 GLN A 67 15.012 11.801 7.790 1.00 1.23 H new ATOM 0 HB3 GLN A 67 14.935 12.842 6.382 1.00 1.23 H new ATOM 0 HG2 GLN A 67 15.848 14.135 8.935 1.00 1.28 H new ATOM 0 HG3 GLN A 67 16.943 12.966 8.223 1.00 1.28 H new ATOM 0 HE21 GLN A 67 15.663 16.197 8.011 1.00 2.66 H new ATOM 0 HE22 GLN A 67 16.468 16.666 6.510 1.00 2.66 H new ATOM 1068 N ASP A 68 13.548 13.708 10.355 1.00 1.22 N ATOM 1069 CA ASP A 68 13.290 13.430 11.751 1.00 1.31 C ATOM 1070 C ASP A 68 11.880 12.877 11.966 1.00 1.62 C ATOM 1071 O ASP A 68 11.698 11.880 12.665 1.00 2.16 O ATOM 1072 CB ASP A 68 13.492 14.743 12.529 1.00 1.23 C ATOM 1073 CG ASP A 68 12.685 14.795 13.822 1.00 2.13 C ATOM 1074 OD1 ASP A 68 11.527 15.266 13.733 1.00 3.45 O ATOM 1075 OD2 ASP A 68 13.243 14.373 14.855 1.00 3.01 O ATOM 0 H ASP A 68 13.933 14.639 10.198 1.00 1.22 H new ATOM 0 HA ASP A 68 13.977 12.663 12.109 1.00 1.31 H new ATOM 0 HB2 ASP A 68 14.550 14.863 12.762 1.00 1.23 H new ATOM 0 HB3 ASP A 68 13.208 15.583 11.895 1.00 1.23 H new ATOM 1080 N SER A 69 10.887 13.556 11.400 1.00 1.38 N ATOM 1081 CA SER A 69 9.535 13.488 11.918 1.00 1.46 C ATOM 1082 C SER A 69 8.901 12.111 11.717 1.00 1.51 C ATOM 1083 O SER A 69 9.287 11.358 10.821 1.00 2.61 O ATOM 1084 CB SER A 69 8.742 14.631 11.290 1.00 1.34 C ATOM 1085 OG SER A 69 9.473 15.828 11.522 1.00 2.50 O ATOM 0 H SER A 69 10.998 14.157 10.584 1.00 1.38 H new ATOM 0 HA SER A 69 9.537 13.614 13.001 1.00 1.46 H new ATOM 0 HB2 SER A 69 8.607 14.464 10.221 1.00 1.34 H new ATOM 0 HB3 SER A 69 7.747 14.696 11.731 1.00 1.34 H new ATOM 0 HG SER A 69 10.081 15.699 12.280 1.00 2.50 H new ATOM 1091 N GLU A 70 7.922 11.778 12.567 1.00 1.03 N ATOM 1092 CA GLU A 70 7.195 10.525 12.412 1.00 0.92 C ATOM 1093 C GLU A 70 6.307 10.680 11.179 1.00 0.84 C ATOM 1094 O GLU A 70 5.524 11.629 11.112 1.00 1.38 O ATOM 1095 CB GLU A 70 6.345 10.138 13.651 1.00 1.09 C ATOM 1096 CG GLU A 70 6.143 8.600 13.744 1.00 2.65 C ATOM 1097 CD GLU A 70 4.756 8.082 14.158 1.00 3.53 C ATOM 1098 OE1 GLU A 70 3.804 8.891 14.276 1.00 3.47 O ATOM 1099 OE2 GLU A 70 4.646 6.844 14.336 1.00 4.84 O ATOM 0 H GLU A 70 7.623 12.352 13.355 1.00 1.03 H new ATOM 0 HA GLU A 70 7.914 9.713 12.301 1.00 0.92 H new ATOM 0 HB2 GLU A 70 6.835 10.497 14.556 1.00 1.09 H new ATOM 0 HB3 GLU A 70 5.374 10.631 13.596 1.00 1.09 H new ATOM 0 HG2 GLU A 70 6.384 8.171 12.771 1.00 2.65 H new ATOM 0 HG3 GLU A 70 6.872 8.209 14.454 1.00 2.65 H new ATOM 1106 N LEU A 71 6.391 9.741 10.240 1.00 0.87 N ATOM 1107 CA LEU A 71 5.310 9.550 9.284 1.00 0.98 C ATOM 1108 C LEU A 71 4.273 8.677 9.984 1.00 0.82 C ATOM 1109 O LEU A 71 4.514 8.194 11.086 1.00 0.92 O ATOM 1110 CB LEU A 71 5.812 8.907 7.986 1.00 1.48 C ATOM 1111 CG LEU A 71 6.560 7.595 8.263 1.00 1.12 C ATOM 1112 CD1 LEU A 71 6.145 6.503 7.285 1.00 2.03 C ATOM 1113 CD2 LEU A 71 8.060 7.834 8.151 1.00 2.34 C ATOM 0 H LEU A 71 7.184 9.111 10.123 1.00 0.87 H new ATOM 0 HA LEU A 71 4.877 10.505 8.986 1.00 0.98 H new ATOM 0 HB2 LEU A 71 4.968 8.713 7.324 1.00 1.48 H new ATOM 0 HB3 LEU A 71 6.472 9.601 7.466 1.00 1.48 H new ATOM 0 HG LEU A 71 6.307 7.264 9.270 1.00 1.12 H new ATOM 0 HD11 LEU A 71 6.693 5.587 7.508 1.00 2.03 H new ATOM 0 HD12 LEU A 71 5.075 6.318 7.379 1.00 2.03 H new ATOM 0 HD13 LEU A 71 6.370 6.821 6.267 1.00 2.03 H new ATOM 0 HD21 LEU A 71 8.592 6.903 8.347 1.00 2.34 H new ATOM 0 HD22 LEU A 71 8.299 8.184 7.147 1.00 2.34 H new ATOM 0 HD23 LEU A 71 8.364 8.586 8.879 1.00 2.34 H new ATOM 1125 N LYS A 72 3.105 8.480 9.379 1.00 0.76 N ATOM 1126 CA LYS A 72 1.957 7.840 9.998 1.00 0.80 C ATOM 1127 C LYS A 72 1.327 6.909 8.971 1.00 0.82 C ATOM 1128 O LYS A 72 1.570 7.091 7.780 1.00 0.86 O ATOM 1129 CB LYS A 72 0.996 8.932 10.497 1.00 1.00 C ATOM 1130 CG LYS A 72 1.768 9.879 11.432 1.00 1.15 C ATOM 1131 CD LYS A 72 0.907 10.617 12.464 1.00 2.01 C ATOM 1132 CE LYS A 72 0.301 9.688 13.526 1.00 3.42 C ATOM 1133 NZ LYS A 72 1.208 8.580 13.886 1.00 4.80 N ATOM 0 H LYS A 72 2.930 8.771 8.417 1.00 0.76 H new ATOM 0 HA LYS A 72 2.234 7.239 10.864 1.00 0.80 H new ATOM 0 HB2 LYS A 72 0.584 9.487 9.654 1.00 1.00 H new ATOM 0 HB3 LYS A 72 0.155 8.483 11.025 1.00 1.00 H new ATOM 0 HG2 LYS A 72 2.528 9.303 11.961 1.00 1.15 H new ATOM 0 HG3 LYS A 72 2.292 10.617 10.825 1.00 1.15 H new ATOM 0 HD2 LYS A 72 1.515 11.375 12.958 1.00 2.01 H new ATOM 0 HD3 LYS A 72 0.102 11.141 11.948 1.00 2.01 H new ATOM 0 HE2 LYS A 72 0.065 10.266 14.419 1.00 3.42 H new ATOM 0 HE3 LYS A 72 -0.638 9.279 13.154 1.00 3.42 H new ATOM 0 HZ1 LYS A 72 0.817 8.061 14.698 1.00 4.80 H new ATOM 0 HZ2 LYS A 72 1.306 7.934 13.077 1.00 4.80 H new ATOM 0 HZ3 LYS A 72 2.141 8.963 14.138 1.00 4.80 H new ATOM 1147 N PHE A 73 0.550 5.916 9.411 1.00 0.94 N ATOM 1148 CA PHE A 73 0.100 4.793 8.575 1.00 1.03 C ATOM 1149 C PHE A 73 -0.360 5.209 7.165 1.00 1.01 C ATOM 1150 O PHE A 73 0.014 4.601 6.162 1.00 1.01 O ATOM 1151 CB PHE A 73 -0.996 3.994 9.298 1.00 1.31 C ATOM 1152 CG PHE A 73 -2.286 4.763 9.523 1.00 1.06 C ATOM 1153 CD1 PHE A 73 -2.385 5.696 10.573 1.00 2.33 C ATOM 1154 CD2 PHE A 73 -3.367 4.597 8.640 1.00 1.95 C ATOM 1155 CE1 PHE A 73 -3.551 6.461 10.736 1.00 2.79 C ATOM 1156 CE2 PHE A 73 -4.535 5.358 8.809 1.00 2.65 C ATOM 1157 CZ PHE A 73 -4.629 6.293 9.852 1.00 2.59 C ATOM 0 H PHE A 73 0.209 5.866 10.371 1.00 0.94 H new ATOM 0 HA PHE A 73 0.972 4.158 8.422 1.00 1.03 H new ATOM 0 HB2 PHE A 73 -1.218 3.098 8.719 1.00 1.31 H new ATOM 0 HB3 PHE A 73 -0.611 3.663 10.263 1.00 1.31 H new ATOM 0 HD1 PHE A 73 -1.559 5.824 11.257 1.00 2.33 H new ATOM 0 HD2 PHE A 73 -3.299 3.884 7.832 1.00 1.95 H new ATOM 0 HE1 PHE A 73 -3.619 7.178 11.541 1.00 2.79 H new ATOM 0 HE2 PHE A 73 -5.366 5.223 8.133 1.00 2.65 H new ATOM 0 HZ PHE A 73 -5.527 6.881 9.974 1.00 2.59 H new ATOM 1167 N ASN A 74 -1.187 6.251 7.092 1.00 1.09 N ATOM 1168 CA ASN A 74 -1.737 6.763 5.842 1.00 1.23 C ATOM 1169 C ASN A 74 -0.650 7.354 4.932 1.00 1.15 C ATOM 1170 O ASN A 74 -0.748 7.238 3.712 1.00 1.29 O ATOM 1171 CB ASN A 74 -2.859 7.770 6.120 1.00 1.48 C ATOM 1172 CG ASN A 74 -2.408 8.937 6.989 1.00 2.39 C ATOM 1173 OD1 ASN A 74 -1.999 9.974 6.485 1.00 2.47 O ATOM 1174 ND2 ASN A 74 -2.502 8.788 8.310 1.00 4.18 N ATOM 0 H ASN A 74 -1.497 6.770 7.914 1.00 1.09 H new ATOM 0 HA ASN A 74 -2.167 5.922 5.299 1.00 1.23 H new ATOM 0 HB2 ASN A 74 -3.238 8.154 5.173 1.00 1.48 H new ATOM 0 HB3 ASN A 74 -3.687 7.258 6.610 1.00 1.48 H new ATOM 0 HD21 ASN A 74 -2.229 9.551 8.930 1.00 4.18 H new ATOM 0 HD22 ASN A 74 -2.847 7.911 8.701 1.00 4.18 H new ATOM 1181 N GLU A 75 0.377 7.983 5.509 1.00 1.03 N ATOM 1182 CA GLU A 75 1.482 8.583 4.771 1.00 1.02 C ATOM 1183 C GLU A 75 2.501 7.511 4.372 1.00 0.89 C ATOM 1184 O GLU A 75 2.908 7.452 3.209 1.00 0.91 O ATOM 1185 CB GLU A 75 2.104 9.700 5.609 1.00 1.10 C ATOM 1186 CG GLU A 75 3.115 10.510 4.790 1.00 1.44 C ATOM 1187 CD GLU A 75 3.606 11.707 5.584 1.00 2.27 C ATOM 1188 OE1 GLU A 75 4.028 11.476 6.738 1.00 3.39 O ATOM 1189 OE2 GLU A 75 3.518 12.822 5.029 1.00 3.21 O ATOM 0 H GLU A 75 0.462 8.089 6.520 1.00 1.03 H new ATOM 0 HA GLU A 75 1.116 9.027 3.845 1.00 1.02 H new ATOM 0 HB2 GLU A 75 1.320 10.360 5.979 1.00 1.10 H new ATOM 0 HB3 GLU A 75 2.598 9.272 6.481 1.00 1.10 H new ATOM 0 HG2 GLU A 75 3.959 9.878 4.515 1.00 1.44 H new ATOM 0 HG3 GLU A 75 2.653 10.847 3.862 1.00 1.44 H new ATOM 1196 N TYR A 76 2.847 6.622 5.319 1.00 0.81 N ATOM 1197 CA TYR A 76 3.579 5.378 5.060 1.00 0.79 C ATOM 1198 C TYR A 76 3.063 4.784 3.755 1.00 0.76 C ATOM 1199 O TYR A 76 3.842 4.421 2.875 1.00 0.77 O ATOM 1200 CB TYR A 76 3.379 4.376 6.218 1.00 0.82 C ATOM 1201 CG TYR A 76 3.670 2.923 5.886 1.00 0.96 C ATOM 1202 CD1 TYR A 76 2.671 2.119 5.303 1.00 2.21 C ATOM 1203 CD2 TYR A 76 4.932 2.367 6.167 1.00 1.61 C ATOM 1204 CE1 TYR A 76 2.957 0.793 4.943 1.00 2.37 C ATOM 1205 CE2 TYR A 76 5.223 1.047 5.781 1.00 1.65 C ATOM 1206 CZ TYR A 76 4.238 0.264 5.154 1.00 1.36 C ATOM 1207 OH TYR A 76 4.529 -0.986 4.691 1.00 1.69 O ATOM 0 H TYR A 76 2.619 6.754 6.304 1.00 0.81 H new ATOM 0 HA TYR A 76 4.646 5.588 4.983 1.00 0.79 H new ATOM 0 HB2 TYR A 76 4.019 4.675 7.048 1.00 0.82 H new ATOM 0 HB3 TYR A 76 2.349 4.451 6.566 1.00 0.82 H new ATOM 0 HD1 TYR A 76 1.684 2.523 5.133 1.00 2.21 H new ATOM 0 HD2 TYR A 76 5.678 2.956 6.680 1.00 1.61 H new ATOM 0 HE1 TYR A 76 2.187 0.178 4.502 1.00 2.37 H new ATOM 0 HE2 TYR A 76 6.204 0.634 5.966 1.00 1.65 H new ATOM 0 HH TYR A 76 5.486 -1.163 4.806 1.00 1.69 H new ATOM 1217 N TRP A 77 1.735 4.727 3.649 1.00 0.75 N ATOM 1218 CA TRP A 77 1.059 4.257 2.470 1.00 0.74 C ATOM 1219 C TRP A 77 1.570 4.947 1.204 1.00 0.77 C ATOM 1220 O TRP A 77 2.307 4.335 0.439 1.00 0.76 O ATOM 1221 CB TRP A 77 -0.451 4.409 2.658 1.00 0.78 C ATOM 1222 CG TRP A 77 -1.152 3.222 2.170 1.00 0.73 C ATOM 1223 CD1 TRP A 77 -1.437 3.009 0.879 1.00 0.72 C ATOM 1224 CD2 TRP A 77 -1.697 2.108 2.918 1.00 0.70 C ATOM 1225 NE1 TRP A 77 -2.041 1.793 0.752 1.00 0.68 N ATOM 1226 CE2 TRP A 77 -2.302 1.230 1.980 1.00 0.68 C ATOM 1227 CE3 TRP A 77 -1.815 1.785 4.286 1.00 0.71 C ATOM 1228 CZ2 TRP A 77 -3.023 0.106 2.375 1.00 0.69 C ATOM 1229 CZ3 TRP A 77 -2.532 0.642 4.683 1.00 0.70 C ATOM 1230 CH2 TRP A 77 -3.099 -0.209 3.733 1.00 0.69 C ATOM 0 H TRP A 77 1.103 5.013 4.397 1.00 0.75 H new ATOM 0 HA TRP A 77 1.280 3.199 2.331 1.00 0.74 H new ATOM 0 HB2 TRP A 77 -0.678 4.564 3.713 1.00 0.78 H new ATOM 0 HB3 TRP A 77 -0.803 5.291 2.123 1.00 0.78 H new ATOM 0 HD1 TRP A 77 -1.223 3.690 0.069 1.00 0.72 H new ATOM 0 HE1 TRP A 77 -2.270 1.356 -0.141 1.00 0.68 H new ATOM 0 HE3 TRP A 77 -1.354 2.417 5.030 1.00 0.71 H new ATOM 0 HZ2 TRP A 77 -3.517 -0.514 1.641 1.00 0.69 H new ATOM 0 HZ3 TRP A 77 -2.645 0.420 5.734 1.00 0.70 H new ATOM 0 HH2 TRP A 77 -3.598 -1.113 4.049 1.00 0.69 H new ATOM 1241 N ARG A 78 1.147 6.194 0.952 1.00 0.85 N ATOM 1242 CA ARG A 78 1.537 6.992 -0.205 1.00 0.96 C ATOM 1243 C ARG A 78 3.041 6.824 -0.499 1.00 0.93 C ATOM 1244 O ARG A 78 3.436 6.675 -1.656 1.00 0.99 O ATOM 1245 CB ARG A 78 1.177 8.473 0.069 1.00 1.15 C ATOM 1246 CG ARG A 78 -0.182 8.664 0.778 1.00 2.09 C ATOM 1247 CD ARG A 78 -0.977 9.914 0.374 1.00 2.73 C ATOM 1248 NE ARG A 78 -0.546 11.123 1.089 1.00 3.06 N ATOM 1249 CZ ARG A 78 -1.238 12.277 1.104 1.00 4.02 C ATOM 1250 NH1 ARG A 78 -2.402 12.392 0.453 1.00 4.91 N ATOM 1251 NH2 ARG A 78 -0.751 13.325 1.778 1.00 4.55 N ATOM 0 H ARG A 78 0.503 6.685 1.572 1.00 0.85 H new ATOM 0 HA ARG A 78 0.998 6.651 -1.089 1.00 0.96 H new ATOM 0 HB2 ARG A 78 1.961 8.921 0.680 1.00 1.15 H new ATOM 0 HB3 ARG A 78 1.162 9.014 -0.877 1.00 1.15 H new ATOM 0 HG2 ARG A 78 -0.798 7.786 0.584 1.00 2.09 H new ATOM 0 HG3 ARG A 78 -0.008 8.699 1.853 1.00 2.09 H new ATOM 0 HD2 ARG A 78 -0.870 10.075 -0.699 1.00 2.73 H new ATOM 0 HD3 ARG A 78 -2.036 9.743 0.567 1.00 2.73 H new ATOM 0 HE ARG A 78 0.332 11.085 1.606 1.00 3.06 H new ATOM 0 HH11 ARG A 78 -2.777 11.597 -0.065 1.00 4.91 H new ATOM 0 HH12 ARG A 78 -2.914 13.274 0.475 1.00 4.91 H new ATOM 0 HH21 ARG A 78 0.137 13.245 2.274 1.00 4.55 H new ATOM 0 HH22 ARG A 78 -1.267 14.204 1.796 1.00 4.55 H new ATOM 1265 N LEU A 79 3.881 6.809 0.548 1.00 0.89 N ATOM 1266 CA LEU A 79 5.315 6.585 0.395 1.00 0.89 C ATOM 1267 C LEU A 79 5.663 5.191 -0.163 1.00 0.85 C ATOM 1268 O LEU A 79 6.313 5.124 -1.209 1.00 0.96 O ATOM 1269 CB LEU A 79 6.059 6.869 1.704 1.00 0.91 C ATOM 1270 CG LEU A 79 6.434 8.343 1.941 1.00 0.95 C ATOM 1271 CD1 LEU A 79 5.320 9.350 1.636 1.00 1.08 C ATOM 1272 CD2 LEU A 79 6.885 8.512 3.396 1.00 1.06 C ATOM 0 H LEU A 79 3.583 6.951 1.513 1.00 0.89 H new ATOM 0 HA LEU A 79 5.656 7.297 -0.357 1.00 0.89 H new ATOM 0 HB2 LEU A 79 5.440 6.530 2.535 1.00 0.91 H new ATOM 0 HB3 LEU A 79 6.971 6.272 1.721 1.00 0.91 H new ATOM 0 HG LEU A 79 7.234 8.568 1.236 1.00 0.95 H new ATOM 0 HD11 LEU A 79 5.679 10.360 1.833 1.00 1.08 H new ATOM 0 HD12 LEU A 79 5.030 9.266 0.589 1.00 1.08 H new ATOM 0 HD13 LEU A 79 4.458 9.141 2.269 1.00 1.08 H new ATOM 0 HD21 LEU A 79 7.153 9.553 3.575 1.00 1.06 H new ATOM 0 HD22 LEU A 79 6.073 8.226 4.064 1.00 1.06 H new ATOM 0 HD23 LEU A 79 7.750 7.877 3.585 1.00 1.06 H new ATOM 1284 N ILE A 80 5.291 4.067 0.474 1.00 0.75 N ATOM 1285 CA ILE A 80 5.584 2.763 -0.147 1.00 0.71 C ATOM 1286 C ILE A 80 4.957 2.703 -1.540 1.00 0.74 C ATOM 1287 O ILE A 80 5.490 2.064 -2.438 1.00 0.74 O ATOM 1288 CB ILE A 80 5.217 1.507 0.675 1.00 0.66 C ATOM 1289 CG1 ILE A 80 3.732 1.152 0.593 1.00 0.74 C ATOM 1290 CG2 ILE A 80 5.709 1.559 2.113 1.00 0.63 C ATOM 1291 CD1 ILE A 80 3.342 -0.159 1.277 1.00 0.68 C ATOM 0 H ILE A 80 4.811 4.030 1.373 1.00 0.75 H new ATOM 0 HA ILE A 80 6.672 2.721 -0.201 1.00 0.71 H new ATOM 0 HB ILE A 80 5.761 0.692 0.198 1.00 0.66 H new ATOM 0 HG12 ILE A 80 3.155 1.962 1.039 1.00 0.74 H new ATOM 0 HG13 ILE A 80 3.445 1.096 -0.457 1.00 0.74 H new ATOM 0 HG21 ILE A 80 5.416 0.646 2.631 1.00 0.63 H new ATOM 0 HG22 ILE A 80 6.795 1.650 2.123 1.00 0.63 H new ATOM 0 HG23 ILE A 80 5.269 2.419 2.617 1.00 0.63 H new ATOM 0 HD11 ILE A 80 2.270 -0.323 1.165 1.00 0.68 H new ATOM 0 HD12 ILE A 80 3.886 -0.985 0.818 1.00 0.68 H new ATOM 0 HD13 ILE A 80 3.592 -0.105 2.337 1.00 0.68 H new ATOM 1303 N GLY A 81 3.832 3.390 -1.724 1.00 0.79 N ATOM 1304 CA GLY A 81 3.228 3.606 -3.019 1.00 0.87 C ATOM 1305 C GLY A 81 4.225 4.053 -4.072 1.00 0.85 C ATOM 1306 O GLY A 81 4.192 3.551 -5.194 1.00 1.03 O ATOM 0 H GLY A 81 3.312 3.817 -0.957 1.00 0.79 H new ATOM 0 HA2 GLY A 81 2.749 2.684 -3.349 1.00 0.87 H new ATOM 0 HA3 GLY A 81 2.444 4.357 -2.927 1.00 0.87 H new ATOM 1310 N GLU A 82 5.133 4.974 -3.734 1.00 0.69 N ATOM 1311 CA GLU A 82 6.109 5.377 -4.719 1.00 0.67 C ATOM 1312 C GLU A 82 7.163 4.279 -4.839 1.00 0.68 C ATOM 1313 O GLU A 82 7.569 3.958 -5.952 1.00 0.76 O ATOM 1314 CB GLU A 82 6.630 6.776 -4.378 1.00 0.62 C ATOM 1315 CG GLU A 82 5.693 7.848 -4.943 1.00 0.96 C ATOM 1316 CD GLU A 82 5.764 7.901 -6.459 1.00 2.97 C ATOM 1317 OE1 GLU A 82 6.888 7.794 -6.987 1.00 3.99 O ATOM 1318 OE2 GLU A 82 4.708 8.018 -7.110 1.00 4.35 O ATOM 0 H GLU A 82 5.204 5.430 -2.825 1.00 0.69 H new ATOM 0 HA GLU A 82 5.681 5.479 -5.716 1.00 0.67 H new ATOM 0 HB2 GLU A 82 6.710 6.887 -3.297 1.00 0.62 H new ATOM 0 HB3 GLU A 82 7.632 6.907 -4.787 1.00 0.62 H new ATOM 0 HG2 GLU A 82 4.669 7.639 -4.632 1.00 0.96 H new ATOM 0 HG3 GLU A 82 5.960 8.821 -4.530 1.00 0.96 H new ATOM 1325 N LEU A 83 7.556 3.646 -3.726 1.00 0.65 N ATOM 1326 CA LEU A 83 8.462 2.499 -3.745 1.00 0.72 C ATOM 1327 C LEU A 83 7.999 1.434 -4.755 1.00 0.80 C ATOM 1328 O LEU A 83 8.796 0.917 -5.537 1.00 0.87 O ATOM 1329 CB LEU A 83 8.596 1.916 -2.334 1.00 0.85 C ATOM 1330 CG LEU A 83 9.886 1.115 -2.127 1.00 1.01 C ATOM 1331 CD1 LEU A 83 11.083 2.038 -1.864 1.00 2.07 C ATOM 1332 CD2 LEU A 83 9.673 0.221 -0.908 1.00 2.31 C ATOM 0 H LEU A 83 7.253 3.917 -2.790 1.00 0.65 H new ATOM 0 HA LEU A 83 9.445 2.838 -4.072 1.00 0.72 H new ATOM 0 HB2 LEU A 83 8.561 2.729 -1.608 1.00 0.85 H new ATOM 0 HB3 LEU A 83 7.740 1.271 -2.132 1.00 0.85 H new ATOM 0 HG LEU A 83 10.102 0.536 -3.025 1.00 1.01 H new ATOM 0 HD11 LEU A 83 11.981 1.437 -1.722 1.00 2.07 H new ATOM 0 HD12 LEU A 83 11.223 2.704 -2.716 1.00 2.07 H new ATOM 0 HD13 LEU A 83 10.896 2.629 -0.968 1.00 2.07 H new ATOM 0 HD21 LEU A 83 10.572 -0.368 -0.727 1.00 2.31 H new ATOM 0 HD22 LEU A 83 9.462 0.840 -0.036 1.00 2.31 H new ATOM 0 HD23 LEU A 83 8.832 -0.448 -1.090 1.00 2.31 H new ATOM 1344 N ALA A 84 6.697 1.124 -4.755 1.00 0.85 N ATOM 1345 CA ALA A 84 6.089 0.201 -5.694 1.00 1.01 C ATOM 1346 C ALA A 84 6.422 0.515 -7.157 1.00 0.98 C ATOM 1347 O ALA A 84 6.601 -0.427 -7.920 1.00 1.22 O ATOM 1348 CB ALA A 84 4.575 0.142 -5.472 1.00 1.07 C ATOM 0 H ALA A 84 6.034 1.519 -4.088 1.00 0.85 H new ATOM 0 HA ALA A 84 6.520 -0.781 -5.496 1.00 1.01 H new ATOM 0 HB1 ALA A 84 4.130 -0.554 -6.183 1.00 1.07 H new ATOM 0 HB2 ALA A 84 4.369 -0.195 -4.456 1.00 1.07 H new ATOM 0 HB3 ALA A 84 4.147 1.134 -5.619 1.00 1.07 H new ATOM 1354 N LYS A 85 6.448 1.791 -7.576 1.00 0.82 N ATOM 1355 CA LYS A 85 6.885 2.157 -8.929 1.00 0.91 C ATOM 1356 C LYS A 85 8.415 2.306 -9.059 1.00 0.88 C ATOM 1357 O LYS A 85 8.971 1.969 -10.107 1.00 1.02 O ATOM 1358 CB LYS A 85 6.036 3.294 -9.524 1.00 1.30 C ATOM 1359 CG LYS A 85 6.469 4.703 -9.126 1.00 1.21 C ATOM 1360 CD LYS A 85 5.538 5.768 -9.728 1.00 1.78 C ATOM 1361 CE LYS A 85 6.272 6.927 -10.419 1.00 1.76 C ATOM 1362 NZ LYS A 85 7.173 7.650 -9.501 1.00 2.54 N ATOM 0 H LYS A 85 6.172 2.584 -6.997 1.00 0.82 H new ATOM 0 HA LYS A 85 6.679 1.308 -9.581 1.00 0.91 H new ATOM 0 HB2 LYS A 85 6.063 3.216 -10.611 1.00 1.30 H new ATOM 0 HB3 LYS A 85 4.999 3.150 -9.220 1.00 1.30 H new ATOM 0 HG2 LYS A 85 6.471 4.791 -8.040 1.00 1.21 H new ATOM 0 HG3 LYS A 85 7.491 4.879 -9.462 1.00 1.21 H new ATOM 0 HD2 LYS A 85 4.876 5.290 -10.450 1.00 1.78 H new ATOM 0 HD3 LYS A 85 4.907 6.173 -8.936 1.00 1.78 H new ATOM 0 HE2 LYS A 85 6.849 6.539 -11.259 1.00 1.76 H new ATOM 0 HE3 LYS A 85 5.541 7.623 -10.829 1.00 1.76 H new ATOM 0 HZ1 LYS A 85 7.567 8.482 -9.985 1.00 2.54 H new ATOM 0 HZ2 LYS A 85 6.640 7.957 -8.662 1.00 2.54 H new ATOM 0 HZ3 LYS A 85 7.948 7.021 -9.208 1.00 2.54 H new ATOM 1376 N GLU A 86 9.088 2.807 -8.007 1.00 0.82 N ATOM 1377 CA GLU A 86 10.552 2.849 -7.833 1.00 0.93 C ATOM 1378 C GLU A 86 11.110 1.534 -8.370 1.00 0.87 C ATOM 1379 O GLU A 86 11.724 1.525 -9.432 1.00 0.94 O ATOM 1380 CB GLU A 86 10.889 3.099 -6.340 1.00 1.12 C ATOM 1381 CG GLU A 86 12.216 3.779 -5.943 1.00 1.66 C ATOM 1382 CD GLU A 86 12.175 4.406 -4.547 1.00 1.83 C ATOM 1383 OE1 GLU A 86 11.153 5.075 -4.275 1.00 1.79 O ATOM 1384 OE2 GLU A 86 13.132 4.235 -3.759 1.00 2.97 O ATOM 0 H GLU A 86 8.598 3.216 -7.211 1.00 0.82 H new ATOM 0 HA GLU A 86 11.012 3.668 -8.386 1.00 0.93 H new ATOM 0 HB2 GLU A 86 10.081 3.701 -5.924 1.00 1.12 H new ATOM 0 HB3 GLU A 86 10.859 2.133 -5.837 1.00 1.12 H new ATOM 0 HG2 GLU A 86 13.020 3.044 -5.981 1.00 1.66 H new ATOM 0 HG3 GLU A 86 12.455 4.551 -6.675 1.00 1.66 H new ATOM 1391 N ILE A 87 10.805 0.407 -7.732 1.00 0.87 N ATOM 1392 CA ILE A 87 11.049 -0.895 -8.333 1.00 1.01 C ATOM 1393 C ILE A 87 9.914 -1.271 -9.289 1.00 1.10 C ATOM 1394 O ILE A 87 8.853 -1.712 -8.860 1.00 1.29 O ATOM 1395 CB ILE A 87 11.324 -1.957 -7.259 1.00 1.28 C ATOM 1396 CG1 ILE A 87 11.250 -3.389 -7.827 1.00 2.27 C ATOM 1397 CG2 ILE A 87 10.439 -1.818 -6.015 1.00 1.34 C ATOM 1398 CD1 ILE A 87 12.270 -3.635 -8.947 1.00 1.84 C ATOM 0 H ILE A 87 10.389 0.372 -6.801 1.00 0.87 H new ATOM 0 HA ILE A 87 11.954 -0.843 -8.938 1.00 1.01 H new ATOM 0 HB ILE A 87 12.347 -1.771 -6.933 1.00 1.28 H new ATOM 0 HG12 ILE A 87 11.421 -4.104 -7.022 1.00 2.27 H new ATOM 0 HG13 ILE A 87 10.246 -3.573 -8.209 1.00 2.27 H new ATOM 0 HG21 ILE A 87 10.690 -2.602 -5.300 1.00 1.34 H new ATOM 0 HG22 ILE A 87 10.605 -0.843 -5.557 1.00 1.34 H new ATOM 0 HG23 ILE A 87 9.391 -1.910 -6.302 1.00 1.34 H new ATOM 0 HD11 ILE A 87 12.173 -4.658 -9.309 1.00 1.84 H new ATOM 0 HD12 ILE A 87 12.085 -2.941 -9.767 1.00 1.84 H new ATOM 0 HD13 ILE A 87 13.278 -3.481 -8.562 1.00 1.84 H new ATOM 1410 N ARG A 88 10.185 -1.237 -10.598 1.00 1.08 N ATOM 1411 CA ARG A 88 9.274 -1.813 -11.574 1.00 1.16 C ATOM 1412 C ARG A 88 9.544 -3.318 -11.566 1.00 1.19 C ATOM 1413 O ARG A 88 10.454 -3.803 -12.234 1.00 1.24 O ATOM 1414 CB ARG A 88 9.505 -1.189 -12.961 1.00 1.26 C ATOM 1415 CG ARG A 88 8.495 -1.737 -13.981 1.00 2.23 C ATOM 1416 CD ARG A 88 8.719 -1.127 -15.371 1.00 2.38 C ATOM 1417 NE ARG A 88 7.743 -1.657 -16.338 1.00 3.67 N ATOM 1418 CZ ARG A 88 7.709 -1.357 -17.647 1.00 4.24 C ATOM 1419 NH1 ARG A 88 8.614 -0.517 -18.161 1.00 3.66 N ATOM 1420 NH2 ARG A 88 6.772 -1.896 -18.435 1.00 5.70 N ATOM 0 H ARG A 88 11.025 -0.818 -10.998 1.00 1.08 H new ATOM 0 HA ARG A 88 8.231 -1.613 -11.328 1.00 1.16 H new ATOM 0 HB2 ARG A 88 9.412 -0.105 -12.897 1.00 1.26 H new ATOM 0 HB3 ARG A 88 10.520 -1.403 -13.296 1.00 1.26 H new ATOM 0 HG2 ARG A 88 8.586 -2.822 -14.039 1.00 2.23 H new ATOM 0 HG3 ARG A 88 7.481 -1.519 -13.645 1.00 2.23 H new ATOM 0 HD2 ARG A 88 8.630 -0.042 -15.316 1.00 2.38 H new ATOM 0 HD3 ARG A 88 9.731 -1.347 -15.711 1.00 2.38 H new ATOM 0 HE ARG A 88 7.037 -2.303 -15.986 1.00 3.67 H new ATOM 0 HH11 ARG A 88 9.328 -0.106 -17.559 1.00 3.66 H new ATOM 0 HH12 ARG A 88 8.590 -0.288 -19.155 1.00 3.66 H new ATOM 0 HH21 ARG A 88 6.082 -2.536 -18.042 1.00 5.70 H new ATOM 0 HH22 ARG A 88 6.748 -1.667 -19.429 1.00 5.70 H new ATOM 1434 N LYS A 89 8.776 -4.036 -10.743 1.00 1.39 N ATOM 1435 CA LYS A 89 8.899 -5.481 -10.578 1.00 1.40 C ATOM 1436 C LYS A 89 8.685 -6.168 -11.937 1.00 1.50 C ATOM 1437 O LYS A 89 7.939 -5.662 -12.774 1.00 2.13 O ATOM 1438 CB LYS A 89 7.886 -6.031 -9.549 1.00 1.81 C ATOM 1439 CG LYS A 89 7.988 -5.504 -8.082 1.00 1.28 C ATOM 1440 CD LYS A 89 6.831 -4.978 -7.178 1.00 1.76 C ATOM 1441 CE LYS A 89 7.124 -3.683 -6.397 1.00 2.04 C ATOM 1442 NZ LYS A 89 8.078 -3.893 -5.288 1.00 2.63 N ATOM 0 H LYS A 89 8.043 -3.622 -10.167 1.00 1.39 H new ATOM 0 HA LYS A 89 9.899 -5.694 -10.201 1.00 1.40 H new ATOM 0 HB2 LYS A 89 6.883 -5.813 -9.915 1.00 1.81 H new ATOM 0 HB3 LYS A 89 7.988 -7.116 -9.524 1.00 1.81 H new ATOM 0 HG2 LYS A 89 8.446 -6.316 -7.517 1.00 1.28 H new ATOM 0 HG3 LYS A 89 8.714 -4.692 -8.119 1.00 1.28 H new ATOM 0 HD2 LYS A 89 5.954 -4.812 -7.803 1.00 1.76 H new ATOM 0 HD3 LYS A 89 6.570 -5.759 -6.464 1.00 1.76 H new ATOM 0 HE2 LYS A 89 7.525 -2.934 -7.080 1.00 2.04 H new ATOM 0 HE3 LYS A 89 6.191 -3.284 -5.999 1.00 2.04 H new ATOM 0 HZ1 LYS A 89 8.254 -2.989 -4.806 1.00 2.63 H new ATOM 0 HZ2 LYS A 89 7.679 -4.575 -4.611 1.00 2.63 H new ATOM 0 HZ3 LYS A 89 8.973 -4.264 -5.666 1.00 2.63 H new ATOM 1456 N LYS A 90 9.320 -7.326 -12.150 1.00 1.67 N ATOM 1457 CA LYS A 90 9.153 -8.092 -13.382 1.00 2.00 C ATOM 1458 C LYS A 90 7.759 -8.731 -13.405 1.00 2.18 C ATOM 1459 O LYS A 90 6.939 -8.437 -14.271 1.00 2.99 O ATOM 1460 CB LYS A 90 10.260 -9.153 -13.503 1.00 2.80 C ATOM 1461 CG LYS A 90 11.667 -8.539 -13.503 1.00 3.56 C ATOM 1462 CD LYS A 90 12.698 -9.630 -13.832 1.00 4.67 C ATOM 1463 CE LYS A 90 14.147 -9.123 -13.779 1.00 5.89 C ATOM 1464 NZ LYS A 90 14.606 -8.856 -12.399 1.00 7.35 N ATOM 0 H LYS A 90 9.958 -7.752 -11.478 1.00 1.67 H new ATOM 0 HA LYS A 90 9.239 -7.426 -14.241 1.00 2.00 H new ATOM 0 HB2 LYS A 90 10.175 -9.858 -12.676 1.00 2.80 H new ATOM 0 HB3 LYS A 90 10.115 -9.721 -14.422 1.00 2.80 H new ATOM 0 HG2 LYS A 90 11.725 -7.735 -14.236 1.00 3.56 H new ATOM 0 HG3 LYS A 90 11.884 -8.099 -12.530 1.00 3.56 H new ATOM 0 HD2 LYS A 90 12.582 -10.455 -13.130 1.00 4.67 H new ATOM 0 HD3 LYS A 90 12.494 -10.027 -14.827 1.00 4.67 H new ATOM 0 HE2 LYS A 90 14.803 -9.861 -14.240 1.00 5.89 H new ATOM 0 HE3 LYS A 90 14.230 -8.210 -14.369 1.00 5.89 H new ATOM 0 HZ1 LYS A 90 15.589 -8.517 -12.420 1.00 7.35 H new ATOM 0 HZ2 LYS A 90 13.999 -8.132 -11.965 1.00 7.35 H new ATOM 0 HZ3 LYS A 90 14.554 -9.732 -11.840 1.00 7.35 H new ATOM 1478 N LYS A 91 7.506 -9.597 -12.423 1.00 2.23 N ATOM 1479 CA LYS A 91 6.199 -10.180 -12.132 1.00 3.02 C ATOM 1480 C LYS A 91 6.182 -10.667 -10.679 1.00 3.24 C ATOM 1481 O LYS A 91 5.184 -10.481 -9.990 1.00 3.79 O ATOM 1482 CB LYS A 91 5.827 -11.301 -13.125 1.00 3.77 C ATOM 1483 CG LYS A 91 4.341 -11.681 -12.986 1.00 5.23 C ATOM 1484 CD LYS A 91 3.916 -12.759 -14.001 1.00 5.94 C ATOM 1485 CE LYS A 91 2.492 -13.289 -13.740 1.00 7.34 C ATOM 1486 NZ LYS A 91 1.429 -12.295 -14.012 1.00 8.64 N ATOM 0 H LYS A 91 8.233 -9.922 -11.786 1.00 2.23 H new ATOM 0 HA LYS A 91 5.435 -9.413 -12.257 1.00 3.02 H new ATOM 0 HB2 LYS A 91 6.030 -10.972 -14.144 1.00 3.77 H new ATOM 0 HB3 LYS A 91 6.450 -12.177 -12.943 1.00 3.77 H new ATOM 0 HG2 LYS A 91 4.154 -12.043 -11.975 1.00 5.23 H new ATOM 0 HG3 LYS A 91 3.726 -10.792 -13.125 1.00 5.23 H new ATOM 0 HD2 LYS A 91 3.967 -12.345 -15.008 1.00 5.94 H new ATOM 0 HD3 LYS A 91 4.622 -13.589 -13.961 1.00 5.94 H new ATOM 0 HE2 LYS A 91 2.322 -14.169 -14.360 1.00 7.34 H new ATOM 0 HE3 LYS A 91 2.418 -13.612 -12.702 1.00 7.34 H new ATOM 0 HZ1 LYS A 91 0.575 -12.544 -13.474 1.00 8.64 H new ATOM 0 HZ2 LYS A 91 1.756 -11.350 -13.725 1.00 8.64 H new ATOM 0 HZ3 LYS A 91 1.209 -12.291 -15.028 1.00 8.64 H new ATOM 1500 N ASP A 92 7.298 -11.245 -10.217 1.00 3.02 N ATOM 1501 CA ASP A 92 7.598 -11.567 -8.849 1.00 3.39 C ATOM 1502 C ASP A 92 9.001 -11.007 -8.611 1.00 2.41 C ATOM 1503 O ASP A 92 9.869 -11.073 -9.484 1.00 2.63 O ATOM 1504 CB ASP A 92 7.581 -13.078 -8.615 1.00 4.33 C ATOM 1505 CG ASP A 92 8.354 -13.371 -7.344 1.00 5.65 C ATOM 1506 OD1 ASP A 92 7.948 -12.835 -6.290 1.00 7.32 O ATOM 1507 OD2 ASP A 92 9.428 -14.008 -7.464 1.00 5.79 O ATOM 0 H ASP A 92 8.056 -11.511 -10.846 1.00 3.02 H new ATOM 0 HA ASP A 92 6.859 -11.145 -8.168 1.00 3.39 H new ATOM 0 HB2 ASP A 92 6.556 -13.437 -8.527 1.00 4.33 H new ATOM 0 HB3 ASP A 92 8.030 -13.598 -9.461 1.00 4.33 H new ATOM 1512 N LEU A 93 9.137 -10.368 -7.463 1.00 2.09 N ATOM 1513 CA LEU A 93 10.356 -9.904 -6.811 1.00 1.55 C ATOM 1514 C LEU A 93 11.103 -10.992 -6.001 1.00 1.30 C ATOM 1515 O LEU A 93 12.333 -10.995 -5.982 1.00 1.29 O ATOM 1516 CB LEU A 93 10.082 -8.585 -6.069 1.00 2.16 C ATOM 1517 CG LEU A 93 8.680 -8.424 -5.446 1.00 1.86 C ATOM 1518 CD1 LEU A 93 8.413 -9.430 -4.339 1.00 2.88 C ATOM 1519 CD2 LEU A 93 8.565 -7.017 -4.869 1.00 3.40 C ATOM 0 H LEU A 93 8.315 -10.136 -6.905 1.00 2.09 H new ATOM 0 HA LEU A 93 11.091 -9.678 -7.583 1.00 1.55 H new ATOM 0 HB2 LEU A 93 10.822 -8.480 -5.276 1.00 2.16 H new ATOM 0 HB3 LEU A 93 10.242 -7.762 -6.766 1.00 2.16 H new ATOM 0 HG LEU A 93 7.945 -8.599 -6.232 1.00 1.86 H new ATOM 0 HD11 LEU A 93 7.413 -9.271 -3.936 1.00 2.88 H new ATOM 0 HD12 LEU A 93 8.486 -10.441 -4.740 1.00 2.88 H new ATOM 0 HD13 LEU A 93 9.148 -9.301 -3.545 1.00 2.88 H new ATOM 0 HD21 LEU A 93 7.579 -6.886 -4.424 1.00 3.40 H new ATOM 0 HD22 LEU A 93 9.330 -6.873 -4.106 1.00 3.40 H new ATOM 0 HD23 LEU A 93 8.704 -6.285 -5.665 1.00 3.40 H new ATOM 1531 N LYS A 94 10.374 -11.975 -5.453 1.00 1.31 N ATOM 1532 CA LYS A 94 10.851 -13.199 -4.796 1.00 1.08 C ATOM 1533 C LYS A 94 12.060 -13.832 -5.430 1.00 1.24 C ATOM 1534 O LYS A 94 12.988 -14.239 -4.744 1.00 1.47 O ATOM 1535 CB LYS A 94 10.731 -13.353 -3.269 1.00 2.18 C ATOM 1536 CG LYS A 94 9.718 -12.411 -2.659 1.00 2.38 C ATOM 1537 CD LYS A 94 8.500 -13.225 -2.295 1.00 2.13 C ATOM 1538 CE LYS A 94 7.175 -12.550 -2.663 1.00 2.50 C ATOM 1539 NZ LYS A 94 6.705 -12.965 -4.001 1.00 3.14 N ATOM 0 H LYS A 94 9.355 -11.930 -5.459 1.00 1.31 H new ATOM 0 HA LYS A 94 10.016 -13.851 -5.053 1.00 1.08 H new ATOM 0 HB2 LYS A 94 10.452 -14.380 -3.034 1.00 2.18 H new ATOM 0 HB3 LYS A 94 11.705 -13.175 -2.814 1.00 2.18 H new ATOM 0 HG2 LYS A 94 10.131 -11.924 -1.776 1.00 2.38 H new ATOM 0 HG3 LYS A 94 9.455 -11.622 -3.364 1.00 2.38 H new ATOM 0 HD2 LYS A 94 8.557 -14.191 -2.796 1.00 2.13 H new ATOM 0 HD3 LYS A 94 8.512 -13.421 -1.223 1.00 2.13 H new ATOM 0 HE2 LYS A 94 6.420 -12.800 -1.918 1.00 2.50 H new ATOM 0 HE3 LYS A 94 7.299 -11.467 -2.640 1.00 2.50 H new ATOM 0 HZ1 LYS A 94 5.693 -12.747 -4.096 1.00 3.14 H new ATOM 0 HZ2 LYS A 94 7.240 -12.453 -4.731 1.00 3.14 H new ATOM 0 HZ3 LYS A 94 6.851 -13.988 -4.119 1.00 3.14 H new ATOM 1553 N ILE A 95 12.042 -13.904 -6.755 1.00 1.30 N ATOM 1554 CA ILE A 95 13.147 -14.408 -7.537 1.00 1.59 C ATOM 1555 C ILE A 95 14.512 -13.804 -7.174 1.00 1.71 C ATOM 1556 O ILE A 95 15.539 -14.390 -7.517 1.00 1.99 O ATOM 1557 CB ILE A 95 12.776 -14.328 -9.025 1.00 1.68 C ATOM 1558 CG1 ILE A 95 13.650 -15.267 -9.868 1.00 2.33 C ATOM 1559 CG2 ILE A 95 12.831 -12.878 -9.528 1.00 2.69 C ATOM 1560 CD1 ILE A 95 13.006 -15.532 -11.229 1.00 2.27 C ATOM 0 H ILE A 95 11.245 -13.608 -7.318 1.00 1.30 H new ATOM 0 HA ILE A 95 13.303 -15.457 -7.284 1.00 1.59 H new ATOM 0 HB ILE A 95 11.747 -14.669 -9.137 1.00 1.68 H new ATOM 0 HG12 ILE A 95 14.637 -14.825 -10.007 1.00 2.33 H new ATOM 0 HG13 ILE A 95 13.794 -16.209 -9.339 1.00 2.33 H new ATOM 0 HG21 ILE A 95 12.564 -12.849 -10.584 1.00 2.69 H new ATOM 0 HG22 ILE A 95 12.128 -12.269 -8.959 1.00 2.69 H new ATOM 0 HG23 ILE A 95 13.840 -12.486 -9.398 1.00 2.69 H new ATOM 0 HD11 ILE A 95 13.643 -16.200 -11.809 1.00 2.27 H new ATOM 0 HD12 ILE A 95 12.030 -15.995 -11.086 1.00 2.27 H new ATOM 0 HD13 ILE A 95 12.885 -14.590 -11.764 1.00 2.27 H new ATOM 1572 N ARG A 96 14.538 -12.652 -6.492 1.00 1.58 N ATOM 1573 CA ARG A 96 15.672 -12.159 -5.728 1.00 1.67 C ATOM 1574 C ARG A 96 16.723 -11.543 -6.653 1.00 2.11 C ATOM 1575 O ARG A 96 16.888 -10.327 -6.726 1.00 2.85 O ATOM 1576 CB ARG A 96 16.263 -13.265 -4.839 1.00 1.72 C ATOM 1577 CG ARG A 96 17.375 -12.789 -3.898 1.00 1.99 C ATOM 1578 CD ARG A 96 17.729 -13.947 -2.956 1.00 2.61 C ATOM 1579 NE ARG A 96 18.910 -13.653 -2.133 1.00 3.53 N ATOM 1580 CZ ARG A 96 20.022 -14.406 -2.057 1.00 4.84 C ATOM 1581 NH1 ARG A 96 20.292 -15.347 -2.967 1.00 5.49 N ATOM 1582 NH2 ARG A 96 20.875 -14.208 -1.045 1.00 6.11 N ATOM 0 H ARG A 96 13.737 -12.021 -6.461 1.00 1.58 H new ATOM 0 HA ARG A 96 15.321 -11.369 -5.064 1.00 1.67 H new ATOM 0 HB2 ARG A 96 15.462 -13.704 -4.244 1.00 1.72 H new ATOM 0 HB3 ARG A 96 16.656 -14.057 -5.477 1.00 1.72 H new ATOM 0 HG2 ARG A 96 18.251 -12.481 -4.469 1.00 1.99 H new ATOM 0 HG3 ARG A 96 17.045 -11.921 -3.327 1.00 1.99 H new ATOM 0 HD2 ARG A 96 16.879 -14.157 -2.307 1.00 2.61 H new ATOM 0 HD3 ARG A 96 17.912 -14.847 -3.543 1.00 2.61 H new ATOM 0 HE ARG A 96 18.884 -12.803 -1.570 1.00 3.53 H new ATOM 0 HH11 ARG A 96 19.648 -15.507 -3.741 1.00 5.49 H new ATOM 0 HH12 ARG A 96 21.142 -15.905 -2.887 1.00 5.49 H new ATOM 0 HH21 ARG A 96 20.678 -13.494 -0.344 1.00 6.11 H new ATOM 0 HH22 ARG A 96 21.722 -14.772 -0.974 1.00 6.11 H new ATOM 1596 N LYS A 97 17.439 -12.436 -7.336 1.00 2.12 N ATOM 1597 CA LYS A 97 18.624 -12.244 -8.154 1.00 2.52 C ATOM 1598 C LYS A 97 18.983 -13.653 -8.630 1.00 3.01 C ATOM 1599 O LYS A 97 18.986 -13.940 -9.821 1.00 3.18 O ATOM 1600 CB LYS A 97 19.752 -11.590 -7.330 1.00 3.07 C ATOM 1601 CG LYS A 97 21.009 -11.209 -8.126 1.00 3.65 C ATOM 1602 CD LYS A 97 21.852 -12.415 -8.572 1.00 3.60 C ATOM 1603 CE LYS A 97 23.249 -11.954 -9.015 1.00 4.53 C ATOM 1604 NZ LYS A 97 24.080 -13.079 -9.492 1.00 4.99 N ATOM 0 H LYS A 97 17.167 -13.419 -7.324 1.00 2.12 H new ATOM 0 HA LYS A 97 18.463 -11.570 -8.996 1.00 2.52 H new ATOM 0 HB2 LYS A 97 19.358 -10.693 -6.853 1.00 3.07 H new ATOM 0 HB3 LYS A 97 20.041 -12.274 -6.532 1.00 3.07 H new ATOM 0 HG2 LYS A 97 20.711 -10.640 -9.007 1.00 3.65 H new ATOM 0 HG3 LYS A 97 21.628 -10.551 -7.516 1.00 3.65 H new ATOM 0 HD2 LYS A 97 21.940 -13.129 -7.753 1.00 3.60 H new ATOM 0 HD3 LYS A 97 21.355 -12.931 -9.393 1.00 3.60 H new ATOM 0 HE2 LYS A 97 23.151 -11.214 -9.809 1.00 4.53 H new ATOM 0 HE3 LYS A 97 23.750 -11.462 -8.181 1.00 4.53 H new ATOM 0 HZ1 LYS A 97 25.014 -12.723 -9.781 1.00 4.99 H new ATOM 0 HZ2 LYS A 97 24.196 -13.774 -8.727 1.00 4.99 H new ATOM 0 HZ3 LYS A 97 23.616 -13.533 -10.305 1.00 4.99 H new ATOM 1618 N LYS A 98 19.255 -14.531 -7.659 1.00 3.60 N ATOM 1619 CA LYS A 98 19.227 -15.975 -7.756 1.00 4.24 C ATOM 1620 C LYS A 98 19.310 -16.457 -6.305 1.00 5.11 C ATOM 1621 O LYS A 98 19.355 -15.571 -5.418 1.00 6.40 O ATOM 1622 CB LYS A 98 20.381 -16.523 -8.621 1.00 4.74 C ATOM 1623 CG LYS A 98 19.885 -17.430 -9.762 1.00 4.77 C ATOM 1624 CD LYS A 98 19.050 -18.664 -9.364 1.00 5.24 C ATOM 1625 CE LYS A 98 19.835 -19.858 -8.796 1.00 6.34 C ATOM 1626 NZ LYS A 98 20.406 -19.588 -7.463 1.00 7.49 N ATOM 1627 OXT LYS A 98 19.378 -17.688 -6.102 1.00 5.14 O ATOM 0 H LYS A 98 19.518 -14.219 -6.724 1.00 3.60 H new ATOM 0 HA LYS A 98 18.326 -16.334 -8.254 1.00 4.24 H new ATOM 0 HB2 LYS A 98 20.942 -15.689 -9.042 1.00 4.74 H new ATOM 0 HB3 LYS A 98 21.070 -17.084 -7.989 1.00 4.74 H new ATOM 0 HG2 LYS A 98 19.288 -16.822 -10.442 1.00 4.77 H new ATOM 0 HG3 LYS A 98 20.754 -17.775 -10.322 1.00 4.77 H new ATOM 0 HD2 LYS A 98 18.313 -18.355 -8.623 1.00 5.24 H new ATOM 0 HD3 LYS A 98 18.498 -19.002 -10.241 1.00 5.24 H new ATOM 0 HE2 LYS A 98 19.176 -20.724 -8.735 1.00 6.34 H new ATOM 0 HE3 LYS A 98 20.639 -20.118 -9.484 1.00 6.34 H new ATOM 0 HZ1 LYS A 98 20.159 -20.364 -6.816 1.00 7.49 H new ATOM 0 HZ2 LYS A 98 21.441 -19.515 -7.537 1.00 7.49 H new ATOM 0 HZ3 LYS A 98 20.021 -18.695 -7.095 1.00 7.49 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 9.262 -13.841 8.442 1.00 4.09 N ATOM 1643 CA MET B 1 10.123 -13.410 7.331 1.00 3.38 C ATOM 1644 C MET B 1 10.583 -14.532 6.393 1.00 3.52 C ATOM 1645 O MET B 1 10.206 -15.689 6.556 1.00 4.18 O ATOM 1646 CB MET B 1 9.393 -12.372 6.482 1.00 3.30 C ATOM 1647 CG MET B 1 8.056 -12.836 5.886 1.00 3.81 C ATOM 1648 SD MET B 1 6.738 -13.320 7.027 1.00 4.93 S ATOM 1649 CE MET B 1 5.547 -14.022 5.871 1.00 6.09 C ATOM 0 H1 MET B 1 9.099 -13.041 9.086 1.00 4.09 H new ATOM 0 H2 MET B 1 8.351 -14.174 8.066 1.00 4.09 H new ATOM 0 H3 MET B 1 9.726 -14.614 8.961 1.00 4.09 H new ATOM 0 HA MET B 1 11.014 -13.007 7.812 1.00 3.38 H new ATOM 0 HB2 MET B 1 9.212 -11.488 7.094 1.00 3.30 H new ATOM 0 HB3 MET B 1 10.049 -12.067 5.667 1.00 3.30 H new ATOM 0 HG2 MET B 1 7.674 -12.032 5.257 1.00 3.81 H new ATOM 0 HG3 MET B 1 8.259 -13.684 5.232 1.00 3.81 H new ATOM 0 HE1 MET B 1 4.686 -14.402 6.421 1.00 6.09 H new ATOM 0 HE2 MET B 1 5.220 -13.252 5.173 1.00 6.09 H new ATOM 0 HE3 MET B 1 6.013 -14.838 5.319 1.00 6.09 H new ATOM 1661 N ALA B 2 11.315 -14.070 5.374 1.00 3.40 N ATOM 1662 CA ALA B 2 11.791 -14.574 4.096 1.00 3.58 C ATOM 1663 C ALA B 2 12.988 -13.672 3.790 1.00 4.15 C ATOM 1664 O ALA B 2 13.396 -12.894 4.655 1.00 4.80 O ATOM 1665 CB ALA B 2 12.199 -16.046 4.208 1.00 5.01 C ATOM 0 H ALA B 2 11.657 -13.113 5.465 1.00 3.40 H new ATOM 0 HA ALA B 2 11.037 -14.548 3.310 1.00 3.58 H new ATOM 0 HB1 ALA B 2 12.552 -16.401 3.239 1.00 5.01 H new ATOM 0 HB2 ALA B 2 12.997 -16.147 4.944 1.00 5.01 H new ATOM 0 HB3 ALA B 2 11.339 -16.639 4.520 1.00 5.01 H new ATOM 1671 N ALA B 3 13.632 -13.891 2.647 1.00 4.56 N ATOM 1672 CA ALA B 3 14.847 -13.235 2.211 1.00 5.43 C ATOM 1673 C ALA B 3 14.894 -13.553 0.730 1.00 4.32 C ATOM 1674 O ALA B 3 15.199 -14.706 0.434 1.00 4.42 O ATOM 1675 CB ALA B 3 14.890 -11.727 2.494 1.00 7.43 C ATOM 0 H ALA B 3 13.295 -14.571 1.966 1.00 4.56 H new ATOM 0 HA ALA B 3 15.718 -13.592 2.760 1.00 5.43 H new ATOM 0 HB1 ALA B 3 15.834 -11.316 2.135 1.00 7.43 H new ATOM 0 HB2 ALA B 3 14.063 -11.237 1.981 1.00 7.43 H new ATOM 0 HB3 ALA B 3 14.804 -11.556 3.567 1.00 7.43 H new ATOM 1681 N GLU B 4 14.687 -12.626 -0.211 1.00 3.55 N ATOM 1682 CA GLU B 4 13.951 -12.895 -1.407 1.00 2.10 C ATOM 1683 C GLU B 4 13.793 -14.348 -1.846 1.00 2.75 C ATOM 1684 O GLU B 4 14.620 -14.920 -2.555 1.00 4.55 O ATOM 1685 CB GLU B 4 13.489 -11.672 -2.246 1.00 2.39 C ATOM 1686 CG GLU B 4 12.743 -10.594 -1.452 1.00 2.66 C ATOM 1687 CD GLU B 4 12.358 -9.386 -2.295 1.00 3.62 C ATOM 1688 OE1 GLU B 4 11.782 -9.626 -3.376 1.00 3.91 O ATOM 1689 OE2 GLU B 4 12.627 -8.252 -1.843 1.00 4.80 O ATOM 0 H GLU B 4 15.035 -11.670 -0.145 1.00 3.55 H new ATOM 0 HA GLU B 4 12.886 -13.113 -1.488 1.00 2.10 H new ATOM 0 HB2 GLU B 4 14.363 -11.219 -2.714 1.00 2.39 H new ATOM 0 HB3 GLU B 4 12.843 -12.024 -3.050 1.00 2.39 H new ATOM 0 HG2 GLU B 4 11.842 -11.029 -1.019 1.00 2.66 H new ATOM 0 HG3 GLU B 4 13.368 -10.265 -0.622 1.00 2.66 H new ATOM 1696 N PRO B 5 12.721 -15.016 -1.365 1.00 3.83 N ATOM 1697 CA PRO B 5 11.813 -14.802 -0.206 1.00 4.77 C ATOM 1698 C PRO B 5 11.428 -13.386 0.352 1.00 4.14 C ATOM 1699 O PRO B 5 12.275 -12.600 0.727 1.00 4.07 O ATOM 1700 CB PRO B 5 10.606 -15.705 -0.490 1.00 7.50 C ATOM 1701 CG PRO B 5 11.200 -16.862 -1.296 1.00 7.77 C ATOM 1702 CD PRO B 5 12.383 -16.247 -2.048 1.00 5.52 C ATOM 0 HA PRO B 5 12.418 -15.045 0.667 1.00 4.77 H new ATOM 0 HB2 PRO B 5 10.143 -16.056 0.432 1.00 7.50 H new ATOM 0 HB3 PRO B 5 9.836 -15.178 -1.053 1.00 7.50 H new ATOM 0 HG2 PRO B 5 11.524 -17.673 -0.644 1.00 7.77 H new ATOM 0 HG3 PRO B 5 10.467 -17.281 -1.986 1.00 7.77 H new ATOM 0 HD2 PRO B 5 13.233 -16.930 -2.056 1.00 5.52 H new ATOM 0 HD3 PRO B 5 12.121 -16.052 -3.088 1.00 5.52 H new ATOM 1710 N LEU B 6 10.157 -13.094 0.624 1.00 3.75 N ATOM 1711 CA LEU B 6 9.635 -11.757 0.998 1.00 3.23 C ATOM 1712 C LEU B 6 9.844 -11.367 2.471 1.00 2.29 C ATOM 1713 O LEU B 6 10.276 -12.187 3.273 1.00 2.04 O ATOM 1714 CB LEU B 6 8.132 -11.601 0.640 1.00 3.62 C ATOM 1715 CG LEU B 6 7.061 -12.556 1.221 1.00 3.77 C ATOM 1716 CD1 LEU B 6 7.140 -14.054 0.885 1.00 4.24 C ATOM 1717 CD2 LEU B 6 6.975 -12.446 2.738 1.00 4.36 C ATOM 0 H LEU B 6 9.424 -13.803 0.592 1.00 3.75 H new ATOM 0 HA LEU B 6 10.237 -11.071 0.402 1.00 3.23 H new ATOM 0 HB2 LEU B 6 7.842 -10.589 0.923 1.00 3.62 H new ATOM 0 HB3 LEU B 6 8.056 -11.662 -0.446 1.00 3.62 H new ATOM 0 HG LEU B 6 6.175 -12.188 0.703 1.00 3.77 H new ATOM 0 HD11 LEU B 6 6.317 -14.580 1.370 1.00 4.24 H new ATOM 0 HD12 LEU B 6 7.071 -14.189 -0.194 1.00 4.24 H new ATOM 0 HD13 LEU B 6 8.088 -14.457 1.241 1.00 4.24 H new ATOM 0 HD21 LEU B 6 6.213 -13.131 3.110 1.00 4.36 H new ATOM 0 HD22 LEU B 6 7.939 -12.703 3.177 1.00 4.36 H new ATOM 0 HD23 LEU B 6 6.711 -11.425 3.014 1.00 4.36 H new ATOM 1729 N THR B 7 9.501 -10.116 2.822 1.00 2.03 N ATOM 1730 CA THR B 7 9.489 -9.566 4.179 1.00 1.41 C ATOM 1731 C THR B 7 8.085 -9.066 4.545 1.00 1.24 C ATOM 1732 O THR B 7 7.366 -8.646 3.641 1.00 1.61 O ATOM 1733 CB THR B 7 10.569 -8.485 4.331 1.00 1.68 C ATOM 1734 OG1 THR B 7 11.675 -8.749 3.493 1.00 2.60 O ATOM 1735 CG2 THR B 7 11.076 -8.473 5.774 1.00 1.72 C ATOM 0 H THR B 7 9.210 -9.429 2.127 1.00 2.03 H new ATOM 0 HA THR B 7 9.734 -10.355 4.890 1.00 1.41 H new ATOM 0 HB THR B 7 10.123 -7.528 4.059 1.00 1.68 H new ATOM 0 HG1 THR B 7 11.832 -7.980 2.906 1.00 2.60 H new ATOM 0 HG21 THR B 7 11.843 -7.706 5.884 1.00 1.72 H new ATOM 0 HG22 THR B 7 10.248 -8.257 6.449 1.00 1.72 H new ATOM 0 HG23 THR B 7 11.499 -9.447 6.019 1.00 1.72 H new ATOM 1743 N GLU B 8 7.673 -9.100 5.827 1.00 1.04 N ATOM 1744 CA GLU B 8 6.294 -8.821 6.248 1.00 1.26 C ATOM 1745 C GLU B 8 5.746 -7.542 5.615 1.00 1.35 C ATOM 1746 O GLU B 8 4.636 -7.530 5.089 1.00 1.56 O ATOM 1747 CB GLU B 8 6.186 -8.714 7.785 1.00 1.38 C ATOM 1748 CG GLU B 8 6.435 -10.009 8.587 1.00 1.88 C ATOM 1749 CD GLU B 8 7.903 -10.389 8.741 1.00 2.47 C ATOM 1750 OE1 GLU B 8 8.740 -9.572 8.293 1.00 3.27 O ATOM 1751 OE2 GLU B 8 8.180 -11.517 9.226 1.00 3.26 O ATOM 0 H GLU B 8 8.296 -9.324 6.603 1.00 1.04 H new ATOM 0 HA GLU B 8 5.694 -9.663 5.902 1.00 1.26 H new ATOM 0 HB2 GLU B 8 6.897 -7.961 8.125 1.00 1.38 H new ATOM 0 HB3 GLU B 8 5.190 -8.347 8.032 1.00 1.38 H new ATOM 0 HG2 GLU B 8 5.997 -9.896 9.579 1.00 1.88 H new ATOM 0 HG3 GLU B 8 5.910 -10.830 8.098 1.00 1.88 H new ATOM 1758 N LEU B 9 6.519 -6.454 5.668 1.00 1.27 N ATOM 1759 CA LEU B 9 6.065 -5.181 5.129 1.00 1.51 C ATOM 1760 C LEU B 9 5.824 -5.320 3.623 1.00 1.66 C ATOM 1761 O LEU B 9 4.842 -4.796 3.099 1.00 1.86 O ATOM 1762 CB LEU B 9 7.089 -4.072 5.430 1.00 1.43 C ATOM 1763 CG LEU B 9 7.186 -3.609 6.900 1.00 1.44 C ATOM 1764 CD1 LEU B 9 5.896 -2.933 7.384 1.00 2.24 C ATOM 1765 CD2 LEU B 9 7.589 -4.716 7.882 1.00 2.31 C ATOM 0 H LEU B 9 7.454 -6.434 6.076 1.00 1.27 H new ATOM 0 HA LEU B 9 5.126 -4.900 5.607 1.00 1.51 H new ATOM 0 HB2 LEU B 9 8.073 -4.421 5.116 1.00 1.43 H new ATOM 0 HB3 LEU B 9 6.846 -3.206 4.814 1.00 1.43 H new ATOM 0 HG LEU B 9 7.993 -2.877 6.895 1.00 1.44 H new ATOM 0 HD11 LEU B 9 6.014 -2.625 8.423 1.00 2.24 H new ATOM 0 HD12 LEU B 9 5.690 -2.058 6.768 1.00 2.24 H new ATOM 0 HD13 LEU B 9 5.066 -3.635 7.306 1.00 2.24 H new ATOM 0 HD21 LEU B 9 7.634 -4.308 8.892 1.00 2.31 H new ATOM 0 HD22 LEU B 9 6.852 -5.519 7.848 1.00 2.31 H new ATOM 0 HD23 LEU B 9 8.567 -5.109 7.606 1.00 2.31 H new ATOM 1777 N GLU B 10 6.726 -6.018 2.926 1.00 1.64 N ATOM 1778 CA GLU B 10 6.683 -6.130 1.477 1.00 1.73 C ATOM 1779 C GLU B 10 5.638 -7.132 0.979 1.00 1.64 C ATOM 1780 O GLU B 10 5.061 -6.942 -0.090 1.00 1.63 O ATOM 1781 CB GLU B 10 8.090 -6.310 0.899 1.00 1.62 C ATOM 1782 CG GLU B 10 8.425 -7.697 0.341 1.00 2.21 C ATOM 1783 CD GLU B 10 7.850 -7.961 -1.053 1.00 2.89 C ATOM 1784 OE1 GLU B 10 7.704 -6.985 -1.825 1.00 3.22 O ATOM 1785 OE2 GLU B 10 7.561 -9.149 -1.310 1.00 4.14 O ATOM 0 H GLU B 10 7.504 -6.519 3.356 1.00 1.64 H new ATOM 0 HA GLU B 10 6.321 -5.183 1.076 1.00 1.73 H new ATOM 0 HB2 GLU B 10 8.228 -5.579 0.103 1.00 1.62 H new ATOM 0 HB3 GLU B 10 8.813 -6.072 1.679 1.00 1.62 H new ATOM 0 HG2 GLU B 10 9.508 -7.811 0.304 1.00 2.21 H new ATOM 0 HG3 GLU B 10 8.048 -8.455 1.028 1.00 2.21 H new ATOM 1792 N GLU B 11 5.340 -8.162 1.771 1.00 1.63 N ATOM 1793 CA GLU B 11 4.312 -9.150 1.453 1.00 1.62 C ATOM 1794 C GLU B 11 3.024 -8.480 0.950 1.00 1.51 C ATOM 1795 O GLU B 11 2.401 -8.924 -0.016 1.00 1.48 O ATOM 1796 CB GLU B 11 4.050 -10.010 2.698 1.00 1.90 C ATOM 1797 CG GLU B 11 3.234 -11.269 2.374 1.00 2.48 C ATOM 1798 CD GLU B 11 3.196 -12.231 3.555 1.00 3.08 C ATOM 1799 OE1 GLU B 11 2.984 -11.742 4.685 1.00 3.98 O ATOM 1800 OE2 GLU B 11 3.410 -13.439 3.314 1.00 3.37 O ATOM 0 H GLU B 11 5.810 -8.335 2.659 1.00 1.63 H new ATOM 0 HA GLU B 11 4.665 -9.788 0.643 1.00 1.62 H new ATOM 0 HB2 GLU B 11 5.002 -10.301 3.143 1.00 1.90 H new ATOM 0 HB3 GLU B 11 3.518 -9.416 3.442 1.00 1.90 H new ATOM 0 HG2 GLU B 11 2.217 -10.985 2.103 1.00 2.48 H new ATOM 0 HG3 GLU B 11 3.666 -11.771 1.509 1.00 2.48 H new ATOM 1807 N SER B 12 2.643 -7.358 1.568 1.00 1.54 N ATOM 1808 CA SER B 12 1.411 -6.668 1.214 1.00 1.56 C ATOM 1809 C SER B 12 1.534 -6.050 -0.181 1.00 1.42 C ATOM 1810 O SER B 12 0.569 -5.944 -0.937 1.00 1.45 O ATOM 1811 CB SER B 12 1.154 -5.585 2.265 1.00 1.64 C ATOM 1812 OG SER B 12 0.470 -6.129 3.376 1.00 2.42 O ATOM 0 H SER B 12 3.174 -6.912 2.316 1.00 1.54 H new ATOM 0 HA SER B 12 0.576 -7.369 1.194 1.00 1.56 H new ATOM 0 HB2 SER B 12 2.100 -5.152 2.589 1.00 1.64 H new ATOM 0 HB3 SER B 12 0.567 -4.777 1.828 1.00 1.64 H new ATOM 0 HG SER B 12 -0.489 -5.943 3.293 1.00 2.42 H new ATOM 1818 N ILE B 13 2.745 -5.608 -0.497 1.00 1.33 N ATOM 1819 CA ILE B 13 3.080 -4.840 -1.670 1.00 1.19 C ATOM 1820 C ILE B 13 3.021 -5.768 -2.866 1.00 1.03 C ATOM 1821 O ILE B 13 2.334 -5.470 -3.845 1.00 0.94 O ATOM 1822 CB ILE B 13 4.482 -4.232 -1.491 1.00 1.27 C ATOM 1823 CG1 ILE B 13 4.500 -3.532 -0.126 1.00 1.67 C ATOM 1824 CG2 ILE B 13 4.913 -3.284 -2.620 1.00 1.26 C ATOM 1825 CD1 ILE B 13 5.799 -2.798 0.132 1.00 1.36 C ATOM 0 H ILE B 13 3.556 -5.790 0.095 1.00 1.33 H new ATOM 0 HA ILE B 13 2.380 -4.019 -1.824 1.00 1.19 H new ATOM 0 HB ILE B 13 5.216 -5.037 -1.536 1.00 1.27 H new ATOM 0 HG12 ILE B 13 3.671 -2.826 -0.072 1.00 1.67 H new ATOM 0 HG13 ILE B 13 4.342 -4.271 0.660 1.00 1.67 H new ATOM 0 HG21 ILE B 13 5.913 -2.902 -2.413 1.00 1.26 H new ATOM 0 HG22 ILE B 13 4.920 -3.825 -3.566 1.00 1.26 H new ATOM 0 HG23 ILE B 13 4.212 -2.452 -2.683 1.00 1.26 H new ATOM 0 HD11 ILE B 13 5.759 -2.321 1.111 1.00 1.36 H new ATOM 0 HD12 ILE B 13 6.628 -3.505 0.107 1.00 1.36 H new ATOM 0 HD13 ILE B 13 5.947 -2.039 -0.636 1.00 1.36 H new ATOM 1837 N GLU B 14 3.737 -6.892 -2.760 1.00 1.05 N ATOM 1838 CA GLU B 14 3.740 -7.896 -3.805 1.00 1.00 C ATOM 1839 C GLU B 14 2.299 -8.355 -4.064 1.00 0.98 C ATOM 1840 O GLU B 14 1.859 -8.395 -5.212 1.00 1.02 O ATOM 1841 CB GLU B 14 4.776 -8.988 -3.519 1.00 1.14 C ATOM 1842 CG GLU B 14 4.282 -10.243 -2.803 1.00 1.91 C ATOM 1843 CD GLU B 14 3.805 -11.318 -3.776 1.00 2.73 C ATOM 1844 OE1 GLU B 14 3.159 -10.966 -4.782 1.00 3.70 O ATOM 1845 OE2 GLU B 14 4.214 -12.481 -3.570 1.00 3.25 O ATOM 0 H GLU B 14 4.320 -7.121 -1.955 1.00 1.05 H new ATOM 0 HA GLU B 14 4.081 -7.486 -4.756 1.00 1.00 H new ATOM 0 HB2 GLU B 14 5.219 -9.292 -4.468 1.00 1.14 H new ATOM 0 HB3 GLU B 14 5.574 -8.549 -2.921 1.00 1.14 H new ATOM 0 HG2 GLU B 14 5.085 -10.646 -2.186 1.00 1.91 H new ATOM 0 HG3 GLU B 14 3.466 -9.977 -2.131 1.00 1.91 H new ATOM 1852 N THR B 15 1.527 -8.566 -2.989 1.00 1.00 N ATOM 1853 CA THR B 15 0.117 -8.901 -3.116 1.00 1.04 C ATOM 1854 C THR B 15 -0.605 -7.848 -3.964 1.00 0.94 C ATOM 1855 O THR B 15 -1.172 -8.199 -4.991 1.00 0.92 O ATOM 1856 CB THR B 15 -0.553 -9.143 -1.753 1.00 1.20 C ATOM 1857 OG1 THR B 15 0.159 -10.130 -1.036 1.00 1.30 O ATOM 1858 CG2 THR B 15 -1.978 -9.675 -1.942 1.00 1.33 C ATOM 0 H THR B 15 1.862 -8.509 -2.027 1.00 1.00 H new ATOM 0 HA THR B 15 0.039 -9.852 -3.642 1.00 1.04 H new ATOM 0 HB THR B 15 -0.564 -8.194 -1.217 1.00 1.20 H new ATOM 0 HG1 THR B 15 0.972 -9.736 -0.656 1.00 1.30 H new ATOM 0 HG21 THR B 15 -2.437 -9.841 -0.967 1.00 1.33 H new ATOM 0 HG22 THR B 15 -2.567 -8.948 -2.501 1.00 1.33 H new ATOM 0 HG23 THR B 15 -1.945 -10.615 -2.492 1.00 1.33 H new ATOM 1866 N VAL B 16 -0.573 -6.557 -3.603 1.00 0.97 N ATOM 1867 CA VAL B 16 -1.224 -5.542 -4.421 1.00 0.91 C ATOM 1868 C VAL B 16 -0.791 -5.641 -5.889 1.00 0.83 C ATOM 1869 O VAL B 16 -1.631 -5.798 -6.779 1.00 0.80 O ATOM 1870 CB VAL B 16 -0.948 -4.137 -3.859 1.00 0.94 C ATOM 1871 CG1 VAL B 16 -1.395 -3.086 -4.871 1.00 0.88 C ATOM 1872 CG2 VAL B 16 -1.704 -3.900 -2.550 1.00 1.24 C ATOM 0 H VAL B 16 -0.111 -6.203 -2.765 1.00 0.97 H new ATOM 0 HA VAL B 16 -2.298 -5.722 -4.385 1.00 0.91 H new ATOM 0 HB VAL B 16 0.122 -4.060 -3.667 1.00 0.94 H new ATOM 0 HG11 VAL B 16 -1.199 -2.091 -4.472 1.00 0.88 H new ATOM 0 HG12 VAL B 16 -0.843 -3.219 -5.802 1.00 0.88 H new ATOM 0 HG13 VAL B 16 -2.462 -3.197 -5.063 1.00 0.88 H new ATOM 0 HG21 VAL B 16 -1.486 -2.898 -2.180 1.00 1.24 H new ATOM 0 HG22 VAL B 16 -2.775 -3.997 -2.726 1.00 1.24 H new ATOM 0 HG23 VAL B 16 -1.390 -4.636 -1.810 1.00 1.24 H new ATOM 1882 N VAL B 17 0.513 -5.506 -6.150 1.00 0.88 N ATOM 1883 CA VAL B 17 0.991 -5.412 -7.525 1.00 0.95 C ATOM 1884 C VAL B 17 0.594 -6.657 -8.318 1.00 0.90 C ATOM 1885 O VAL B 17 0.081 -6.543 -9.429 1.00 0.98 O ATOM 1886 CB VAL B 17 2.493 -5.093 -7.614 1.00 0.92 C ATOM 1887 CG1 VAL B 17 2.796 -3.742 -6.954 1.00 1.29 C ATOM 1888 CG2 VAL B 17 3.335 -6.194 -6.971 1.00 0.87 C ATOM 0 H VAL B 17 1.242 -5.460 -5.438 1.00 0.88 H new ATOM 0 HA VAL B 17 0.497 -4.559 -7.990 1.00 0.95 H new ATOM 0 HB VAL B 17 2.758 -5.038 -8.670 1.00 0.92 H new ATOM 0 HG11 VAL B 17 3.863 -3.533 -7.026 1.00 1.29 H new ATOM 0 HG12 VAL B 17 2.237 -2.956 -7.461 1.00 1.29 H new ATOM 0 HG13 VAL B 17 2.503 -3.776 -5.905 1.00 1.29 H new ATOM 0 HG21 VAL B 17 4.391 -5.938 -7.051 1.00 0.87 H new ATOM 0 HG22 VAL B 17 3.064 -6.292 -5.920 1.00 0.87 H new ATOM 0 HG23 VAL B 17 3.151 -7.139 -7.483 1.00 0.87 H new ATOM 1898 N THR B 18 0.789 -7.844 -7.739 1.00 0.86 N ATOM 1899 CA THR B 18 0.441 -9.080 -8.412 1.00 0.97 C ATOM 1900 C THR B 18 -1.075 -9.162 -8.600 1.00 0.88 C ATOM 1901 O THR B 18 -1.526 -9.598 -9.655 1.00 0.97 O ATOM 1902 CB THR B 18 1.084 -10.300 -7.722 1.00 1.24 C ATOM 1903 OG1 THR B 18 1.400 -11.277 -8.694 1.00 1.76 O ATOM 1904 CG2 THR B 18 0.201 -10.945 -6.654 1.00 1.24 C ATOM 0 H THR B 18 1.186 -7.967 -6.807 1.00 0.86 H new ATOM 0 HA THR B 18 0.866 -9.090 -9.416 1.00 0.97 H new ATOM 0 HB THR B 18 1.976 -9.928 -7.218 1.00 1.24 H new ATOM 0 HG1 THR B 18 1.810 -12.052 -8.257 1.00 1.76 H new ATOM 0 HG21 THR B 18 0.723 -11.795 -6.215 1.00 1.24 H new ATOM 0 HG22 THR B 18 -0.021 -10.215 -5.876 1.00 1.24 H new ATOM 0 HG23 THR B 18 -0.730 -11.285 -7.108 1.00 1.24 H new ATOM 1912 N THR B 19 -1.880 -8.697 -7.637 1.00 0.84 N ATOM 1913 CA THR B 19 -3.332 -8.727 -7.760 1.00 0.94 C ATOM 1914 C THR B 19 -3.807 -7.858 -8.930 1.00 0.87 C ATOM 1915 O THR B 19 -4.777 -8.224 -9.591 1.00 0.98 O ATOM 1916 CB THR B 19 -3.993 -8.366 -6.425 1.00 1.07 C ATOM 1917 OG1 THR B 19 -3.662 -9.338 -5.455 1.00 1.23 O ATOM 1918 CG2 THR B 19 -5.516 -8.356 -6.533 1.00 1.37 C ATOM 0 H THR B 19 -1.543 -8.295 -6.762 1.00 0.84 H new ATOM 0 HA THR B 19 -3.647 -9.743 -7.997 1.00 0.94 H new ATOM 0 HB THR B 19 -3.634 -7.374 -6.149 1.00 1.07 H new ATOM 0 HG1 THR B 19 -2.759 -9.167 -5.116 1.00 1.23 H new ATOM 0 HG21 THR B 19 -5.948 -8.096 -5.566 1.00 1.37 H new ATOM 0 HG22 THR B 19 -5.823 -7.621 -7.277 1.00 1.37 H new ATOM 0 HG23 THR B 19 -5.866 -9.344 -6.833 1.00 1.37 H new ATOM 1926 N PHE B 20 -3.127 -6.742 -9.242 1.00 0.77 N ATOM 1927 CA PHE B 20 -3.423 -6.031 -10.489 1.00 0.82 C ATOM 1928 C PHE B 20 -3.314 -6.976 -11.684 1.00 0.98 C ATOM 1929 O PHE B 20 -4.094 -6.876 -12.627 1.00 1.12 O ATOM 1930 CB PHE B 20 -2.468 -4.861 -10.761 1.00 0.83 C ATOM 1931 CG PHE B 20 -2.497 -3.725 -9.768 1.00 0.66 C ATOM 1932 CD1 PHE B 20 -3.716 -3.130 -9.404 1.00 1.43 C ATOM 1933 CD2 PHE B 20 -1.287 -3.152 -9.342 1.00 1.59 C ATOM 1934 CE1 PHE B 20 -3.728 -2.059 -8.501 1.00 1.49 C ATOM 1935 CE2 PHE B 20 -1.298 -2.112 -8.400 1.00 1.63 C ATOM 1936 CZ PHE B 20 -2.519 -1.562 -7.989 1.00 0.90 C ATOM 0 H PHE B 20 -2.394 -6.326 -8.668 1.00 0.77 H new ATOM 0 HA PHE B 20 -4.435 -5.645 -10.366 1.00 0.82 H new ATOM 0 HB2 PHE B 20 -1.452 -5.252 -10.802 1.00 0.83 H new ATOM 0 HB3 PHE B 20 -2.695 -4.458 -11.748 1.00 0.83 H new ATOM 0 HD1 PHE B 20 -4.643 -3.498 -9.820 1.00 1.43 H new ATOM 0 HD2 PHE B 20 -0.349 -3.512 -9.739 1.00 1.59 H new ATOM 0 HE1 PHE B 20 -4.666 -1.616 -8.199 1.00 1.49 H new ATOM 0 HE2 PHE B 20 -0.370 -1.738 -7.994 1.00 1.63 H new ATOM 0 HZ PHE B 20 -2.530 -0.752 -7.275 1.00 0.90 H new ATOM 1946 N PHE B 21 -2.291 -7.835 -11.680 1.00 1.09 N ATOM 1947 CA PHE B 21 -2.009 -8.699 -12.809 1.00 1.49 C ATOM 1948 C PHE B 21 -3.004 -9.853 -12.799 1.00 1.62 C ATOM 1949 O PHE B 21 -3.826 -9.956 -13.700 1.00 1.71 O ATOM 1950 CB PHE B 21 -0.560 -9.219 -12.764 1.00 1.91 C ATOM 1951 CG PHE B 21 0.563 -8.217 -12.516 1.00 3.53 C ATOM 1952 CD1 PHE B 21 0.376 -6.828 -12.678 1.00 4.95 C ATOM 1953 CD2 PHE B 21 1.785 -8.688 -11.998 1.00 4.70 C ATOM 1954 CE1 PHE B 21 1.395 -5.927 -12.323 1.00 6.88 C ATOM 1955 CE2 PHE B 21 2.811 -7.788 -11.663 1.00 6.65 C ATOM 1956 CZ PHE B 21 2.624 -6.409 -11.843 1.00 7.58 C ATOM 0 H PHE B 21 -1.646 -7.944 -10.898 1.00 1.09 H new ATOM 0 HA PHE B 21 -2.115 -8.133 -13.734 1.00 1.49 H new ATOM 0 HB2 PHE B 21 -0.504 -9.980 -11.985 1.00 1.91 H new ATOM 0 HB3 PHE B 21 -0.357 -9.718 -13.712 1.00 1.91 H new ATOM 0 HD1 PHE B 21 -0.556 -6.455 -13.077 1.00 4.95 H new ATOM 0 HD2 PHE B 21 1.935 -9.748 -11.857 1.00 4.70 H new ATOM 0 HE1 PHE B 21 1.233 -4.864 -12.419 1.00 6.88 H new ATOM 0 HE2 PHE B 21 3.745 -8.158 -11.266 1.00 6.65 H new ATOM 0 HZ PHE B 21 3.423 -5.720 -11.613 1.00 7.58 H new ATOM 1966 N THR B 22 -2.962 -10.677 -11.754 1.00 1.94 N ATOM 1967 CA THR B 22 -3.729 -11.901 -11.630 1.00 2.49 C ATOM 1968 C THR B 22 -5.081 -11.556 -11.015 1.00 2.38 C ATOM 1969 O THR B 22 -5.419 -11.986 -9.911 1.00 2.85 O ATOM 1970 CB THR B 22 -2.905 -12.907 -10.811 1.00 3.24 C ATOM 1971 OG1 THR B 22 -1.559 -12.877 -11.253 1.00 4.33 O ATOM 1972 CG2 THR B 22 -3.436 -14.333 -10.975 1.00 3.89 C ATOM 0 H THR B 22 -2.369 -10.498 -10.944 1.00 1.94 H new ATOM 0 HA THR B 22 -3.931 -12.371 -12.592 1.00 2.49 H new ATOM 0 HB THR B 22 -2.979 -12.625 -9.761 1.00 3.24 H new ATOM 0 HG1 THR B 22 -1.537 -12.848 -12.232 1.00 4.33 H new ATOM 0 HG21 THR B 22 -2.829 -15.018 -10.382 1.00 3.89 H new ATOM 0 HG22 THR B 22 -4.471 -14.377 -10.635 1.00 3.89 H new ATOM 0 HG23 THR B 22 -3.387 -14.621 -12.025 1.00 3.89 H new ATOM 1980 N PHE B 23 -5.862 -10.757 -11.739 1.00 2.14 N ATOM 1981 CA PHE B 23 -7.065 -10.155 -11.195 1.00 2.38 C ATOM 1982 C PHE B 23 -8.211 -11.160 -11.291 1.00 2.74 C ATOM 1983 O PHE B 23 -9.013 -11.114 -12.219 1.00 2.91 O ATOM 1984 CB PHE B 23 -7.367 -8.830 -11.904 1.00 2.50 C ATOM 1985 CG PHE B 23 -8.522 -8.074 -11.276 1.00 3.14 C ATOM 1986 CD1 PHE B 23 -8.344 -7.440 -10.033 1.00 4.16 C ATOM 1987 CD2 PHE B 23 -9.805 -8.129 -11.855 1.00 3.94 C ATOM 1988 CE1 PHE B 23 -9.446 -6.880 -9.363 1.00 5.58 C ATOM 1989 CE2 PHE B 23 -10.904 -7.562 -11.187 1.00 5.13 C ATOM 1990 CZ PHE B 23 -10.728 -6.946 -9.936 1.00 5.87 C ATOM 0 H PHE B 23 -5.676 -10.513 -12.712 1.00 2.14 H new ATOM 0 HA PHE B 23 -6.927 -9.911 -10.142 1.00 2.38 H new ATOM 0 HB2 PHE B 23 -6.476 -8.203 -11.885 1.00 2.50 H new ATOM 0 HB3 PHE B 23 -7.596 -9.028 -12.951 1.00 2.50 H new ATOM 0 HD1 PHE B 23 -7.359 -7.383 -9.593 1.00 4.16 H new ATOM 0 HD2 PHE B 23 -9.944 -8.607 -12.813 1.00 3.94 H new ATOM 0 HE1 PHE B 23 -9.307 -6.398 -8.406 1.00 5.58 H new ATOM 0 HE2 PHE B 23 -11.886 -7.600 -11.636 1.00 5.13 H new ATOM 0 HZ PHE B 23 -11.576 -6.524 -9.416 1.00 5.87 H new ATOM 2000 N ALA B 24 -8.261 -12.080 -10.322 1.00 3.88 N ATOM 2001 CA ALA B 24 -9.360 -13.020 -10.125 1.00 4.63 C ATOM 2002 C ALA B 24 -9.657 -13.804 -11.407 1.00 5.03 C ATOM 2003 O ALA B 24 -10.712 -13.650 -12.017 1.00 5.35 O ATOM 2004 CB ALA B 24 -10.591 -12.279 -9.590 1.00 4.92 C ATOM 0 H ALA B 24 -7.515 -12.191 -9.636 1.00 3.88 H new ATOM 0 HA ALA B 24 -9.068 -13.758 -9.378 1.00 4.63 H new ATOM 0 HB1 ALA B 24 -11.407 -12.987 -9.445 1.00 4.92 H new ATOM 0 HB2 ALA B 24 -10.347 -11.807 -8.638 1.00 4.92 H new ATOM 0 HB3 ALA B 24 -10.895 -11.515 -10.306 1.00 4.92 H new ATOM 2010 N ARG B 25 -8.708 -14.660 -11.805 1.00 5.37 N ATOM 2011 CA ARG B 25 -8.730 -15.389 -13.071 1.00 5.84 C ATOM 2012 C ARG B 25 -8.854 -14.410 -14.242 1.00 4.87 C ATOM 2013 O ARG B 25 -9.731 -14.529 -15.097 1.00 5.00 O ATOM 2014 CB ARG B 25 -9.846 -16.455 -13.076 1.00 7.22 C ATOM 2015 CG ARG B 25 -9.509 -17.672 -12.202 1.00 9.08 C ATOM 2016 CD ARG B 25 -8.701 -18.724 -12.976 1.00 10.60 C ATOM 2017 NE ARG B 25 -9.499 -19.294 -14.077 1.00 11.09 N ATOM 2018 CZ ARG B 25 -9.030 -20.085 -15.056 1.00 12.13 C ATOM 2019 NH1 ARG B 25 -7.748 -20.463 -15.052 1.00 12.93 N ATOM 2020 NH2 ARG B 25 -9.848 -20.491 -16.034 1.00 12.64 N ATOM 0 H ARG B 25 -7.885 -14.867 -11.239 1.00 5.37 H new ATOM 0 HA ARG B 25 -7.787 -15.924 -13.189 1.00 5.84 H new ATOM 0 HB2 ARG B 25 -10.774 -16.005 -12.723 1.00 7.22 H new ATOM 0 HB3 ARG B 25 -10.022 -16.786 -14.100 1.00 7.22 H new ATOM 0 HG2 ARG B 25 -8.942 -17.347 -11.330 1.00 9.08 H new ATOM 0 HG3 ARG B 25 -10.431 -18.121 -11.833 1.00 9.08 H new ATOM 0 HD2 ARG B 25 -7.794 -18.270 -13.376 1.00 10.60 H new ATOM 0 HD3 ARG B 25 -8.388 -19.519 -12.299 1.00 10.60 H new ATOM 0 HE ARG B 25 -10.493 -19.068 -14.097 1.00 11.09 H new ATOM 0 HH11 ARG B 25 -7.127 -20.151 -14.306 1.00 12.93 H new ATOM 0 HH12 ARG B 25 -7.391 -21.064 -15.795 1.00 12.93 H new ATOM 0 HH21 ARG B 25 -10.826 -20.200 -16.035 1.00 12.64 H new ATOM 0 HH22 ARG B 25 -9.494 -21.092 -16.778 1.00 12.64 H new ATOM 2034 N GLN B 26 -7.909 -13.475 -14.325 1.00 4.67 N ATOM 2035 CA GLN B 26 -7.719 -12.613 -15.474 1.00 4.24 C ATOM 2036 C GLN B 26 -6.269 -12.137 -15.420 1.00 4.53 C ATOM 2037 O GLN B 26 -5.804 -11.838 -14.323 1.00 5.56 O ATOM 2038 CB GLN B 26 -8.697 -11.428 -15.383 1.00 4.93 C ATOM 2039 CG GLN B 26 -9.004 -10.800 -16.749 1.00 5.26 C ATOM 2040 CD GLN B 26 -9.992 -11.589 -17.614 1.00 6.31 C ATOM 2041 OE1 GLN B 26 -10.390 -11.111 -18.669 1.00 6.87 O ATOM 2042 NE2 GLN B 26 -10.414 -12.785 -17.208 1.00 7.23 N ATOM 0 H GLN B 26 -7.242 -13.297 -13.574 1.00 4.67 H new ATOM 0 HA GLN B 26 -7.913 -13.129 -16.414 1.00 4.24 H new ATOM 0 HB2 GLN B 26 -9.628 -11.766 -14.927 1.00 4.93 H new ATOM 0 HB3 GLN B 26 -8.277 -10.667 -14.725 1.00 4.93 H new ATOM 0 HG2 GLN B 26 -9.402 -9.798 -16.591 1.00 5.26 H new ATOM 0 HG3 GLN B 26 -8.070 -10.689 -17.300 1.00 5.26 H new ATOM 0 HE21 GLN B 26 -10.076 -13.173 -16.328 1.00 7.23 H new ATOM 0 HE22 GLN B 26 -11.075 -13.313 -17.778 1.00 7.23 H new ATOM 2051 N GLU B 27 -5.590 -12.054 -16.568 1.00 4.26 N ATOM 2052 CA GLU B 27 -4.461 -11.156 -16.784 1.00 4.61 C ATOM 2053 C GLU B 27 -4.784 -10.389 -18.065 1.00 3.31 C ATOM 2054 O GLU B 27 -5.594 -10.857 -18.864 1.00 3.91 O ATOM 2055 CB GLU B 27 -3.106 -11.888 -16.873 1.00 6.29 C ATOM 2056 CG GLU B 27 -2.741 -12.641 -15.580 1.00 8.20 C ATOM 2057 CD GLU B 27 -1.330 -12.380 -15.056 1.00 9.96 C ATOM 2058 OE1 GLU B 27 -0.387 -12.154 -15.849 1.00 10.44 O ATOM 2059 OE2 GLU B 27 -1.143 -12.425 -13.819 1.00 11.17 O ATOM 0 H GLU B 27 -5.817 -12.621 -17.385 1.00 4.26 H new ATOM 0 HA GLU B 27 -4.339 -10.487 -15.932 1.00 4.61 H new ATOM 0 HB2 GLU B 27 -3.135 -12.595 -17.702 1.00 6.29 H new ATOM 0 HB3 GLU B 27 -2.323 -11.164 -17.099 1.00 6.29 H new ATOM 0 HG2 GLU B 27 -3.456 -12.368 -14.804 1.00 8.20 H new ATOM 0 HG3 GLU B 27 -2.855 -13.711 -15.756 1.00 8.20 H new ATOM 2066 N GLY B 28 -4.195 -9.203 -18.224 1.00 2.80 N ATOM 2067 CA GLY B 28 -4.602 -8.222 -19.222 1.00 2.73 C ATOM 2068 C GLY B 28 -4.918 -6.927 -18.483 1.00 2.72 C ATOM 2069 O GLY B 28 -6.053 -6.699 -18.077 1.00 3.12 O ATOM 0 H GLY B 28 -3.409 -8.895 -17.652 1.00 2.80 H new ATOM 0 HA2 GLY B 28 -3.808 -8.064 -19.952 1.00 2.73 H new ATOM 0 HA3 GLY B 28 -5.475 -8.573 -19.772 1.00 2.73 H new ATOM 2073 N ARG B 29 -3.887 -6.115 -18.248 1.00 2.52 N ATOM 2074 CA ARG B 29 -3.941 -4.930 -17.404 1.00 2.51 C ATOM 2075 C ARG B 29 -2.830 -3.987 -17.866 1.00 2.02 C ATOM 2076 O ARG B 29 -1.796 -4.474 -18.327 1.00 1.86 O ATOM 2077 CB ARG B 29 -3.789 -5.336 -15.922 1.00 2.76 C ATOM 2078 CG ARG B 29 -2.351 -5.587 -15.439 1.00 2.41 C ATOM 2079 CD ARG B 29 -1.602 -6.737 -16.143 1.00 2.89 C ATOM 2080 NE ARG B 29 -0.194 -6.792 -15.717 1.00 3.11 N ATOM 2081 CZ ARG B 29 0.713 -5.837 -15.985 1.00 4.08 C ATOM 2082 NH1 ARG B 29 0.427 -4.879 -16.870 1.00 5.13 N ATOM 2083 NH2 ARG B 29 1.890 -5.833 -15.352 1.00 4.74 N ATOM 0 H ARG B 29 -2.965 -6.272 -18.654 1.00 2.52 H new ATOM 0 HA ARG B 29 -4.900 -4.419 -17.491 1.00 2.51 H new ATOM 0 HB2 ARG B 29 -4.228 -4.553 -15.304 1.00 2.76 H new ATOM 0 HB3 ARG B 29 -4.372 -6.241 -15.752 1.00 2.76 H new ATOM 0 HG2 ARG B 29 -1.777 -4.670 -15.571 1.00 2.41 H new ATOM 0 HG3 ARG B 29 -2.377 -5.796 -14.369 1.00 2.41 H new ATOM 0 HD2 ARG B 29 -2.091 -7.685 -15.918 1.00 2.89 H new ATOM 0 HD3 ARG B 29 -1.653 -6.601 -17.223 1.00 2.89 H new ATOM 0 HE ARG B 29 0.113 -7.606 -15.185 1.00 3.11 H new ATOM 0 HH11 ARG B 29 -0.478 -4.873 -17.341 1.00 5.13 H new ATOM 0 HH12 ARG B 29 1.113 -4.153 -17.075 1.00 5.13 H new ATOM 0 HH21 ARG B 29 2.101 -6.556 -14.664 1.00 4.74 H new ATOM 0 HH22 ARG B 29 2.577 -5.107 -15.557 1.00 4.74 H new ATOM 2097 N LYS B 30 -3.006 -2.668 -17.743 1.00 2.08 N ATOM 2098 CA LYS B 30 -1.917 -1.724 -17.985 1.00 1.92 C ATOM 2099 C LYS B 30 -1.036 -1.660 -16.735 1.00 1.61 C ATOM 2100 O LYS B 30 0.020 -2.299 -16.687 1.00 2.13 O ATOM 2101 CB LYS B 30 -2.454 -0.339 -18.395 1.00 2.62 C ATOM 2102 CG LYS B 30 -2.662 -0.201 -19.913 1.00 2.89 C ATOM 2103 CD LYS B 30 -3.781 -1.073 -20.503 1.00 2.82 C ATOM 2104 CE LYS B 30 -5.191 -0.651 -20.062 1.00 3.12 C ATOM 2105 NZ LYS B 30 -5.514 0.730 -20.471 1.00 3.85 N ATOM 0 H LYS B 30 -3.890 -2.233 -17.478 1.00 2.08 H new ATOM 0 HA LYS B 30 -1.311 -2.069 -18.823 1.00 1.92 H new ATOM 0 HB2 LYS B 30 -3.401 -0.157 -17.886 1.00 2.62 H new ATOM 0 HB3 LYS B 30 -1.758 0.429 -18.058 1.00 2.62 H new ATOM 0 HG2 LYS B 30 -2.879 0.843 -20.140 1.00 2.89 H new ATOM 0 HG3 LYS B 30 -1.727 -0.449 -20.416 1.00 2.89 H new ATOM 0 HD2 LYS B 30 -3.724 -1.035 -21.591 1.00 2.82 H new ATOM 0 HD3 LYS B 30 -3.614 -2.110 -20.211 1.00 2.82 H new ATOM 0 HE2 LYS B 30 -5.924 -1.335 -20.490 1.00 3.12 H new ATOM 0 HE3 LYS B 30 -5.271 -0.735 -18.978 1.00 3.12 H new ATOM 0 HZ1 LYS B 30 -6.524 0.914 -20.305 1.00 3.85 H new ATOM 0 HZ2 LYS B 30 -4.945 1.399 -19.915 1.00 3.85 H new ATOM 0 HZ3 LYS B 30 -5.301 0.851 -21.482 1.00 3.85 H new ATOM 2119 N ASP B 31 -1.495 -0.913 -15.728 1.00 1.48 N ATOM 2120 CA ASP B 31 -0.799 -0.709 -14.467 1.00 1.30 C ATOM 2121 C ASP B 31 -1.763 -1.107 -13.350 1.00 1.21 C ATOM 2122 O ASP B 31 -1.692 -2.233 -12.859 1.00 1.31 O ATOM 2123 CB ASP B 31 -0.325 0.749 -14.355 1.00 1.55 C ATOM 2124 CG ASP B 31 0.664 1.154 -15.439 1.00 1.96 C ATOM 2125 OD1 ASP B 31 1.791 0.617 -15.441 1.00 2.77 O ATOM 2126 OD2 ASP B 31 0.287 2.044 -16.234 1.00 2.93 O ATOM 0 H ASP B 31 -2.388 -0.422 -15.774 1.00 1.48 H new ATOM 0 HA ASP B 31 0.099 -1.323 -14.396 1.00 1.30 H new ATOM 0 HB2 ASP B 31 -1.192 1.408 -14.401 1.00 1.55 H new ATOM 0 HB3 ASP B 31 0.137 0.898 -13.379 1.00 1.55 H new ATOM 2131 N SER B 32 -2.697 -0.211 -13.005 1.00 1.37 N ATOM 2132 CA SER B 32 -3.924 -0.533 -12.295 1.00 1.15 C ATOM 2133 C SER B 32 -5.079 -0.461 -13.309 1.00 1.11 C ATOM 2134 O SER B 32 -4.874 -0.728 -14.497 1.00 1.33 O ATOM 2135 CB SER B 32 -4.084 0.431 -11.106 1.00 1.12 C ATOM 2136 OG SER B 32 -5.195 0.090 -10.298 1.00 1.77 O ATOM 0 H SER B 32 -2.610 0.782 -13.222 1.00 1.37 H new ATOM 0 HA SER B 32 -3.912 -1.538 -11.874 1.00 1.15 H new ATOM 0 HB2 SER B 32 -3.177 0.416 -10.502 1.00 1.12 H new ATOM 0 HB3 SER B 32 -4.203 1.449 -11.477 1.00 1.12 H new ATOM 0 HG SER B 32 -4.930 -0.595 -9.649 1.00 1.77 H new ATOM 2142 N LEU B 33 -6.279 -0.120 -12.835 1.00 0.96 N ATOM 2143 CA LEU B 33 -7.515 -0.063 -13.606 1.00 0.99 C ATOM 2144 C LEU B 33 -7.786 1.391 -14.023 1.00 0.93 C ATOM 2145 O LEU B 33 -6.873 2.223 -14.018 1.00 0.96 O ATOM 2146 CB LEU B 33 -8.673 -0.629 -12.755 1.00 1.01 C ATOM 2147 CG LEU B 33 -8.517 -2.057 -12.207 1.00 1.14 C ATOM 2148 CD1 LEU B 33 -8.042 -3.054 -13.268 1.00 1.97 C ATOM 2149 CD2 LEU B 33 -7.629 -2.106 -10.962 1.00 1.17 C ATOM 0 H LEU B 33 -6.418 0.135 -11.857 1.00 0.96 H new ATOM 0 HA LEU B 33 -7.428 -0.667 -14.509 1.00 0.99 H new ATOM 0 HB2 LEU B 33 -8.828 0.041 -11.909 1.00 1.01 H new ATOM 0 HB3 LEU B 33 -9.581 -0.597 -13.358 1.00 1.01 H new ATOM 0 HG LEU B 33 -9.518 -2.369 -11.908 1.00 1.14 H new ATOM 0 HD11 LEU B 33 -7.951 -4.044 -12.822 1.00 1.97 H new ATOM 0 HD12 LEU B 33 -8.764 -3.089 -14.084 1.00 1.97 H new ATOM 0 HD13 LEU B 33 -7.073 -2.739 -13.655 1.00 1.97 H new ATOM 0 HD21 LEU B 33 -7.549 -3.135 -10.612 1.00 1.17 H new ATOM 0 HD22 LEU B 33 -6.637 -1.728 -11.208 1.00 1.17 H new ATOM 0 HD23 LEU B 33 -8.068 -1.489 -10.178 1.00 1.17 H new ATOM 2161 N SER B 34 -9.039 1.726 -14.345 1.00 0.93 N ATOM 2162 CA SER B 34 -9.448 3.116 -14.501 1.00 0.90 C ATOM 2163 C SER B 34 -9.673 3.722 -13.112 1.00 0.85 C ATOM 2164 O SER B 34 -9.817 2.990 -12.135 1.00 0.89 O ATOM 2165 CB SER B 34 -10.673 3.248 -15.417 1.00 0.97 C ATOM 2166 OG SER B 34 -10.654 2.258 -16.425 1.00 1.93 O ATOM 0 H SER B 34 -9.785 1.049 -14.502 1.00 0.93 H new ATOM 0 HA SER B 34 -8.657 3.678 -14.998 1.00 0.90 H new ATOM 0 HB2 SER B 34 -11.585 3.156 -14.828 1.00 0.97 H new ATOM 0 HB3 SER B 34 -10.687 4.238 -15.873 1.00 0.97 H new ATOM 0 HG SER B 34 -10.865 1.386 -16.031 1.00 1.93 H new ATOM 2172 N VAL B 35 -9.690 5.050 -12.983 1.00 0.80 N ATOM 2173 CA VAL B 35 -9.670 5.673 -11.664 1.00 0.78 C ATOM 2174 C VAL B 35 -11.044 5.560 -10.974 1.00 0.76 C ATOM 2175 O VAL B 35 -11.142 5.133 -9.824 1.00 0.73 O ATOM 2176 CB VAL B 35 -9.179 7.123 -11.790 1.00 0.91 C ATOM 2177 CG1 VAL B 35 -9.021 7.784 -10.423 1.00 0.93 C ATOM 2178 CG2 VAL B 35 -7.840 7.258 -12.534 1.00 1.02 C ATOM 0 H VAL B 35 -9.717 5.704 -13.765 1.00 0.80 H new ATOM 0 HA VAL B 35 -8.970 5.142 -11.019 1.00 0.78 H new ATOM 0 HB VAL B 35 -9.952 7.623 -12.373 1.00 0.91 H new ATOM 0 HG11 VAL B 35 -8.672 8.809 -10.552 1.00 0.93 H new ATOM 0 HG12 VAL B 35 -9.982 7.790 -9.909 1.00 0.93 H new ATOM 0 HG13 VAL B 35 -8.296 7.226 -9.831 1.00 0.93 H new ATOM 0 HG21 VAL B 35 -7.556 8.309 -12.585 1.00 1.02 H new ATOM 0 HG22 VAL B 35 -7.070 6.699 -12.002 1.00 1.02 H new ATOM 0 HG23 VAL B 35 -7.943 6.861 -13.544 1.00 1.02 H new ATOM 2188 N ASN B 36 -12.131 5.941 -11.655 1.00 0.84 N ATOM 2189 CA ASN B 36 -13.470 5.838 -11.070 1.00 0.93 C ATOM 2190 C ASN B 36 -13.806 4.364 -10.833 1.00 0.95 C ATOM 2191 O ASN B 36 -14.250 3.987 -9.751 1.00 0.98 O ATOM 2192 CB ASN B 36 -14.530 6.516 -11.953 1.00 1.09 C ATOM 2193 CG ASN B 36 -15.659 7.117 -11.113 1.00 2.05 C ATOM 2194 OD1 ASN B 36 -16.385 6.420 -10.406 1.00 2.93 O ATOM 2195 ND2 ASN B 36 -15.812 8.439 -11.147 1.00 2.49 N ATOM 0 H ASN B 36 -12.110 6.320 -12.602 1.00 0.84 H new ATOM 0 HA ASN B 36 -13.476 6.365 -10.116 1.00 0.93 H new ATOM 0 HB2 ASN B 36 -14.062 7.300 -12.549 1.00 1.09 H new ATOM 0 HB3 ASN B 36 -14.943 5.788 -12.652 1.00 1.09 H new ATOM 0 HD21 ASN B 36 -16.537 8.883 -10.583 1.00 2.49 H new ATOM 0 HD22 ASN B 36 -15.204 9.008 -11.737 1.00 2.49 H new ATOM 2202 N GLU B 37 -13.523 3.538 -11.850 1.00 0.98 N ATOM 2203 CA GLU B 37 -13.583 2.083 -11.790 1.00 1.06 C ATOM 2204 C GLU B 37 -12.923 1.595 -10.501 1.00 0.95 C ATOM 2205 O GLU B 37 -13.584 0.982 -9.672 1.00 1.01 O ATOM 2206 CB GLU B 37 -12.896 1.515 -13.039 1.00 1.16 C ATOM 2207 CG GLU B 37 -12.906 -0.016 -13.133 1.00 1.44 C ATOM 2208 CD GLU B 37 -12.138 -0.508 -14.355 1.00 2.48 C ATOM 2209 OE1 GLU B 37 -11.266 0.258 -14.829 1.00 3.22 O ATOM 2210 OE2 GLU B 37 -12.414 -1.647 -14.779 1.00 3.27 O ATOM 0 H GLU B 37 -13.237 3.883 -12.766 1.00 0.98 H new ATOM 0 HA GLU B 37 -14.616 1.736 -11.777 1.00 1.06 H new ATOM 0 HB2 GLU B 37 -13.385 1.923 -13.924 1.00 1.16 H new ATOM 0 HB3 GLU B 37 -11.862 1.860 -13.058 1.00 1.16 H new ATOM 0 HG2 GLU B 37 -12.465 -0.439 -12.231 1.00 1.44 H new ATOM 0 HG3 GLU B 37 -13.935 -0.371 -13.182 1.00 1.44 H new ATOM 2217 N PHE B 38 -11.638 1.914 -10.308 1.00 0.84 N ATOM 2218 CA PHE B 38 -10.913 1.666 -9.069 1.00 0.71 C ATOM 2219 C PHE B 38 -11.748 2.046 -7.845 1.00 0.68 C ATOM 2220 O PHE B 38 -11.933 1.211 -6.965 1.00 0.68 O ATOM 2221 CB PHE B 38 -9.556 2.384 -9.082 1.00 0.64 C ATOM 2222 CG PHE B 38 -9.028 2.786 -7.718 1.00 0.80 C ATOM 2223 CD1 PHE B 38 -8.410 1.831 -6.894 1.00 1.53 C ATOM 2224 CD2 PHE B 38 -9.237 4.091 -7.234 1.00 2.04 C ATOM 2225 CE1 PHE B 38 -7.921 2.208 -5.633 1.00 1.66 C ATOM 2226 CE2 PHE B 38 -8.860 4.428 -5.925 1.00 2.41 C ATOM 2227 CZ PHE B 38 -8.162 3.500 -5.138 1.00 1.65 C ATOM 0 H PHE B 38 -11.067 2.360 -11.026 1.00 0.84 H new ATOM 0 HA PHE B 38 -10.720 0.596 -8.998 1.00 0.71 H new ATOM 0 HB2 PHE B 38 -8.823 1.735 -9.561 1.00 0.64 H new ATOM 0 HB3 PHE B 38 -9.641 3.278 -9.699 1.00 0.64 H new ATOM 0 HD1 PHE B 38 -8.311 0.809 -7.230 1.00 1.53 H new ATOM 0 HD2 PHE B 38 -9.689 4.836 -7.872 1.00 2.04 H new ATOM 0 HE1 PHE B 38 -7.357 1.502 -5.041 1.00 1.66 H new ATOM 0 HE2 PHE B 38 -9.107 5.400 -5.524 1.00 2.41 H new ATOM 0 HZ PHE B 38 -7.811 3.778 -4.155 1.00 1.65 H new ATOM 2237 N LYS B 39 -12.260 3.282 -7.775 1.00 0.72 N ATOM 2238 CA LYS B 39 -13.063 3.708 -6.631 1.00 0.78 C ATOM 2239 C LYS B 39 -14.253 2.751 -6.388 1.00 0.91 C ATOM 2240 O LYS B 39 -14.540 2.400 -5.241 1.00 0.98 O ATOM 2241 CB LYS B 39 -13.371 5.230 -6.686 1.00 0.86 C ATOM 2242 CG LYS B 39 -14.761 5.663 -6.185 1.00 1.26 C ATOM 2243 CD LYS B 39 -15.704 5.732 -7.392 1.00 2.17 C ATOM 2244 CE LYS B 39 -17.134 6.170 -7.050 1.00 2.99 C ATOM 2245 NZ LYS B 39 -17.999 6.130 -8.252 1.00 4.21 N ATOM 0 H LYS B 39 -12.132 3.996 -8.492 1.00 0.72 H new ATOM 0 HA LYS B 39 -12.483 3.612 -5.713 1.00 0.78 H new ATOM 0 HB2 LYS B 39 -12.617 5.753 -6.098 1.00 0.86 H new ATOM 0 HB3 LYS B 39 -13.259 5.565 -7.717 1.00 0.86 H new ATOM 0 HG2 LYS B 39 -15.138 4.954 -5.448 1.00 1.26 H new ATOM 0 HG3 LYS B 39 -14.702 6.633 -5.692 1.00 1.26 H new ATOM 0 HD2 LYS B 39 -15.289 6.425 -8.124 1.00 2.17 H new ATOM 0 HD3 LYS B 39 -15.740 4.752 -7.867 1.00 2.17 H new ATOM 0 HE2 LYS B 39 -17.544 5.517 -6.279 1.00 2.99 H new ATOM 0 HE3 LYS B 39 -17.121 7.180 -6.639 1.00 2.99 H new ATOM 0 HZ1 LYS B 39 -18.721 6.876 -8.185 1.00 4.21 H new ATOM 0 HZ2 LYS B 39 -17.420 6.284 -9.102 1.00 4.21 H new ATOM 0 HZ3 LYS B 39 -18.465 5.202 -8.314 1.00 4.21 H new ATOM 2259 N GLU B 40 -14.933 2.292 -7.444 1.00 1.00 N ATOM 2260 CA GLU B 40 -16.035 1.339 -7.298 1.00 1.11 C ATOM 2261 C GLU B 40 -15.547 -0.088 -7.004 1.00 1.08 C ATOM 2262 O GLU B 40 -16.221 -0.858 -6.323 1.00 1.35 O ATOM 2263 CB GLU B 40 -16.979 1.404 -8.506 1.00 1.24 C ATOM 2264 CG GLU B 40 -17.437 2.855 -8.701 1.00 1.34 C ATOM 2265 CD GLU B 40 -18.776 3.008 -9.398 1.00 1.62 C ATOM 2266 OE1 GLU B 40 -19.218 2.059 -10.073 1.00 2.27 O ATOM 2267 OE2 GLU B 40 -19.321 4.122 -9.224 1.00 2.27 O ATOM 0 H GLU B 40 -14.739 2.565 -8.407 1.00 1.00 H new ATOM 0 HA GLU B 40 -16.609 1.636 -6.420 1.00 1.11 H new ATOM 0 HB2 GLU B 40 -16.471 1.046 -9.401 1.00 1.24 H new ATOM 0 HB3 GLU B 40 -17.840 0.755 -8.347 1.00 1.24 H new ATOM 0 HG2 GLU B 40 -17.493 3.338 -7.726 1.00 1.34 H new ATOM 0 HG3 GLU B 40 -16.680 3.387 -9.277 1.00 1.34 H new ATOM 2274 N LEU B 41 -14.363 -0.450 -7.493 1.00 0.89 N ATOM 2275 CA LEU B 41 -13.725 -1.724 -7.210 1.00 0.86 C ATOM 2276 C LEU B 41 -13.445 -1.794 -5.708 1.00 0.71 C ATOM 2277 O LEU B 41 -13.957 -2.663 -5.006 1.00 0.76 O ATOM 2278 CB LEU B 41 -12.469 -1.837 -8.091 1.00 0.94 C ATOM 2279 CG LEU B 41 -11.780 -3.209 -8.130 1.00 1.94 C ATOM 2280 CD1 LEU B 41 -10.887 -3.250 -9.376 1.00 3.04 C ATOM 2281 CD2 LEU B 41 -10.895 -3.456 -6.900 1.00 4.09 C ATOM 0 H LEU B 41 -13.813 0.149 -8.109 1.00 0.89 H new ATOM 0 HA LEU B 41 -14.357 -2.579 -7.452 1.00 0.86 H new ATOM 0 HB2 LEU B 41 -12.742 -1.563 -9.110 1.00 0.94 H new ATOM 0 HB3 LEU B 41 -11.743 -1.100 -7.746 1.00 0.94 H new ATOM 0 HG LEU B 41 -12.553 -3.977 -8.145 1.00 1.94 H new ATOM 0 HD11 LEU B 41 -10.383 -4.215 -9.431 1.00 3.04 H new ATOM 0 HD12 LEU B 41 -11.499 -3.109 -10.267 1.00 3.04 H new ATOM 0 HD13 LEU B 41 -10.143 -2.455 -9.317 1.00 3.04 H new ATOM 0 HD21 LEU B 41 -10.431 -4.439 -6.977 1.00 4.09 H new ATOM 0 HD22 LEU B 41 -10.119 -2.692 -6.851 1.00 4.09 H new ATOM 0 HD23 LEU B 41 -11.505 -3.412 -5.998 1.00 4.09 H new ATOM 2293 N VAL B 42 -12.656 -0.853 -5.185 1.00 0.63 N ATOM 2294 CA VAL B 42 -12.274 -0.878 -3.781 1.00 0.65 C ATOM 2295 C VAL B 42 -13.495 -0.862 -2.861 1.00 0.80 C ATOM 2296 O VAL B 42 -13.557 -1.670 -1.942 1.00 0.87 O ATOM 2297 CB VAL B 42 -11.237 0.199 -3.432 1.00 0.67 C ATOM 2298 CG1 VAL B 42 -9.946 -0.058 -4.215 1.00 1.46 C ATOM 2299 CG2 VAL B 42 -11.749 1.623 -3.672 1.00 1.82 C ATOM 0 H VAL B 42 -12.273 -0.069 -5.714 1.00 0.63 H new ATOM 0 HA VAL B 42 -11.771 -1.829 -3.604 1.00 0.65 H new ATOM 0 HB VAL B 42 -11.038 0.127 -2.363 1.00 0.67 H new ATOM 0 HG11 VAL B 42 -9.211 0.707 -3.966 1.00 1.46 H new ATOM 0 HG12 VAL B 42 -9.551 -1.039 -3.953 1.00 1.46 H new ATOM 0 HG13 VAL B 42 -10.156 -0.025 -5.284 1.00 1.46 H new ATOM 0 HG21 VAL B 42 -10.971 2.339 -3.407 1.00 1.82 H new ATOM 0 HG22 VAL B 42 -12.010 1.743 -4.723 1.00 1.82 H new ATOM 0 HG23 VAL B 42 -12.631 1.801 -3.057 1.00 1.82 H new ATOM 2309 N THR B 43 -14.495 -0.008 -3.099 1.00 0.94 N ATOM 2310 CA THR B 43 -15.669 -0.014 -2.225 1.00 1.13 C ATOM 2311 C THR B 43 -16.332 -1.399 -2.167 1.00 1.15 C ATOM 2312 O THR B 43 -16.922 -1.747 -1.149 1.00 1.38 O ATOM 2313 CB THR B 43 -16.673 1.101 -2.568 1.00 1.35 C ATOM 2314 OG1 THR B 43 -17.436 1.411 -1.421 1.00 1.75 O ATOM 2315 CG2 THR B 43 -17.647 0.729 -3.687 1.00 1.69 C ATOM 0 H THR B 43 -14.518 0.671 -3.859 1.00 0.94 H new ATOM 0 HA THR B 43 -15.307 0.208 -1.221 1.00 1.13 H new ATOM 0 HB THR B 43 -16.079 1.948 -2.912 1.00 1.35 H new ATOM 0 HG1 THR B 43 -18.075 2.122 -1.636 1.00 1.75 H new ATOM 0 HG21 THR B 43 -18.323 1.563 -3.873 1.00 1.69 H new ATOM 0 HG22 THR B 43 -17.089 0.505 -4.596 1.00 1.69 H new ATOM 0 HG23 THR B 43 -18.224 -0.147 -3.391 1.00 1.69 H new ATOM 2323 N GLN B 44 -16.244 -2.183 -3.249 1.00 1.06 N ATOM 2324 CA GLN B 44 -16.751 -3.544 -3.276 1.00 1.12 C ATOM 2325 C GLN B 44 -15.808 -4.462 -2.489 1.00 1.01 C ATOM 2326 O GLN B 44 -16.233 -5.181 -1.590 1.00 1.03 O ATOM 2327 CB GLN B 44 -16.887 -3.993 -4.737 1.00 1.19 C ATOM 2328 CG GLN B 44 -17.693 -5.285 -4.852 1.00 2.50 C ATOM 2329 CD GLN B 44 -17.428 -5.965 -6.190 1.00 3.29 C ATOM 2330 OE1 GLN B 44 -16.729 -6.973 -6.249 1.00 4.49 O ATOM 2331 NE2 GLN B 44 -17.957 -5.412 -7.276 1.00 3.29 N ATOM 0 H GLN B 44 -15.818 -1.883 -4.126 1.00 1.06 H new ATOM 0 HA GLN B 44 -17.733 -3.595 -2.805 1.00 1.12 H new ATOM 0 HB2 GLN B 44 -17.372 -3.207 -5.317 1.00 1.19 H new ATOM 0 HB3 GLN B 44 -15.896 -4.141 -5.167 1.00 1.19 H new ATOM 0 HG2 GLN B 44 -17.429 -5.959 -4.037 1.00 2.50 H new ATOM 0 HG3 GLN B 44 -18.756 -5.067 -4.753 1.00 2.50 H new ATOM 0 HE21 GLN B 44 -18.533 -4.575 -7.193 1.00 3.29 H new ATOM 0 HE22 GLN B 44 -17.787 -5.825 -8.193 1.00 3.29 H new ATOM 2340 N GLN B 45 -14.523 -4.446 -2.850 1.00 0.96 N ATOM 2341 CA GLN B 45 -13.499 -5.310 -2.271 1.00 0.93 C ATOM 2342 C GLN B 45 -13.257 -5.037 -0.786 1.00 0.88 C ATOM 2343 O GLN B 45 -12.712 -5.903 -0.102 1.00 0.90 O ATOM 2344 CB GLN B 45 -12.189 -5.141 -3.049 1.00 0.98 C ATOM 2345 CG GLN B 45 -12.063 -6.023 -4.292 1.00 0.94 C ATOM 2346 CD GLN B 45 -13.302 -6.073 -5.187 1.00 1.17 C ATOM 2347 OE1 GLN B 45 -13.423 -5.316 -6.141 1.00 1.81 O ATOM 2348 NE2 GLN B 45 -14.215 -7.001 -4.907 1.00 1.93 N ATOM 0 H GLN B 45 -14.161 -3.818 -3.568 1.00 0.96 H new ATOM 0 HA GLN B 45 -13.861 -6.335 -2.349 1.00 0.93 H new ATOM 0 HB2 GLN B 45 -12.093 -4.098 -3.350 1.00 0.98 H new ATOM 0 HB3 GLN B 45 -11.355 -5.358 -2.381 1.00 0.98 H new ATOM 0 HG2 GLN B 45 -11.221 -5.668 -4.885 1.00 0.94 H new ATOM 0 HG3 GLN B 45 -11.823 -7.038 -3.974 1.00 0.94 H new ATOM 0 HE21 GLN B 45 -14.086 -7.618 -4.105 1.00 1.93 H new ATOM 0 HE22 GLN B 45 -15.043 -7.095 -5.495 1.00 1.93 H new ATOM 2357 N LEU B 46 -13.621 -3.849 -0.297 1.00 0.87 N ATOM 2358 CA LEU B 46 -13.426 -3.411 1.077 1.00 0.89 C ATOM 2359 C LEU B 46 -14.767 -3.443 1.836 1.00 0.82 C ATOM 2360 O LEU B 46 -15.253 -2.377 2.210 1.00 0.88 O ATOM 2361 CB LEU B 46 -12.878 -1.962 1.081 1.00 1.08 C ATOM 2362 CG LEU B 46 -11.536 -1.596 0.400 1.00 1.60 C ATOM 2363 CD1 LEU B 46 -10.536 -1.067 1.434 1.00 1.76 C ATOM 2364 CD2 LEU B 46 -10.877 -2.655 -0.496 1.00 3.09 C ATOM 0 H LEU B 46 -14.077 -3.142 -0.874 1.00 0.87 H new ATOM 0 HA LEU B 46 -12.718 -4.079 1.566 1.00 0.89 H new ATOM 0 HB2 LEU B 46 -13.644 -1.334 0.627 1.00 1.08 H new ATOM 0 HB3 LEU B 46 -12.795 -1.659 2.125 1.00 1.08 H new ATOM 0 HG LEU B 46 -11.823 -0.820 -0.309 1.00 1.60 H new ATOM 0 HD11 LEU B 46 -9.599 -0.815 0.938 1.00 1.76 H new ATOM 0 HD12 LEU B 46 -10.944 -0.177 1.913 1.00 1.76 H new ATOM 0 HD13 LEU B 46 -10.353 -1.833 2.188 1.00 1.76 H new ATOM 0 HD21 LEU B 46 -9.947 -2.259 -0.904 1.00 3.09 H new ATOM 0 HD22 LEU B 46 -10.665 -3.548 0.092 1.00 3.09 H new ATOM 0 HD23 LEU B 46 -11.551 -2.911 -1.313 1.00 3.09 H new ATOM 2376 N PRO B 47 -15.390 -4.600 2.136 1.00 0.80 N ATOM 2377 CA PRO B 47 -16.737 -4.648 2.707 1.00 0.82 C ATOM 2378 C PRO B 47 -16.783 -4.299 4.207 1.00 0.87 C ATOM 2379 O PRO B 47 -17.611 -4.839 4.939 1.00 1.19 O ATOM 2380 CB PRO B 47 -17.207 -6.085 2.446 1.00 0.93 C ATOM 2381 CG PRO B 47 -15.908 -6.876 2.574 1.00 0.95 C ATOM 2382 CD PRO B 47 -14.924 -5.950 1.862 1.00 0.84 C ATOM 0 HA PRO B 47 -17.383 -3.899 2.250 1.00 0.82 H new ATOM 0 HB2 PRO B 47 -17.954 -6.408 3.172 1.00 0.93 H new ATOM 0 HB3 PRO B 47 -17.655 -6.194 1.458 1.00 0.93 H new ATOM 0 HG2 PRO B 47 -15.632 -7.048 3.614 1.00 0.95 H new ATOM 0 HG3 PRO B 47 -15.973 -7.853 2.096 1.00 0.95 H new ATOM 0 HD2 PRO B 47 -13.909 -6.097 2.232 1.00 0.84 H new ATOM 0 HD3 PRO B 47 -14.904 -6.148 0.790 1.00 0.84 H new ATOM 2390 N HIS B 48 -15.915 -3.397 4.676 1.00 1.10 N ATOM 2391 CA HIS B 48 -15.963 -2.872 6.030 1.00 1.33 C ATOM 2392 C HIS B 48 -17.015 -1.742 6.089 1.00 1.59 C ATOM 2393 O HIS B 48 -17.806 -1.568 5.166 1.00 3.06 O ATOM 2394 CB HIS B 48 -14.546 -2.436 6.439 1.00 1.58 C ATOM 2395 CG HIS B 48 -14.363 -2.297 7.930 1.00 1.73 C ATOM 2396 ND1 HIS B 48 -14.155 -1.117 8.606 1.00 3.11 N ATOM 2397 CD2 HIS B 48 -14.521 -3.286 8.866 1.00 2.29 C ATOM 2398 CE1 HIS B 48 -14.195 -1.387 9.921 1.00 3.54 C ATOM 2399 NE2 HIS B 48 -14.417 -2.692 10.128 1.00 3.20 N ATOM 0 H HIS B 48 -15.155 -3.012 4.115 1.00 1.10 H new ATOM 0 HA HIS B 48 -16.278 -3.625 6.753 1.00 1.33 H new ATOM 0 HB2 HIS B 48 -13.828 -3.163 6.060 1.00 1.58 H new ATOM 0 HB3 HIS B 48 -14.317 -1.483 5.963 1.00 1.58 H new ATOM 0 HD2 HIS B 48 -14.694 -4.333 8.666 1.00 2.29 H new ATOM 0 HE1 HIS B 48 -14.066 -0.654 10.703 1.00 3.54 H new ATOM 0 HE2 HIS B 48 -14.495 -3.161 11.030 1.00 3.20 H new ATOM 2407 N LEU B 49 -17.019 -0.946 7.165 1.00 1.36 N ATOM 2408 CA LEU B 49 -18.024 0.087 7.425 1.00 1.35 C ATOM 2409 C LEU B 49 -18.145 1.127 6.295 1.00 1.34 C ATOM 2410 O LEU B 49 -19.255 1.473 5.904 1.00 1.43 O ATOM 2411 CB LEU B 49 -17.722 0.752 8.781 1.00 1.44 C ATOM 2412 CG LEU B 49 -18.969 1.089 9.616 1.00 1.63 C ATOM 2413 CD1 LEU B 49 -18.520 1.683 10.956 1.00 2.52 C ATOM 2414 CD2 LEU B 49 -19.910 2.078 8.920 1.00 2.91 C ATOM 0 H LEU B 49 -16.308 -1.005 7.894 1.00 1.36 H new ATOM 0 HA LEU B 49 -18.999 -0.400 7.462 1.00 1.35 H new ATOM 0 HB2 LEU B 49 -17.079 0.090 9.361 1.00 1.44 H new ATOM 0 HB3 LEU B 49 -17.159 1.669 8.605 1.00 1.44 H new ATOM 0 HG LEU B 49 -19.526 0.163 9.756 1.00 1.63 H new ATOM 0 HD11 LEU B 49 -19.396 1.926 11.558 1.00 2.52 H new ATOM 0 HD12 LEU B 49 -17.905 0.957 11.488 1.00 2.52 H new ATOM 0 HD13 LEU B 49 -17.940 2.588 10.777 1.00 2.52 H new ATOM 0 HD21 LEU B 49 -20.770 2.274 9.561 1.00 2.91 H new ATOM 0 HD22 LEU B 49 -19.380 3.011 8.728 1.00 2.91 H new ATOM 0 HD23 LEU B 49 -20.251 1.653 7.976 1.00 2.91 H new ATOM 2426 N LEU B 50 -17.016 1.657 5.801 1.00 1.38 N ATOM 2427 CA LEU B 50 -16.960 2.662 4.737 1.00 1.42 C ATOM 2428 C LEU B 50 -17.641 3.963 5.173 1.00 1.37 C ATOM 2429 O LEU B 50 -18.547 4.484 4.528 1.00 1.46 O ATOM 2430 CB LEU B 50 -17.511 2.113 3.416 1.00 1.63 C ATOM 2431 CG LEU B 50 -16.708 0.900 2.920 1.00 1.78 C ATOM 2432 CD1 LEU B 50 -17.623 0.057 2.036 1.00 2.66 C ATOM 2433 CD2 LEU B 50 -15.456 1.338 2.154 1.00 2.82 C ATOM 0 H LEU B 50 -16.093 1.389 6.142 1.00 1.38 H new ATOM 0 HA LEU B 50 -15.914 2.904 4.551 1.00 1.42 H new ATOM 0 HB2 LEU B 50 -18.555 1.828 3.549 1.00 1.63 H new ATOM 0 HB3 LEU B 50 -17.488 2.897 2.659 1.00 1.63 H new ATOM 0 HG LEU B 50 -16.365 0.312 3.771 1.00 1.78 H new ATOM 0 HD11 LEU B 50 -17.076 -0.812 1.670 1.00 2.66 H new ATOM 0 HD12 LEU B 50 -18.485 -0.274 2.616 1.00 2.66 H new ATOM 0 HD13 LEU B 50 -17.963 0.654 1.190 1.00 2.66 H new ATOM 0 HD21 LEU B 50 -14.909 0.457 1.816 1.00 2.82 H new ATOM 0 HD22 LEU B 50 -15.748 1.937 1.291 1.00 2.82 H new ATOM 0 HD23 LEU B 50 -14.818 1.932 2.809 1.00 2.82 H new ATOM 2445 N LYS B 51 -17.175 4.478 6.311 1.00 1.32 N ATOM 2446 CA LYS B 51 -17.636 5.720 6.925 1.00 1.35 C ATOM 2447 C LYS B 51 -17.143 6.957 6.160 1.00 1.32 C ATOM 2448 O LYS B 51 -17.810 7.986 6.149 1.00 1.42 O ATOM 2449 CB LYS B 51 -17.177 5.732 8.391 1.00 1.41 C ATOM 2450 CG LYS B 51 -15.646 5.717 8.540 1.00 1.40 C ATOM 2451 CD LYS B 51 -15.025 7.125 8.514 1.00 1.63 C ATOM 2452 CE LYS B 51 -14.306 7.492 9.819 1.00 1.86 C ATOM 2453 NZ LYS B 51 -13.327 8.580 9.605 1.00 3.40 N ATOM 0 H LYS B 51 -16.438 4.023 6.850 1.00 1.32 H new ATOM 0 HA LYS B 51 -18.724 5.763 6.884 1.00 1.35 H new ATOM 0 HB2 LYS B 51 -17.576 6.618 8.884 1.00 1.41 H new ATOM 0 HB3 LYS B 51 -17.595 4.866 8.904 1.00 1.41 H new ATOM 0 HG2 LYS B 51 -15.383 5.227 9.477 1.00 1.40 H new ATOM 0 HG3 LYS B 51 -15.214 5.121 7.736 1.00 1.40 H new ATOM 0 HD2 LYS B 51 -14.318 7.188 7.687 1.00 1.63 H new ATOM 0 HD3 LYS B 51 -15.809 7.857 8.320 1.00 1.63 H new ATOM 0 HE2 LYS B 51 -15.038 7.800 10.566 1.00 1.86 H new ATOM 0 HE3 LYS B 51 -13.796 6.614 10.215 1.00 1.86 H new ATOM 0 HZ1 LYS B 51 -12.943 8.887 10.522 1.00 3.40 H new ATOM 0 HZ2 LYS B 51 -12.552 8.236 9.003 1.00 3.40 H new ATOM 0 HZ3 LYS B 51 -13.796 9.383 9.140 1.00 3.40 H new ATOM 2467 N ASP B 52 -15.941 6.842 5.592 1.00 1.23 N ATOM 2468 CA ASP B 52 -15.311 7.645 4.560 1.00 1.12 C ATOM 2469 C ASP B 52 -15.642 9.140 4.553 1.00 1.16 C ATOM 2470 O ASP B 52 -16.594 9.572 3.910 1.00 1.29 O ATOM 2471 CB ASP B 52 -15.464 6.931 3.207 1.00 1.24 C ATOM 2472 CG ASP B 52 -14.956 5.485 3.227 1.00 1.71 C ATOM 2473 OD1 ASP B 52 -14.603 5.010 4.335 1.00 2.65 O ATOM 2474 OD2 ASP B 52 -14.964 4.856 2.150 1.00 2.31 O ATOM 0 H ASP B 52 -15.317 6.090 5.886 1.00 1.23 H new ATOM 0 HA ASP B 52 -14.251 7.703 4.806 1.00 1.12 H new ATOM 0 HB2 ASP B 52 -16.515 6.936 2.917 1.00 1.24 H new ATOM 0 HB3 ASP B 52 -14.921 7.490 2.445 1.00 1.24 H new ATOM 2479 N VAL B 53 -14.811 9.934 5.246 1.00 1.32 N ATOM 2480 CA VAL B 53 -14.868 11.392 5.241 1.00 1.55 C ATOM 2481 C VAL B 53 -13.461 11.998 5.172 1.00 1.60 C ATOM 2482 O VAL B 53 -12.483 11.362 5.573 1.00 1.83 O ATOM 2483 CB VAL B 53 -15.635 11.921 6.470 1.00 2.08 C ATOM 2484 CG1 VAL B 53 -17.129 11.590 6.387 1.00 3.24 C ATOM 2485 CG2 VAL B 53 -15.066 11.386 7.791 1.00 2.23 C ATOM 0 H VAL B 53 -14.066 9.565 5.837 1.00 1.32 H new ATOM 0 HA VAL B 53 -15.411 11.701 4.348 1.00 1.55 H new ATOM 0 HB VAL B 53 -15.508 13.003 6.458 1.00 2.08 H new ATOM 0 HG11 VAL B 53 -17.637 11.978 7.270 1.00 3.24 H new ATOM 0 HG12 VAL B 53 -17.554 12.047 5.493 1.00 3.24 H new ATOM 0 HG13 VAL B 53 -17.260 10.509 6.339 1.00 3.24 H new ATOM 0 HG21 VAL B 53 -15.641 11.789 8.625 1.00 2.23 H new ATOM 0 HG22 VAL B 53 -15.128 10.298 7.800 1.00 2.23 H new ATOM 0 HG23 VAL B 53 -14.024 11.691 7.888 1.00 2.23 H new ATOM 2495 N GLY B 54 -13.357 13.233 4.676 1.00 1.80 N ATOM 2496 CA GLY B 54 -12.160 14.057 4.703 1.00 1.97 C ATOM 2497 C GLY B 54 -11.202 13.626 3.603 1.00 1.62 C ATOM 2498 O GLY B 54 -11.096 14.264 2.556 1.00 1.93 O ATOM 0 H GLY B 54 -14.144 13.701 4.226 1.00 1.80 H new ATOM 0 HA2 GLY B 54 -12.428 15.105 4.572 1.00 1.97 H new ATOM 0 HA3 GLY B 54 -11.673 13.972 5.674 1.00 1.97 H new ATOM 2502 N SER B 55 -10.511 12.508 3.832 1.00 1.23 N ATOM 2503 CA SER B 55 -9.700 11.909 2.784 1.00 1.02 C ATOM 2504 C SER B 55 -10.617 11.412 1.656 1.00 0.96 C ATOM 2505 O SER B 55 -10.214 11.383 0.497 1.00 1.08 O ATOM 2506 CB SER B 55 -8.744 10.847 3.350 1.00 1.07 C ATOM 2507 OG SER B 55 -8.773 10.830 4.773 1.00 1.83 O ATOM 0 H SER B 55 -10.499 12.009 4.722 1.00 1.23 H new ATOM 0 HA SER B 55 -9.040 12.656 2.344 1.00 1.02 H new ATOM 0 HB2 SER B 55 -9.020 9.865 2.967 1.00 1.07 H new ATOM 0 HB3 SER B 55 -7.729 11.049 3.007 1.00 1.07 H new ATOM 0 HG SER B 55 -8.902 9.910 5.087 1.00 1.83 H new ATOM 2513 N LEU B 56 -11.878 11.097 1.982 1.00 0.91 N ATOM 2514 CA LEU B 56 -12.911 10.841 0.989 1.00 0.91 C ATOM 2515 C LEU B 56 -12.991 12.032 0.052 1.00 0.93 C ATOM 2516 O LEU B 56 -12.750 11.881 -1.141 1.00 0.94 O ATOM 2517 CB LEU B 56 -14.255 10.572 1.679 1.00 0.98 C ATOM 2518 CG LEU B 56 -15.466 10.325 0.760 1.00 1.46 C ATOM 2519 CD1 LEU B 56 -16.109 11.610 0.222 1.00 1.85 C ATOM 2520 CD2 LEU B 56 -15.160 9.339 -0.374 1.00 2.41 C ATOM 0 H LEU B 56 -12.203 11.014 2.945 1.00 0.91 H new ATOM 0 HA LEU B 56 -12.664 9.953 0.407 1.00 0.91 H new ATOM 0 HB2 LEU B 56 -14.137 9.704 2.327 1.00 0.98 H new ATOM 0 HB3 LEU B 56 -14.484 11.422 2.322 1.00 0.98 H new ATOM 0 HG LEU B 56 -16.209 9.859 1.407 1.00 1.46 H new ATOM 0 HD11 LEU B 56 -16.954 11.354 -0.417 1.00 1.85 H new ATOM 0 HD12 LEU B 56 -16.456 12.220 1.056 1.00 1.85 H new ATOM 0 HD13 LEU B 56 -15.374 12.170 -0.356 1.00 1.85 H new ATOM 0 HD21 LEU B 56 -16.050 9.204 -0.989 1.00 2.41 H new ATOM 0 HD22 LEU B 56 -14.350 9.732 -0.989 1.00 2.41 H new ATOM 0 HD23 LEU B 56 -14.862 8.379 0.049 1.00 2.41 H new ATOM 2532 N ASP B 57 -13.301 13.207 0.597 1.00 1.06 N ATOM 2533 CA ASP B 57 -13.520 14.437 -0.142 1.00 1.19 C ATOM 2534 C ASP B 57 -12.322 14.714 -1.053 1.00 1.15 C ATOM 2535 O ASP B 57 -12.475 14.904 -2.264 1.00 1.22 O ATOM 2536 CB ASP B 57 -13.765 15.583 0.855 1.00 1.42 C ATOM 2537 CG ASP B 57 -14.851 15.261 1.880 1.00 2.76 C ATOM 2538 OD1 ASP B 57 -14.651 14.272 2.627 1.00 4.03 O ATOM 2539 OD2 ASP B 57 -15.853 16.002 1.905 1.00 3.75 O ATOM 0 H ASP B 57 -13.409 13.327 1.604 1.00 1.06 H new ATOM 0 HA ASP B 57 -14.399 14.348 -0.780 1.00 1.19 H new ATOM 0 HB2 ASP B 57 -12.835 15.808 1.378 1.00 1.42 H new ATOM 0 HB3 ASP B 57 -14.047 16.481 0.305 1.00 1.42 H new ATOM 2544 N GLU B 58 -11.118 14.682 -0.465 1.00 1.12 N ATOM 2545 CA GLU B 58 -9.850 14.768 -1.176 1.00 1.15 C ATOM 2546 C GLU B 58 -9.816 13.882 -2.425 1.00 1.06 C ATOM 2547 O GLU B 58 -9.287 14.300 -3.460 1.00 1.15 O ATOM 2548 CB GLU B 58 -8.689 14.375 -0.251 1.00 1.19 C ATOM 2549 CG GLU B 58 -8.327 15.462 0.768 1.00 1.70 C ATOM 2550 CD GLU B 58 -7.265 16.400 0.212 1.00 2.84 C ATOM 2551 OE1 GLU B 58 -7.506 16.924 -0.899 1.00 4.15 O ATOM 2552 OE2 GLU B 58 -6.210 16.529 0.867 1.00 3.41 O ATOM 0 H GLU B 58 -11.004 14.593 0.545 1.00 1.12 H new ATOM 0 HA GLU B 58 -9.743 15.805 -1.495 1.00 1.15 H new ATOM 0 HB2 GLU B 58 -8.952 13.461 0.282 1.00 1.19 H new ATOM 0 HB3 GLU B 58 -7.812 14.149 -0.857 1.00 1.19 H new ATOM 0 HG2 GLU B 58 -9.219 16.031 1.030 1.00 1.70 H new ATOM 0 HG3 GLU B 58 -7.964 14.999 1.685 1.00 1.70 H new ATOM 2559 N LYS B 59 -10.334 12.660 -2.312 1.00 1.02 N ATOM 2560 CA LYS B 59 -10.314 11.655 -3.360 1.00 1.00 C ATOM 2561 C LYS B 59 -11.426 11.895 -4.380 1.00 0.96 C ATOM 2562 O LYS B 59 -11.166 11.909 -5.581 1.00 1.04 O ATOM 2563 CB LYS B 59 -10.430 10.271 -2.704 1.00 0.96 C ATOM 2564 CG LYS B 59 -9.458 9.247 -3.288 1.00 1.07 C ATOM 2565 CD LYS B 59 -9.100 8.164 -2.263 1.00 1.03 C ATOM 2566 CE LYS B 59 -10.263 7.303 -1.760 1.00 1.13 C ATOM 2567 NZ LYS B 59 -11.083 8.021 -0.764 1.00 1.54 N ATOM 0 H LYS B 59 -10.792 12.337 -1.460 1.00 1.02 H new ATOM 0 HA LYS B 59 -9.376 11.715 -3.912 1.00 1.00 H new ATOM 0 HB2 LYS B 59 -10.248 10.367 -1.634 1.00 0.96 H new ATOM 0 HB3 LYS B 59 -11.449 9.904 -2.822 1.00 0.96 H new ATOM 0 HG2 LYS B 59 -9.902 8.783 -4.169 1.00 1.07 H new ATOM 0 HG3 LYS B 59 -8.550 9.752 -3.617 1.00 1.07 H new ATOM 0 HD2 LYS B 59 -8.352 7.506 -2.706 1.00 1.03 H new ATOM 0 HD3 LYS B 59 -8.633 8.645 -1.404 1.00 1.03 H new ATOM 0 HE2 LYS B 59 -10.889 7.009 -2.602 1.00 1.13 H new ATOM 0 HE3 LYS B 59 -9.873 6.387 -1.317 1.00 1.13 H new ATOM 0 HZ1 LYS B 59 -11.605 7.334 -0.183 1.00 1.54 H new ATOM 0 HZ2 LYS B 59 -10.465 8.593 -0.153 1.00 1.54 H new ATOM 0 HZ3 LYS B 59 -11.758 8.643 -1.253 1.00 1.54 H new ATOM 2581 N MET B 60 -12.664 12.065 -3.910 1.00 0.91 N ATOM 2582 CA MET B 60 -13.839 12.242 -4.749 1.00 0.92 C ATOM 2583 C MET B 60 -13.583 13.323 -5.790 1.00 1.01 C ATOM 2584 O MET B 60 -13.753 13.067 -6.978 1.00 1.00 O ATOM 2585 CB MET B 60 -15.076 12.563 -3.893 1.00 1.00 C ATOM 2586 CG MET B 60 -15.909 11.308 -3.595 1.00 1.80 C ATOM 2587 SD MET B 60 -17.298 10.970 -4.714 1.00 3.16 S ATOM 2588 CE MET B 60 -16.506 10.897 -6.333 1.00 4.08 C ATOM 0 H MET B 60 -12.876 12.083 -2.912 1.00 0.91 H new ATOM 0 HA MET B 60 -14.040 11.309 -5.275 1.00 0.92 H new ATOM 0 HB2 MET B 60 -14.760 13.020 -2.955 1.00 1.00 H new ATOM 0 HB3 MET B 60 -15.696 13.295 -4.411 1.00 1.00 H new ATOM 0 HG2 MET B 60 -15.243 10.446 -3.609 1.00 1.80 H new ATOM 0 HG3 MET B 60 -16.301 11.392 -2.581 1.00 1.80 H new ATOM 0 HE1 MET B 60 -17.254 10.678 -7.095 1.00 4.08 H new ATOM 0 HE2 MET B 60 -16.036 11.856 -6.552 1.00 4.08 H new ATOM 0 HE3 MET B 60 -15.749 10.113 -6.333 1.00 4.08 H new ATOM 2598 N LYS B 61 -13.137 14.504 -5.352 1.00 1.13 N ATOM 2599 CA LYS B 61 -12.807 15.578 -6.281 1.00 1.25 C ATOM 2600 C LYS B 61 -11.786 15.088 -7.318 1.00 1.26 C ATOM 2601 O LYS B 61 -11.989 15.230 -8.519 1.00 1.33 O ATOM 2602 CB LYS B 61 -12.336 16.818 -5.505 1.00 1.39 C ATOM 2603 CG LYS B 61 -10.968 16.610 -4.844 1.00 1.52 C ATOM 2604 CD LYS B 61 -10.709 17.627 -3.739 1.00 1.70 C ATOM 2605 CE LYS B 61 -9.223 17.983 -3.576 1.00 2.96 C ATOM 2606 NZ LYS B 61 -8.337 16.819 -3.367 1.00 4.35 N ATOM 0 H LYS B 61 -12.999 14.735 -4.368 1.00 1.13 H new ATOM 0 HA LYS B 61 -13.696 15.875 -6.838 1.00 1.25 H new ATOM 0 HB2 LYS B 61 -12.283 17.669 -6.184 1.00 1.39 H new ATOM 0 HB3 LYS B 61 -13.072 17.066 -4.740 1.00 1.39 H new ATOM 0 HG2 LYS B 61 -10.914 15.603 -4.430 1.00 1.52 H new ATOM 0 HG3 LYS B 61 -10.185 16.687 -5.598 1.00 1.52 H new ATOM 0 HD2 LYS B 61 -11.272 18.536 -3.952 1.00 1.70 H new ATOM 0 HD3 LYS B 61 -11.086 17.232 -2.796 1.00 1.70 H new ATOM 0 HE2 LYS B 61 -8.891 18.522 -4.463 1.00 2.96 H new ATOM 0 HE3 LYS B 61 -9.115 18.663 -2.731 1.00 2.96 H new ATOM 0 HZ1 LYS B 61 -7.941 16.852 -2.406 1.00 4.35 H new ATOM 0 HZ2 LYS B 61 -8.882 15.942 -3.487 1.00 4.35 H new ATOM 0 HZ3 LYS B 61 -7.563 16.843 -4.061 1.00 4.35 H new ATOM 2620 N SER B 62 -10.691 14.488 -6.847 1.00 1.24 N ATOM 2621 CA SER B 62 -9.630 13.956 -7.700 1.00 1.27 C ATOM 2622 C SER B 62 -10.202 13.045 -8.798 1.00 1.22 C ATOM 2623 O SER B 62 -9.890 13.218 -9.976 1.00 1.45 O ATOM 2624 CB SER B 62 -8.576 13.235 -6.844 1.00 1.29 C ATOM 2625 OG SER B 62 -7.366 13.104 -7.563 1.00 1.77 O ATOM 0 H SER B 62 -10.515 14.357 -5.851 1.00 1.24 H new ATOM 0 HA SER B 62 -9.139 14.787 -8.207 1.00 1.27 H new ATOM 0 HB2 SER B 62 -8.402 13.793 -5.924 1.00 1.29 H new ATOM 0 HB3 SER B 62 -8.944 12.250 -6.555 1.00 1.29 H new ATOM 0 HG SER B 62 -6.703 12.645 -7.006 1.00 1.77 H new ATOM 2631 N LEU B 63 -11.056 12.085 -8.422 1.00 1.02 N ATOM 2632 CA LEU B 63 -11.692 11.203 -9.393 1.00 0.98 C ATOM 2633 C LEU B 63 -12.579 12.035 -10.333 1.00 1.06 C ATOM 2634 O LEU B 63 -12.424 11.971 -11.552 1.00 1.12 O ATOM 2635 CB LEU B 63 -12.468 10.056 -8.703 1.00 0.94 C ATOM 2636 CG LEU B 63 -11.639 8.959 -8.001 1.00 0.98 C ATOM 2637 CD1 LEU B 63 -10.182 9.307 -7.655 1.00 1.11 C ATOM 2638 CD2 LEU B 63 -12.334 8.567 -6.693 1.00 1.25 C ATOM 0 H LEU B 63 -11.318 11.904 -7.453 1.00 1.02 H new ATOM 0 HA LEU B 63 -10.922 10.718 -9.993 1.00 0.98 H new ATOM 0 HB2 LEU B 63 -13.136 10.498 -7.964 1.00 0.94 H new ATOM 0 HB3 LEU B 63 -13.096 9.575 -9.453 1.00 0.94 H new ATOM 0 HG LEU B 63 -11.588 8.156 -8.737 1.00 0.98 H new ATOM 0 HD11 LEU B 63 -9.710 8.454 -7.166 1.00 1.11 H new ATOM 0 HD12 LEU B 63 -9.639 9.548 -8.569 1.00 1.11 H new ATOM 0 HD13 LEU B 63 -10.163 10.166 -6.984 1.00 1.11 H new ATOM 0 HD21 LEU B 63 -11.754 7.792 -6.191 1.00 1.25 H new ATOM 0 HD22 LEU B 63 -12.410 9.440 -6.045 1.00 1.25 H new ATOM 0 HD23 LEU B 63 -13.333 8.189 -6.911 1.00 1.25 H new ATOM 2650 N ASP B 64 -13.497 12.825 -9.774 1.00 1.11 N ATOM 2651 CA ASP B 64 -14.441 13.638 -10.532 1.00 1.24 C ATOM 2652 C ASP B 64 -13.749 14.449 -11.636 1.00 1.23 C ATOM 2653 O ASP B 64 -14.188 14.431 -12.783 1.00 1.29 O ATOM 2654 CB ASP B 64 -15.209 14.547 -9.568 1.00 1.38 C ATOM 2655 CG ASP B 64 -16.226 15.395 -10.313 1.00 1.54 C ATOM 2656 OD1 ASP B 64 -17.307 14.844 -10.608 1.00 2.84 O ATOM 2657 OD2 ASP B 64 -15.904 16.576 -10.560 1.00 2.22 O ATOM 0 H ASP B 64 -13.605 12.917 -8.764 1.00 1.11 H new ATOM 0 HA ASP B 64 -15.143 12.974 -11.037 1.00 1.24 H new ATOM 0 HB2 ASP B 64 -15.716 13.941 -8.817 1.00 1.38 H new ATOM 0 HB3 ASP B 64 -14.510 15.193 -9.037 1.00 1.38 H new ATOM 2662 N VAL B 65 -12.641 15.114 -11.290 1.00 1.20 N ATOM 2663 CA VAL B 65 -11.863 15.959 -12.195 1.00 1.23 C ATOM 2664 C VAL B 65 -11.535 15.228 -13.494 1.00 1.09 C ATOM 2665 O VAL B 65 -11.983 15.627 -14.567 1.00 1.24 O ATOM 2666 CB VAL B 65 -10.583 16.434 -11.481 1.00 1.32 C ATOM 2667 CG1 VAL B 65 -9.533 17.050 -12.414 1.00 1.72 C ATOM 2668 CG2 VAL B 65 -10.950 17.492 -10.448 1.00 2.03 C ATOM 0 H VAL B 65 -12.253 15.077 -10.348 1.00 1.20 H new ATOM 0 HA VAL B 65 -12.461 16.830 -12.464 1.00 1.23 H new ATOM 0 HB VAL B 65 -10.144 15.541 -11.035 1.00 1.32 H new ATOM 0 HG11 VAL B 65 -8.665 17.358 -11.832 1.00 1.72 H new ATOM 0 HG12 VAL B 65 -9.229 16.313 -13.157 1.00 1.72 H new ATOM 0 HG13 VAL B 65 -9.958 17.918 -12.918 1.00 1.72 H new ATOM 0 HG21 VAL B 65 -10.048 17.832 -9.939 1.00 2.03 H new ATOM 0 HG22 VAL B 65 -11.426 18.337 -10.946 1.00 2.03 H new ATOM 0 HG23 VAL B 65 -11.639 17.065 -9.719 1.00 2.03 H new ATOM 2678 N ASN B 66 -10.699 14.192 -13.404 1.00 0.95 N ATOM 2679 CA ASN B 66 -10.227 13.475 -14.593 1.00 0.98 C ATOM 2680 C ASN B 66 -9.954 12.003 -14.292 1.00 1.06 C ATOM 2681 O ASN B 66 -8.862 11.495 -14.550 1.00 1.22 O ATOM 2682 CB ASN B 66 -8.988 14.157 -15.209 1.00 1.08 C ATOM 2683 CG ASN B 66 -9.304 15.446 -15.963 1.00 1.47 C ATOM 2684 OD1 ASN B 66 -8.906 16.531 -15.550 1.00 2.68 O ATOM 2685 ND2 ASN B 66 -9.986 15.344 -17.100 1.00 2.11 N ATOM 0 H ASN B 66 -10.335 13.830 -12.523 1.00 0.95 H new ATOM 0 HA ASN B 66 -11.028 13.515 -15.331 1.00 0.98 H new ATOM 0 HB2 ASN B 66 -8.274 14.377 -14.415 1.00 1.08 H new ATOM 0 HB3 ASN B 66 -8.502 13.459 -15.890 1.00 1.08 H new ATOM 0 HD21 ASN B 66 -10.189 16.179 -17.650 1.00 2.11 H new ATOM 0 HD22 ASN B 66 -10.306 14.431 -17.422 1.00 2.11 H new ATOM 2692 N GLN B 67 -10.977 11.284 -13.830 1.00 1.07 N ATOM 2693 CA GLN B 67 -10.887 9.846 -13.615 1.00 1.19 C ATOM 2694 C GLN B 67 -10.383 9.081 -14.849 1.00 1.46 C ATOM 2695 O GLN B 67 -9.734 8.042 -14.734 1.00 1.68 O ATOM 2696 CB GLN B 67 -12.241 9.281 -13.155 1.00 1.28 C ATOM 2697 CG GLN B 67 -13.399 9.475 -14.154 1.00 1.61 C ATOM 2698 CD GLN B 67 -13.412 8.423 -15.265 1.00 3.27 C ATOM 2699 OE1 GLN B 67 -13.017 7.280 -15.042 1.00 4.71 O ATOM 2700 NE2 GLN B 67 -13.833 8.820 -16.459 1.00 3.70 N ATOM 0 H GLN B 67 -11.886 11.683 -13.596 1.00 1.07 H new ATOM 0 HA GLN B 67 -10.146 9.699 -12.829 1.00 1.19 H new ATOM 0 HB2 GLN B 67 -12.125 8.215 -12.958 1.00 1.28 H new ATOM 0 HB3 GLN B 67 -12.513 9.752 -12.210 1.00 1.28 H new ATOM 0 HG2 GLN B 67 -14.346 9.439 -13.616 1.00 1.61 H new ATOM 0 HG3 GLN B 67 -13.324 10.466 -14.601 1.00 1.61 H new ATOM 0 HE21 GLN B 67 -14.151 9.780 -16.594 1.00 3.70 H new ATOM 0 HE22 GLN B 67 -13.838 8.166 -17.241 1.00 3.70 H new ATOM 2709 N ASP B 68 -10.734 9.574 -16.038 1.00 1.53 N ATOM 2710 CA ASP B 68 -10.572 8.834 -17.284 1.00 1.63 C ATOM 2711 C ASP B 68 -9.099 8.568 -17.631 1.00 1.73 C ATOM 2712 O ASP B 68 -8.798 7.725 -18.468 1.00 1.98 O ATOM 2713 CB ASP B 68 -11.303 9.581 -18.412 1.00 1.50 C ATOM 2714 CG ASP B 68 -12.028 8.613 -19.337 1.00 2.19 C ATOM 2715 OD1 ASP B 68 -12.953 7.944 -18.819 1.00 2.94 O ATOM 2716 OD2 ASP B 68 -11.685 8.595 -20.537 1.00 3.40 O ATOM 0 H ASP B 68 -11.140 10.502 -16.161 1.00 1.53 H new ATOM 0 HA ASP B 68 -11.019 7.848 -17.158 1.00 1.63 H new ATOM 0 HB2 ASP B 68 -12.019 10.282 -17.983 1.00 1.50 H new ATOM 0 HB3 ASP B 68 -10.586 10.168 -18.986 1.00 1.50 H new ATOM 2721 N SER B 69 -8.174 9.269 -16.965 1.00 1.61 N ATOM 2722 CA SER B 69 -6.732 9.190 -17.184 1.00 1.75 C ATOM 2723 C SER B 69 -6.115 7.792 -17.018 1.00 1.98 C ATOM 2724 O SER B 69 -4.950 7.614 -17.373 1.00 3.70 O ATOM 2725 CB SER B 69 -6.045 10.147 -16.203 1.00 1.61 C ATOM 2726 OG SER B 69 -6.662 11.422 -16.229 1.00 2.32 O ATOM 0 H SER B 69 -8.423 9.932 -16.231 1.00 1.61 H new ATOM 0 HA SER B 69 -6.572 9.459 -18.228 1.00 1.75 H new ATOM 0 HB2 SER B 69 -6.091 9.736 -15.194 1.00 1.61 H new ATOM 0 HB3 SER B 69 -4.990 10.243 -16.460 1.00 1.61 H new ATOM 0 HG SER B 69 -7.377 11.453 -15.560 1.00 2.32 H new ATOM 2732 N GLU B 70 -6.849 6.843 -16.429 1.00 0.87 N ATOM 2733 CA GLU B 70 -6.352 5.565 -15.928 1.00 0.80 C ATOM 2734 C GLU B 70 -5.433 5.723 -14.722 1.00 0.83 C ATOM 2735 O GLU B 70 -4.963 6.818 -14.413 1.00 1.02 O ATOM 2736 CB GLU B 70 -5.760 4.645 -17.011 1.00 0.86 C ATOM 2737 CG GLU B 70 -6.884 3.996 -17.822 1.00 1.51 C ATOM 2738 CD GLU B 70 -6.376 3.001 -18.853 1.00 2.12 C ATOM 2739 OE1 GLU B 70 -5.144 2.806 -18.979 1.00 2.16 O ATOM 2740 OE2 GLU B 70 -7.217 2.351 -19.513 1.00 3.43 O ATOM 0 H GLU B 70 -7.852 6.954 -16.283 1.00 0.87 H new ATOM 0 HA GLU B 70 -7.241 5.041 -15.577 1.00 0.80 H new ATOM 0 HB2 GLU B 70 -5.110 5.219 -17.671 1.00 0.86 H new ATOM 0 HB3 GLU B 70 -5.144 3.875 -16.548 1.00 0.86 H new ATOM 0 HG2 GLU B 70 -7.568 3.489 -17.142 1.00 1.51 H new ATOM 0 HG3 GLU B 70 -7.456 4.774 -18.328 1.00 1.51 H new ATOM 2747 N LEU B 71 -5.260 4.614 -14.001 1.00 0.87 N ATOM 2748 CA LEU B 71 -4.632 4.578 -12.691 1.00 0.84 C ATOM 2749 C LEU B 71 -3.398 3.672 -12.714 1.00 0.84 C ATOM 2750 O LEU B 71 -3.388 2.636 -13.385 1.00 1.03 O ATOM 2751 CB LEU B 71 -5.679 4.067 -11.690 1.00 1.02 C ATOM 2752 CG LEU B 71 -5.305 4.235 -10.212 1.00 1.36 C ATOM 2753 CD1 LEU B 71 -5.325 5.703 -9.777 1.00 2.15 C ATOM 2754 CD2 LEU B 71 -6.354 3.492 -9.386 1.00 2.09 C ATOM 0 H LEU B 71 -5.563 3.696 -14.326 1.00 0.87 H new ATOM 0 HA LEU B 71 -4.292 5.572 -12.399 1.00 0.84 H new ATOM 0 HB2 LEU B 71 -6.618 4.589 -11.872 1.00 1.02 H new ATOM 0 HB3 LEU B 71 -5.859 3.010 -11.885 1.00 1.02 H new ATOM 0 HG LEU B 71 -4.297 3.847 -10.064 1.00 1.36 H new ATOM 0 HD11 LEU B 71 -5.054 5.774 -8.724 1.00 2.15 H new ATOM 0 HD12 LEU B 71 -4.611 6.269 -10.374 1.00 2.15 H new ATOM 0 HD13 LEU B 71 -6.325 6.112 -9.923 1.00 2.15 H new ATOM 0 HD21 LEU B 71 -6.119 3.590 -8.326 1.00 2.09 H new ATOM 0 HD22 LEU B 71 -7.338 3.918 -9.580 1.00 2.09 H new ATOM 0 HD23 LEU B 71 -6.354 2.437 -9.661 1.00 2.09 H new ATOM 2766 N LYS B 72 -2.360 4.047 -11.964 1.00 0.78 N ATOM 2767 CA LYS B 72 -1.125 3.298 -11.819 1.00 0.86 C ATOM 2768 C LYS B 72 -0.830 3.032 -10.343 1.00 0.81 C ATOM 2769 O LYS B 72 -1.552 3.481 -9.448 1.00 0.71 O ATOM 2770 CB LYS B 72 0.031 4.045 -12.504 1.00 0.96 C ATOM 2771 CG LYS B 72 -0.373 4.549 -13.896 1.00 1.14 C ATOM 2772 CD LYS B 72 0.806 5.225 -14.602 1.00 2.05 C ATOM 2773 CE LYS B 72 0.411 5.625 -16.032 1.00 2.49 C ATOM 2774 NZ LYS B 72 0.389 4.464 -16.947 1.00 3.56 N ATOM 0 H LYS B 72 -2.363 4.913 -11.424 1.00 0.78 H new ATOM 0 HA LYS B 72 -1.235 2.331 -12.310 1.00 0.86 H new ATOM 0 HB2 LYS B 72 0.338 4.888 -11.885 1.00 0.96 H new ATOM 0 HB3 LYS B 72 0.893 3.383 -12.591 1.00 0.96 H new ATOM 0 HG2 LYS B 72 -0.731 3.714 -14.498 1.00 1.14 H new ATOM 0 HG3 LYS B 72 -1.199 5.254 -13.805 1.00 1.14 H new ATOM 0 HD2 LYS B 72 1.117 6.107 -14.043 1.00 2.05 H new ATOM 0 HD3 LYS B 72 1.660 4.548 -14.629 1.00 2.05 H new ATOM 0 HE2 LYS B 72 -0.573 6.094 -16.018 1.00 2.49 H new ATOM 0 HE3 LYS B 72 1.114 6.369 -16.407 1.00 2.49 H new ATOM 0 HZ1 LYS B 72 -0.342 4.608 -17.673 1.00 3.56 H new ATOM 0 HZ2 LYS B 72 1.317 4.365 -17.405 1.00 3.56 H new ATOM 0 HZ3 LYS B 72 0.176 3.601 -16.408 1.00 3.56 H new ATOM 2788 N PHE B 73 0.236 2.258 -10.115 1.00 0.99 N ATOM 2789 CA PHE B 73 0.596 1.679 -8.828 1.00 1.01 C ATOM 2790 C PHE B 73 0.542 2.721 -7.712 1.00 0.83 C ATOM 2791 O PHE B 73 -0.219 2.569 -6.760 1.00 0.65 O ATOM 2792 CB PHE B 73 1.989 1.024 -8.906 1.00 1.43 C ATOM 2793 CG PHE B 73 2.269 0.290 -10.205 1.00 0.82 C ATOM 2794 CD1 PHE B 73 1.643 -0.943 -10.459 1.00 2.17 C ATOM 2795 CD2 PHE B 73 2.989 0.929 -11.233 1.00 1.91 C ATOM 2796 CE1 PHE B 73 1.704 -1.521 -11.738 1.00 3.09 C ATOM 2797 CE2 PHE B 73 3.061 0.346 -12.510 1.00 2.38 C ATOM 2798 CZ PHE B 73 2.426 -0.881 -12.760 1.00 2.74 C ATOM 0 H PHE B 73 0.894 2.011 -10.854 1.00 0.99 H new ATOM 0 HA PHE B 73 -0.136 0.908 -8.588 1.00 1.01 H new ATOM 0 HB2 PHE B 73 2.747 1.795 -8.769 1.00 1.43 H new ATOM 0 HB3 PHE B 73 2.094 0.323 -8.078 1.00 1.43 H new ATOM 0 HD1 PHE B 73 1.112 -1.449 -9.666 1.00 2.17 H new ATOM 0 HD2 PHE B 73 3.486 1.868 -11.040 1.00 1.91 H new ATOM 0 HE1 PHE B 73 1.198 -2.454 -11.935 1.00 3.09 H new ATOM 0 HE2 PHE B 73 3.605 0.842 -13.300 1.00 2.38 H new ATOM 0 HZ PHE B 73 2.492 -1.333 -13.738 1.00 2.74 H new ATOM 2808 N ASN B 74 1.355 3.776 -7.832 1.00 1.04 N ATOM 2809 CA ASN B 74 1.480 4.762 -6.767 1.00 1.14 C ATOM 2810 C ASN B 74 0.137 5.436 -6.495 1.00 0.90 C ATOM 2811 O ASN B 74 -0.251 5.531 -5.336 1.00 0.98 O ATOM 2812 CB ASN B 74 2.601 5.785 -7.008 1.00 1.61 C ATOM 2813 CG ASN B 74 2.125 6.957 -7.857 1.00 1.55 C ATOM 2814 OD1 ASN B 74 1.763 8.007 -7.323 1.00 2.90 O ATOM 2815 ND2 ASN B 74 2.041 6.724 -9.164 1.00 2.15 N ATOM 0 H ASN B 74 1.931 3.964 -8.653 1.00 1.04 H new ATOM 0 HA ASN B 74 1.778 4.218 -5.870 1.00 1.14 H new ATOM 0 HB2 ASN B 74 2.967 6.155 -6.050 1.00 1.61 H new ATOM 0 HB3 ASN B 74 3.440 5.295 -7.502 1.00 1.61 H new ATOM 0 HD21 ASN B 74 1.659 7.437 -9.786 1.00 2.15 H new ATOM 0 HD22 ASN B 74 2.358 5.832 -9.545 1.00 2.15 H new ATOM 2822 N GLU B 75 -0.570 5.893 -7.538 1.00 0.78 N ATOM 2823 CA GLU B 75 -1.820 6.621 -7.376 1.00 0.66 C ATOM 2824 C GLU B 75 -2.827 5.755 -6.628 1.00 0.61 C ATOM 2825 O GLU B 75 -3.355 6.180 -5.601 1.00 0.69 O ATOM 2826 CB GLU B 75 -2.390 7.039 -8.731 1.00 0.69 C ATOM 2827 CG GLU B 75 -1.457 7.958 -9.534 1.00 1.08 C ATOM 2828 CD GLU B 75 -0.887 7.277 -10.769 1.00 2.21 C ATOM 2829 OE1 GLU B 75 -1.665 6.560 -11.435 1.00 3.31 O ATOM 2830 OE2 GLU B 75 0.326 7.466 -11.007 1.00 2.95 O ATOM 0 H GLU B 75 -0.287 5.765 -8.510 1.00 0.78 H new ATOM 0 HA GLU B 75 -1.621 7.524 -6.799 1.00 0.66 H new ATOM 0 HB2 GLU B 75 -2.600 6.145 -9.319 1.00 0.69 H new ATOM 0 HB3 GLU B 75 -3.341 7.548 -8.574 1.00 0.69 H new ATOM 0 HG2 GLU B 75 -2.004 8.851 -9.836 1.00 1.08 H new ATOM 0 HG3 GLU B 75 -0.638 8.287 -8.894 1.00 1.08 H new ATOM 2837 N TYR B 76 -3.062 4.535 -7.134 1.00 0.56 N ATOM 2838 CA TYR B 76 -3.863 3.537 -6.435 1.00 0.59 C ATOM 2839 C TYR B 76 -3.459 3.528 -4.968 1.00 0.59 C ATOM 2840 O TYR B 76 -4.294 3.662 -4.076 1.00 0.61 O ATOM 2841 CB TYR B 76 -3.651 2.152 -7.070 1.00 0.67 C ATOM 2842 CG TYR B 76 -4.172 0.990 -6.240 1.00 1.00 C ATOM 2843 CD1 TYR B 76 -3.392 0.457 -5.194 1.00 1.90 C ATOM 2844 CD2 TYR B 76 -5.397 0.383 -6.564 1.00 1.79 C ATOM 2845 CE1 TYR B 76 -3.877 -0.611 -4.423 1.00 2.19 C ATOM 2846 CE2 TYR B 76 -5.883 -0.686 -5.791 1.00 2.12 C ATOM 2847 CZ TYR B 76 -5.135 -1.165 -4.704 1.00 1.88 C ATOM 2848 OH TYR B 76 -5.645 -2.146 -3.909 1.00 2.35 O ATOM 0 H TYR B 76 -2.701 4.220 -8.035 1.00 0.56 H new ATOM 0 HA TYR B 76 -4.922 3.784 -6.515 1.00 0.59 H new ATOM 0 HB2 TYR B 76 -4.140 2.134 -8.044 1.00 0.67 H new ATOM 0 HB3 TYR B 76 -2.585 2.007 -7.246 1.00 0.67 H new ATOM 0 HD1 TYR B 76 -2.417 0.872 -4.985 1.00 1.90 H new ATOM 0 HD2 TYR B 76 -5.967 0.739 -7.410 1.00 1.79 H new ATOM 0 HE1 TYR B 76 -3.282 -1.006 -3.613 1.00 2.19 H new ATOM 0 HE2 TYR B 76 -6.833 -1.139 -6.034 1.00 2.12 H new ATOM 0 HH TYR B 76 -6.603 -2.249 -4.090 1.00 2.35 H new ATOM 2858 N TRP B 77 -2.156 3.394 -4.738 1.00 0.60 N ATOM 2859 CA TRP B 77 -1.602 3.355 -3.408 1.00 0.64 C ATOM 2860 C TRP B 77 -2.054 4.536 -2.561 1.00 0.62 C ATOM 2861 O TRP B 77 -2.799 4.331 -1.606 1.00 0.68 O ATOM 2862 CB TRP B 77 -0.088 3.286 -3.480 1.00 0.69 C ATOM 2863 CG TRP B 77 0.416 2.194 -2.648 1.00 0.73 C ATOM 2864 CD1 TRP B 77 0.708 2.318 -1.348 1.00 0.75 C ATOM 2865 CD2 TRP B 77 0.787 0.853 -3.041 1.00 0.75 C ATOM 2866 NE1 TRP B 77 1.169 1.121 -0.879 1.00 0.77 N ATOM 2867 CE2 TRP B 77 1.332 0.209 -1.899 1.00 0.76 C ATOM 2868 CE3 TRP B 77 0.818 0.154 -4.263 1.00 0.78 C ATOM 2869 CZ2 TRP B 77 1.926 -1.051 -1.976 1.00 0.77 C ATOM 2870 CZ3 TRP B 77 1.389 -1.124 -4.328 1.00 0.83 C ATOM 2871 CH2 TRP B 77 1.932 -1.729 -3.198 1.00 0.81 C ATOM 0 H TRP B 77 -1.460 3.310 -5.479 1.00 0.60 H new ATOM 0 HA TRP B 77 -1.977 2.457 -2.917 1.00 0.64 H new ATOM 0 HB2 TRP B 77 0.226 3.138 -4.513 1.00 0.69 H new ATOM 0 HB3 TRP B 77 0.341 4.231 -3.148 1.00 0.69 H new ATOM 0 HD1 TRP B 77 0.597 3.219 -0.764 1.00 0.75 H new ATOM 0 HE1 TRP B 77 1.368 0.927 0.102 1.00 0.77 H new ATOM 0 HE3 TRP B 77 0.401 0.604 -5.152 1.00 0.78 H new ATOM 0 HZ2 TRP B 77 2.376 -1.497 -1.101 1.00 0.77 H new ATOM 0 HZ3 TRP B 77 1.408 -1.649 -5.272 1.00 0.83 H new ATOM 0 HH2 TRP B 77 2.357 -2.720 -3.265 1.00 0.81 H new ATOM 2882 N ARG B 78 -1.587 5.748 -2.886 1.00 0.57 N ATOM 2883 CA ARG B 78 -1.937 6.979 -2.196 1.00 0.60 C ATOM 2884 C ARG B 78 -3.438 6.966 -1.859 1.00 0.63 C ATOM 2885 O ARG B 78 -3.827 7.153 -0.708 1.00 0.68 O ATOM 2886 CB ARG B 78 -1.575 8.209 -3.066 1.00 0.66 C ATOM 2887 CG ARG B 78 -0.197 8.155 -3.760 1.00 1.25 C ATOM 2888 CD ARG B 78 0.474 9.520 -3.966 1.00 1.52 C ATOM 2889 NE ARG B 78 1.586 9.439 -4.945 1.00 2.79 N ATOM 2890 CZ ARG B 78 2.706 10.189 -4.949 1.00 3.86 C ATOM 2891 NH1 ARG B 78 2.944 11.114 -4.017 1.00 4.18 N ATOM 2892 NH2 ARG B 78 3.637 10.041 -5.886 1.00 5.31 N ATOM 0 H ARG B 78 -0.938 5.895 -3.659 1.00 0.57 H new ATOM 0 HA ARG B 78 -1.368 7.049 -1.269 1.00 0.60 H new ATOM 0 HB2 ARG B 78 -2.342 8.329 -3.831 1.00 0.66 H new ATOM 0 HB3 ARG B 78 -1.610 9.099 -2.437 1.00 0.66 H new ATOM 0 HG2 ARG B 78 0.467 7.525 -3.169 1.00 1.25 H new ATOM 0 HG3 ARG B 78 -0.313 7.673 -4.731 1.00 1.25 H new ATOM 0 HD2 ARG B 78 -0.266 10.241 -4.313 1.00 1.52 H new ATOM 0 HD3 ARG B 78 0.854 9.887 -3.013 1.00 1.52 H new ATOM 0 HE ARG B 78 1.494 8.747 -5.689 1.00 2.79 H new ATOM 0 HH11 ARG B 78 2.267 11.272 -3.270 1.00 4.18 H new ATOM 0 HH12 ARG B 78 3.803 11.663 -4.051 1.00 4.18 H new ATOM 0 HH21 ARG B 78 3.512 9.348 -6.624 1.00 5.31 H new ATOM 0 HH22 ARG B 78 4.476 10.621 -5.867 1.00 5.31 H new ATOM 2906 N LEU B 79 -4.266 6.658 -2.866 1.00 0.59 N ATOM 2907 CA LEU B 79 -5.713 6.606 -2.737 1.00 0.61 C ATOM 2908 C LEU B 79 -6.199 5.558 -1.714 1.00 0.63 C ATOM 2909 O LEU B 79 -7.060 5.882 -0.895 1.00 0.70 O ATOM 2910 CB LEU B 79 -6.348 6.424 -4.127 1.00 0.64 C ATOM 2911 CG LEU B 79 -6.463 7.714 -4.975 1.00 0.89 C ATOM 2912 CD1 LEU B 79 -5.336 8.747 -4.815 1.00 1.21 C ATOM 2913 CD2 LEU B 79 -6.588 7.362 -6.461 1.00 1.34 C ATOM 0 H LEU B 79 -3.935 6.436 -3.805 1.00 0.59 H new ATOM 0 HA LEU B 79 -6.048 7.558 -2.326 1.00 0.61 H new ATOM 0 HB2 LEU B 79 -5.761 5.694 -4.684 1.00 0.64 H new ATOM 0 HB3 LEU B 79 -7.345 6.002 -4.001 1.00 0.64 H new ATOM 0 HG LEU B 79 -7.358 8.196 -4.583 1.00 0.89 H new ATOM 0 HD11 LEU B 79 -5.533 9.603 -5.461 1.00 1.21 H new ATOM 0 HD12 LEU B 79 -5.290 9.078 -3.777 1.00 1.21 H new ATOM 0 HD13 LEU B 79 -4.385 8.294 -5.093 1.00 1.21 H new ATOM 0 HD21 LEU B 79 -6.668 8.278 -7.046 1.00 1.34 H new ATOM 0 HD22 LEU B 79 -5.707 6.805 -6.778 1.00 1.34 H new ATOM 0 HD23 LEU B 79 -7.478 6.753 -6.617 1.00 1.34 H new ATOM 2925 N ILE B 80 -5.704 4.311 -1.709 1.00 0.62 N ATOM 2926 CA ILE B 80 -6.124 3.371 -0.656 1.00 0.69 C ATOM 2927 C ILE B 80 -5.500 3.728 0.695 1.00 0.67 C ATOM 2928 O ILE B 80 -6.048 3.396 1.744 1.00 0.66 O ATOM 2929 CB ILE B 80 -5.978 1.876 -1.004 1.00 0.75 C ATOM 2930 CG1 ILE B 80 -4.568 1.345 -0.775 1.00 0.78 C ATOM 2931 CG2 ILE B 80 -6.420 1.611 -2.432 1.00 0.81 C ATOM 2932 CD1 ILE B 80 -4.430 -0.174 -0.886 1.00 0.82 C ATOM 0 H ILE B 80 -5.041 3.940 -2.390 1.00 0.62 H new ATOM 0 HA ILE B 80 -7.203 3.505 -0.577 1.00 0.69 H new ATOM 0 HB ILE B 80 -6.632 1.335 -0.320 1.00 0.75 H new ATOM 0 HG12 ILE B 80 -3.898 1.811 -1.497 1.00 0.78 H new ATOM 0 HG13 ILE B 80 -4.234 1.655 0.215 1.00 0.78 H new ATOM 0 HG21 ILE B 80 -6.309 0.550 -2.656 1.00 0.81 H new ATOM 0 HG22 ILE B 80 -7.465 1.899 -2.549 1.00 0.81 H new ATOM 0 HG23 ILE B 80 -5.804 2.193 -3.117 1.00 0.81 H new ATOM 0 HD11 ILE B 80 -3.393 -0.459 -0.708 1.00 0.82 H new ATOM 0 HD12 ILE B 80 -5.070 -0.653 -0.145 1.00 0.82 H new ATOM 0 HD13 ILE B 80 -4.728 -0.494 -1.884 1.00 0.82 H new ATOM 2944 N GLY B 81 -4.356 4.408 0.691 1.00 0.67 N ATOM 2945 CA GLY B 81 -3.809 5.003 1.895 1.00 0.71 C ATOM 2946 C GLY B 81 -4.845 5.941 2.497 1.00 0.72 C ATOM 2947 O GLY B 81 -5.187 5.861 3.677 1.00 0.83 O ATOM 0 H GLY B 81 -3.790 4.558 -0.144 1.00 0.67 H new ATOM 0 HA2 GLY B 81 -3.543 4.226 2.612 1.00 0.71 H new ATOM 0 HA3 GLY B 81 -2.895 5.550 1.663 1.00 0.71 H new ATOM 2951 N GLU B 82 -5.376 6.812 1.643 1.00 0.64 N ATOM 2952 CA GLU B 82 -6.486 7.675 1.975 1.00 0.71 C ATOM 2953 C GLU B 82 -7.708 6.845 2.404 1.00 0.80 C ATOM 2954 O GLU B 82 -8.300 7.191 3.416 1.00 1.01 O ATOM 2955 CB GLU B 82 -6.700 8.681 0.837 1.00 0.74 C ATOM 2956 CG GLU B 82 -5.515 9.671 0.817 1.00 0.75 C ATOM 2957 CD GLU B 82 -5.177 10.205 -0.571 1.00 1.69 C ATOM 2958 OE1 GLU B 82 -6.069 10.160 -1.445 1.00 2.54 O ATOM 2959 OE2 GLU B 82 -4.018 10.663 -0.713 1.00 2.71 O ATOM 0 H GLU B 82 -5.036 6.933 0.689 1.00 0.64 H new ATOM 0 HA GLU B 82 -6.276 8.285 2.854 1.00 0.71 H new ATOM 0 HB2 GLU B 82 -6.773 8.160 -0.118 1.00 0.74 H new ATOM 0 HB3 GLU B 82 -7.638 9.218 0.980 1.00 0.74 H new ATOM 0 HG2 GLU B 82 -5.745 10.511 1.472 1.00 0.75 H new ATOM 0 HG3 GLU B 82 -4.635 9.177 1.229 1.00 0.75 H new ATOM 2966 N LEU B 83 -8.036 5.708 1.767 1.00 0.67 N ATOM 2967 CA LEU B 83 -9.057 4.805 2.326 1.00 0.70 C ATOM 2968 C LEU B 83 -8.751 4.411 3.780 1.00 0.82 C ATOM 2969 O LEU B 83 -9.610 4.564 4.648 1.00 0.96 O ATOM 2970 CB LEU B 83 -9.303 3.529 1.507 1.00 0.66 C ATOM 2971 CG LEU B 83 -9.907 3.741 0.114 1.00 1.55 C ATOM 2972 CD1 LEU B 83 -9.985 2.379 -0.579 1.00 2.23 C ATOM 2973 CD2 LEU B 83 -11.318 4.339 0.170 1.00 2.51 C ATOM 0 H LEU B 83 -7.622 5.398 0.888 1.00 0.67 H new ATOM 0 HA LEU B 83 -9.971 5.397 2.284 1.00 0.70 H new ATOM 0 HB2 LEU B 83 -8.355 3.002 1.396 1.00 0.66 H new ATOM 0 HB3 LEU B 83 -9.966 2.876 2.075 1.00 0.66 H new ATOM 0 HG LEU B 83 -9.273 4.443 -0.427 1.00 1.55 H new ATOM 0 HD11 LEU B 83 -10.412 2.501 -1.574 1.00 2.23 H new ATOM 0 HD12 LEU B 83 -8.984 1.956 -0.663 1.00 2.23 H new ATOM 0 HD13 LEU B 83 -10.614 1.709 0.006 1.00 2.23 H new ATOM 0 HD21 LEU B 83 -11.699 4.468 -0.843 1.00 2.51 H new ATOM 0 HD22 LEU B 83 -11.976 3.668 0.722 1.00 2.51 H new ATOM 0 HD23 LEU B 83 -11.284 5.306 0.671 1.00 2.51 H new ATOM 2985 N ALA B 84 -7.553 3.886 4.073 1.00 0.80 N ATOM 2986 CA ALA B 84 -7.183 3.606 5.458 1.00 0.98 C ATOM 2987 C ALA B 84 -7.355 4.840 6.362 1.00 1.09 C ATOM 2988 O ALA B 84 -7.788 4.717 7.506 1.00 1.42 O ATOM 2989 CB ALA B 84 -5.759 3.042 5.522 1.00 0.97 C ATOM 0 H ALA B 84 -6.840 3.652 3.382 1.00 0.80 H new ATOM 0 HA ALA B 84 -7.865 2.849 5.844 1.00 0.98 H new ATOM 0 HB1 ALA B 84 -5.495 2.837 6.560 1.00 0.97 H new ATOM 0 HB2 ALA B 84 -5.707 2.118 4.945 1.00 0.97 H new ATOM 0 HB3 ALA B 84 -5.061 3.769 5.106 1.00 0.97 H new ATOM 2995 N LYS B 85 -7.003 6.031 5.869 1.00 0.97 N ATOM 2996 CA LYS B 85 -7.153 7.289 6.597 1.00 1.25 C ATOM 2997 C LYS B 85 -8.634 7.601 6.892 1.00 1.34 C ATOM 2998 O LYS B 85 -8.984 7.971 8.010 1.00 1.60 O ATOM 2999 CB LYS B 85 -6.485 8.403 5.779 1.00 1.46 C ATOM 3000 CG LYS B 85 -6.179 9.663 6.591 1.00 1.55 C ATOM 3001 CD LYS B 85 -5.579 10.720 5.647 1.00 1.69 C ATOM 3002 CE LYS B 85 -5.818 12.168 6.095 1.00 2.35 C ATOM 3003 NZ LYS B 85 -7.257 12.509 6.142 1.00 3.02 N ATOM 0 H LYS B 85 -6.600 6.147 4.939 1.00 0.97 H new ATOM 0 HA LYS B 85 -6.664 7.211 7.568 1.00 1.25 H new ATOM 0 HB2 LYS B 85 -5.557 8.022 5.353 1.00 1.46 H new ATOM 0 HB3 LYS B 85 -7.134 8.668 4.944 1.00 1.46 H new ATOM 0 HG2 LYS B 85 -7.088 10.044 7.056 1.00 1.55 H new ATOM 0 HG3 LYS B 85 -5.481 9.434 7.396 1.00 1.55 H new ATOM 0 HD2 LYS B 85 -4.506 10.549 5.563 1.00 1.69 H new ATOM 0 HD3 LYS B 85 -6.002 10.584 4.652 1.00 1.69 H new ATOM 0 HE2 LYS B 85 -5.378 12.319 7.081 1.00 2.35 H new ATOM 0 HE3 LYS B 85 -5.308 12.847 5.412 1.00 2.35 H new ATOM 0 HZ1 LYS B 85 -7.442 13.320 5.518 1.00 3.02 H new ATOM 0 HZ2 LYS B 85 -7.818 11.693 5.824 1.00 3.02 H new ATOM 0 HZ3 LYS B 85 -7.524 12.754 7.117 1.00 3.02 H new ATOM 3017 N GLU B 86 -9.484 7.483 5.869 1.00 1.19 N ATOM 3018 CA GLU B 86 -10.938 7.564 5.901 1.00 1.19 C ATOM 3019 C GLU B 86 -11.484 6.594 6.946 1.00 1.29 C ATOM 3020 O GLU B 86 -11.850 7.009 8.050 1.00 1.45 O ATOM 3021 CB GLU B 86 -11.459 7.214 4.495 1.00 1.03 C ATOM 3022 CG GLU B 86 -11.579 8.451 3.608 1.00 1.20 C ATOM 3023 CD GLU B 86 -11.344 8.107 2.144 1.00 1.59 C ATOM 3024 OE1 GLU B 86 -12.255 7.573 1.477 1.00 2.84 O ATOM 3025 OE2 GLU B 86 -10.252 8.429 1.630 1.00 2.23 O ATOM 0 H GLU B 86 -9.141 7.315 4.923 1.00 1.19 H new ATOM 0 HA GLU B 86 -11.268 8.566 6.175 1.00 1.19 H new ATOM 0 HB2 GLU B 86 -10.786 6.496 4.027 1.00 1.03 H new ATOM 0 HB3 GLU B 86 -12.433 6.731 4.578 1.00 1.03 H new ATOM 0 HG2 GLU B 86 -12.569 8.891 3.726 1.00 1.20 H new ATOM 0 HG3 GLU B 86 -10.856 9.202 3.928 1.00 1.20 H new ATOM 3032 N ILE B 87 -11.600 5.317 6.581 1.00 1.27 N ATOM 3033 CA ILE B 87 -12.174 4.294 7.431 1.00 1.35 C ATOM 3034 C ILE B 87 -11.101 3.776 8.392 1.00 1.25 C ATOM 3035 O ILE B 87 -10.213 3.019 8.004 1.00 1.16 O ATOM 3036 CB ILE B 87 -12.905 3.221 6.593 1.00 1.52 C ATOM 3037 CG1 ILE B 87 -13.372 2.025 7.430 1.00 1.43 C ATOM 3038 CG2 ILE B 87 -12.103 2.723 5.380 1.00 2.05 C ATOM 3039 CD1 ILE B 87 -14.315 2.414 8.574 1.00 2.29 C ATOM 0 H ILE B 87 -11.292 4.968 5.674 1.00 1.27 H new ATOM 0 HA ILE B 87 -12.961 4.706 8.063 1.00 1.35 H new ATOM 0 HB ILE B 87 -13.783 3.743 6.212 1.00 1.52 H new ATOM 0 HG12 ILE B 87 -13.877 1.311 6.780 1.00 1.43 H new ATOM 0 HG13 ILE B 87 -12.500 1.518 7.844 1.00 1.43 H new ATOM 0 HG21 ILE B 87 -12.683 1.972 4.843 1.00 2.05 H new ATOM 0 HG22 ILE B 87 -11.891 3.561 4.716 1.00 2.05 H new ATOM 0 HG23 ILE B 87 -11.166 2.282 5.720 1.00 2.05 H new ATOM 0 HD11 ILE B 87 -14.607 1.520 9.125 1.00 2.29 H new ATOM 0 HD12 ILE B 87 -13.806 3.105 9.246 1.00 2.29 H new ATOM 0 HD13 ILE B 87 -15.204 2.894 8.165 1.00 2.29 H new ATOM 3051 N ARG B 88 -11.219 4.139 9.673 1.00 1.42 N ATOM 3052 CA ARG B 88 -10.207 3.883 10.693 1.00 1.52 C ATOM 3053 C ARG B 88 -10.317 2.441 11.204 1.00 1.47 C ATOM 3054 O ARG B 88 -10.514 2.189 12.390 1.00 1.87 O ATOM 3055 CB ARG B 88 -10.390 4.903 11.835 1.00 1.85 C ATOM 3056 CG ARG B 88 -11.803 4.872 12.459 1.00 2.17 C ATOM 3057 CD ARG B 88 -11.769 4.611 13.972 1.00 3.01 C ATOM 3058 NE ARG B 88 -13.122 4.329 14.488 1.00 4.74 N ATOM 3059 CZ ARG B 88 -13.407 3.599 15.581 1.00 6.33 C ATOM 3060 NH1 ARG B 88 -12.422 3.143 16.362 1.00 6.75 N ATOM 3061 NH2 ARG B 88 -14.681 3.329 15.888 1.00 8.09 N ATOM 0 H ARG B 88 -12.038 4.628 10.033 1.00 1.42 H new ATOM 0 HA ARG B 88 -9.209 4.000 10.270 1.00 1.52 H new ATOM 0 HB2 ARG B 88 -9.652 4.704 12.612 1.00 1.85 H new ATOM 0 HB3 ARG B 88 -10.190 5.905 11.454 1.00 1.85 H new ATOM 0 HG2 ARG B 88 -12.303 5.822 12.268 1.00 2.17 H new ATOM 0 HG3 ARG B 88 -12.395 4.097 11.973 1.00 2.17 H new ATOM 0 HD2 ARG B 88 -11.111 3.768 14.185 1.00 3.01 H new ATOM 0 HD3 ARG B 88 -11.353 5.478 14.485 1.00 3.01 H new ATOM 0 HE ARG B 88 -13.909 4.721 13.971 1.00 4.74 H new ATOM 0 HH11 ARG B 88 -11.450 3.348 16.130 1.00 6.75 H new ATOM 0 HH12 ARG B 88 -12.642 2.590 17.190 1.00 6.75 H new ATOM 0 HH21 ARG B 88 -15.434 3.677 15.294 1.00 8.09 H new ATOM 0 HH22 ARG B 88 -14.900 2.776 16.716 1.00 8.09 H new ATOM 3075 N LYS B 89 -10.180 1.477 10.294 1.00 1.31 N ATOM 3076 CA LYS B 89 -10.411 0.071 10.578 1.00 1.37 C ATOM 3077 C LYS B 89 -9.254 -0.608 11.316 1.00 1.56 C ATOM 3078 O LYS B 89 -9.433 -1.728 11.791 1.00 1.56 O ATOM 3079 CB LYS B 89 -10.922 -0.684 9.346 1.00 2.32 C ATOM 3080 CG LYS B 89 -9.881 -1.111 8.304 1.00 2.03 C ATOM 3081 CD LYS B 89 -9.419 0.049 7.412 1.00 2.40 C ATOM 3082 CE LYS B 89 -8.703 -0.421 6.138 1.00 2.45 C ATOM 3083 NZ LYS B 89 -9.596 -1.117 5.185 1.00 3.62 N ATOM 0 H LYS B 89 -9.902 1.658 9.329 1.00 1.31 H new ATOM 0 HA LYS B 89 -11.225 0.027 11.302 1.00 1.37 H new ATOM 0 HB2 LYS B 89 -11.442 -1.578 9.690 1.00 2.32 H new ATOM 0 HB3 LYS B 89 -11.661 -0.057 8.848 1.00 2.32 H new ATOM 0 HG2 LYS B 89 -9.017 -1.537 8.814 1.00 2.03 H new ATOM 0 HG3 LYS B 89 -10.302 -1.898 7.679 1.00 2.03 H new ATOM 0 HD2 LYS B 89 -10.283 0.653 7.135 1.00 2.40 H new ATOM 0 HD3 LYS B 89 -8.749 0.693 7.982 1.00 2.40 H new ATOM 0 HE2 LYS B 89 -8.256 0.441 5.642 1.00 2.45 H new ATOM 0 HE3 LYS B 89 -7.887 -1.089 6.414 1.00 2.45 H new ATOM 0 HZ1 LYS B 89 -9.260 -2.091 5.042 1.00 3.62 H new ATOM 0 HZ2 LYS B 89 -10.563 -1.138 5.567 1.00 3.62 H new ATOM 0 HZ3 LYS B 89 -9.594 -0.613 4.276 1.00 3.62 H new ATOM 3097 N LYS B 90 -8.068 0.024 11.347 1.00 2.21 N ATOM 3098 CA LYS B 90 -6.876 -0.423 12.075 1.00 3.06 C ATOM 3099 C LYS B 90 -7.168 -0.561 13.580 1.00 2.23 C ATOM 3100 O LYS B 90 -6.700 0.229 14.398 1.00 2.33 O ATOM 3101 CB LYS B 90 -5.702 0.537 11.784 1.00 4.68 C ATOM 3102 CG LYS B 90 -4.371 0.070 12.412 1.00 5.82 C ATOM 3103 CD LYS B 90 -3.132 0.714 11.764 1.00 7.68 C ATOM 3104 CE LYS B 90 -2.924 2.193 12.136 1.00 8.48 C ATOM 3105 NZ LYS B 90 -1.664 2.415 12.882 1.00 9.91 N ATOM 0 H LYS B 90 -7.911 0.897 10.843 1.00 2.21 H new ATOM 0 HA LYS B 90 -6.589 -1.415 11.728 1.00 3.06 H new ATOM 0 HB2 LYS B 90 -5.575 0.631 10.705 1.00 4.68 H new ATOM 0 HB3 LYS B 90 -5.948 1.529 12.163 1.00 4.68 H new ATOM 0 HG2 LYS B 90 -4.378 0.303 13.477 1.00 5.82 H new ATOM 0 HG3 LYS B 90 -4.296 -1.014 12.324 1.00 5.82 H new ATOM 0 HD2 LYS B 90 -2.247 0.149 12.057 1.00 7.68 H new ATOM 0 HD3 LYS B 90 -3.218 0.632 10.681 1.00 7.68 H new ATOM 0 HE2 LYS B 90 -2.917 2.796 11.228 1.00 8.48 H new ATOM 0 HE3 LYS B 90 -3.765 2.535 12.739 1.00 8.48 H new ATOM 0 HZ1 LYS B 90 -1.376 3.410 12.789 1.00 9.91 H new ATOM 0 HZ2 LYS B 90 -1.811 2.189 13.887 1.00 9.91 H new ATOM 0 HZ3 LYS B 90 -0.919 1.802 12.495 1.00 9.91 H new ATOM 3119 N LYS B 91 -7.944 -1.586 13.929 1.00 1.98 N ATOM 3120 CA LYS B 91 -8.390 -1.931 15.264 1.00 2.13 C ATOM 3121 C LYS B 91 -9.063 -3.308 15.185 1.00 2.06 C ATOM 3122 O LYS B 91 -8.585 -4.252 15.812 1.00 2.53 O ATOM 3123 CB LYS B 91 -9.347 -0.856 15.815 1.00 3.07 C ATOM 3124 CG LYS B 91 -9.473 -0.936 17.342 1.00 3.45 C ATOM 3125 CD LYS B 91 -8.327 -0.197 18.047 1.00 4.48 C ATOM 3126 CE LYS B 91 -8.509 -0.300 19.568 1.00 5.07 C ATOM 3127 NZ LYS B 91 -7.436 0.397 20.307 1.00 6.78 N ATOM 0 H LYS B 91 -8.299 -2.239 13.231 1.00 1.98 H new ATOM 0 HA LYS B 91 -7.547 -1.974 15.954 1.00 2.13 H new ATOM 0 HB2 LYS B 91 -8.986 0.132 15.531 1.00 3.07 H new ATOM 0 HB3 LYS B 91 -10.331 -0.978 15.362 1.00 3.07 H new ATOM 0 HG2 LYS B 91 -10.426 -0.508 17.651 1.00 3.45 H new ATOM 0 HG3 LYS B 91 -9.477 -1.981 17.652 1.00 3.45 H new ATOM 0 HD2 LYS B 91 -7.369 -0.627 17.755 1.00 4.48 H new ATOM 0 HD3 LYS B 91 -8.313 0.849 17.742 1.00 4.48 H new ATOM 0 HE2 LYS B 91 -9.474 0.124 19.846 1.00 5.07 H new ATOM 0 HE3 LYS B 91 -8.526 -1.350 19.860 1.00 5.07 H new ATOM 0 HZ1 LYS B 91 -7.600 0.301 21.330 1.00 6.78 H new ATOM 0 HZ2 LYS B 91 -6.517 -0.023 20.063 1.00 6.78 H new ATOM 0 HZ3 LYS B 91 -7.435 1.405 20.050 1.00 6.78 H new ATOM 3141 N ASP B 92 -10.135 -3.427 14.385 1.00 1.97 N ATOM 3142 CA ASP B 92 -10.954 -4.637 14.319 1.00 2.15 C ATOM 3143 C ASP B 92 -11.593 -4.794 12.931 1.00 1.73 C ATOM 3144 O ASP B 92 -12.809 -4.957 12.846 1.00 1.90 O ATOM 3145 CB ASP B 92 -12.099 -4.535 15.353 1.00 2.86 C ATOM 3146 CG ASP B 92 -11.692 -4.508 16.815 1.00 3.79 C ATOM 3147 OD1 ASP B 92 -11.382 -3.405 17.308 1.00 4.41 O ATOM 3148 OD2 ASP B 92 -11.834 -5.579 17.446 1.00 4.67 O ATOM 0 H ASP B 92 -10.455 -2.682 13.766 1.00 1.97 H new ATOM 0 HA ASP B 92 -10.309 -5.492 14.524 1.00 2.15 H new ATOM 0 HB2 ASP B 92 -12.670 -3.631 15.141 1.00 2.86 H new ATOM 0 HB3 ASP B 92 -12.771 -5.380 15.202 1.00 2.86 H new ATOM 3153 N LEU B 93 -10.812 -4.811 11.843 1.00 1.56 N ATOM 3154 CA LEU B 93 -11.439 -4.959 10.527 1.00 1.42 C ATOM 3155 C LEU B 93 -11.767 -6.429 10.251 1.00 1.23 C ATOM 3156 O LEU B 93 -12.922 -6.849 10.297 1.00 0.88 O ATOM 3157 CB LEU B 93 -10.606 -4.261 9.426 1.00 2.31 C ATOM 3158 CG LEU B 93 -9.342 -4.921 8.843 1.00 1.81 C ATOM 3159 CD1 LEU B 93 -8.857 -4.180 7.592 1.00 3.32 C ATOM 3160 CD2 LEU B 93 -8.193 -4.980 9.863 1.00 2.55 C ATOM 0 H LEU B 93 -9.795 -4.729 11.843 1.00 1.56 H new ATOM 0 HA LEU B 93 -12.397 -4.439 10.519 1.00 1.42 H new ATOM 0 HB2 LEU B 93 -11.279 -4.070 8.591 1.00 2.31 H new ATOM 0 HB3 LEU B 93 -10.305 -3.291 9.821 1.00 2.31 H new ATOM 0 HG LEU B 93 -9.626 -5.940 8.580 1.00 1.81 H new ATOM 0 HD11 LEU B 93 -7.964 -4.669 7.203 1.00 3.32 H new ATOM 0 HD12 LEU B 93 -9.639 -4.197 6.833 1.00 3.32 H new ATOM 0 HD13 LEU B 93 -8.623 -3.147 7.849 1.00 3.32 H new ATOM 0 HD21 LEU B 93 -7.324 -5.453 9.406 1.00 2.55 H new ATOM 0 HD22 LEU B 93 -7.932 -3.969 10.176 1.00 2.55 H new ATOM 0 HD23 LEU B 93 -8.507 -5.559 10.731 1.00 2.55 H new ATOM 3172 N LYS B 94 -10.725 -7.256 10.176 1.00 1.98 N ATOM 3173 CA LYS B 94 -10.835 -8.644 9.764 1.00 2.38 C ATOM 3174 C LYS B 94 -11.319 -9.529 10.903 1.00 2.69 C ATOM 3175 O LYS B 94 -11.745 -10.657 10.683 1.00 3.02 O ATOM 3176 CB LYS B 94 -9.547 -9.113 9.085 1.00 3.71 C ATOM 3177 CG LYS B 94 -8.315 -9.135 10.000 1.00 3.89 C ATOM 3178 CD LYS B 94 -7.967 -10.559 10.455 1.00 4.04 C ATOM 3179 CE LYS B 94 -6.546 -10.587 11.045 1.00 5.25 C ATOM 3180 NZ LYS B 94 -6.055 -11.966 11.221 1.00 6.20 N ATOM 0 H LYS B 94 -9.772 -6.972 10.403 1.00 1.98 H new ATOM 0 HA LYS B 94 -11.610 -8.731 9.003 1.00 2.38 H new ATOM 0 HB2 LYS B 94 -9.706 -10.115 8.687 1.00 3.71 H new ATOM 0 HB3 LYS B 94 -9.341 -8.461 8.236 1.00 3.71 H new ATOM 0 HG2 LYS B 94 -7.464 -8.704 9.473 1.00 3.89 H new ATOM 0 HG3 LYS B 94 -8.500 -8.510 10.873 1.00 3.89 H new ATOM 0 HD2 LYS B 94 -8.686 -10.898 11.200 1.00 4.04 H new ATOM 0 HD3 LYS B 94 -8.034 -11.246 9.612 1.00 4.04 H new ATOM 0 HE2 LYS B 94 -5.869 -10.041 10.389 1.00 5.25 H new ATOM 0 HE3 LYS B 94 -6.541 -10.074 12.007 1.00 5.25 H new ATOM 0 HZ1 LYS B 94 -5.016 -11.961 11.272 1.00 6.20 H new ATOM 0 HZ2 LYS B 94 -6.443 -12.363 12.100 1.00 6.20 H new ATOM 0 HZ3 LYS B 94 -6.359 -12.548 10.415 1.00 6.20 H new ATOM 3194 N ILE B 95 -11.219 -9.024 12.136 1.00 3.02 N ATOM 3195 CA ILE B 95 -11.926 -9.585 13.277 1.00 3.75 C ATOM 3196 C ILE B 95 -13.433 -9.694 12.980 1.00 3.57 C ATOM 3197 O ILE B 95 -14.105 -10.518 13.596 1.00 4.39 O ATOM 3198 CB ILE B 95 -11.604 -8.755 14.541 1.00 4.15 C ATOM 3199 CG1 ILE B 95 -10.088 -8.838 14.818 1.00 5.54 C ATOM 3200 CG2 ILE B 95 -12.406 -9.237 15.762 1.00 5.08 C ATOM 3201 CD1 ILE B 95 -9.639 -8.135 16.104 1.00 5.74 C ATOM 0 H ILE B 95 -10.643 -8.214 12.365 1.00 3.02 H new ATOM 0 HA ILE B 95 -11.586 -10.603 13.468 1.00 3.75 H new ATOM 0 HB ILE B 95 -11.893 -7.719 14.363 1.00 4.15 H new ATOM 0 HG12 ILE B 95 -9.798 -9.887 14.872 1.00 5.54 H new ATOM 0 HG13 ILE B 95 -9.553 -8.402 13.974 1.00 5.54 H new ATOM 0 HG21 ILE B 95 -12.150 -8.628 16.629 1.00 5.08 H new ATOM 0 HG22 ILE B 95 -13.472 -9.146 15.556 1.00 5.08 H new ATOM 0 HG23 ILE B 95 -12.164 -10.280 15.968 1.00 5.08 H new ATOM 0 HD11 ILE B 95 -8.561 -8.243 16.220 1.00 5.74 H new ATOM 0 HD12 ILE B 95 -9.894 -7.077 16.048 1.00 5.74 H new ATOM 0 HD13 ILE B 95 -10.143 -8.585 16.959 1.00 5.74 H new ATOM 3213 N ARG B 96 -13.968 -8.903 12.036 1.00 2.75 N ATOM 3214 CA ARG B 96 -15.339 -9.054 11.561 1.00 3.04 C ATOM 3215 C ARG B 96 -16.297 -8.707 12.704 1.00 4.13 C ATOM 3216 O ARG B 96 -17.234 -9.440 13.019 1.00 5.36 O ATOM 3217 CB ARG B 96 -15.527 -10.462 10.958 1.00 3.39 C ATOM 3218 CG ARG B 96 -16.535 -10.526 9.802 1.00 2.64 C ATOM 3219 CD ARG B 96 -17.994 -10.551 10.264 1.00 2.91 C ATOM 3220 NE ARG B 96 -18.912 -10.749 9.131 1.00 2.99 N ATOM 3221 CZ ARG B 96 -19.344 -9.769 8.319 1.00 3.13 C ATOM 3222 NH1 ARG B 96 -18.827 -8.548 8.397 1.00 3.61 N ATOM 3223 NH2 ARG B 96 -20.309 -10.012 7.425 1.00 4.29 N ATOM 0 H ARG B 96 -13.457 -8.144 11.586 1.00 2.75 H new ATOM 0 HA ARG B 96 -15.568 -8.362 10.751 1.00 3.04 H new ATOM 0 HB2 ARG B 96 -14.562 -10.824 10.603 1.00 3.39 H new ATOM 0 HB3 ARG B 96 -15.852 -11.141 11.746 1.00 3.39 H new ATOM 0 HG2 ARG B 96 -16.383 -9.666 9.150 1.00 2.64 H new ATOM 0 HG3 ARG B 96 -16.336 -11.416 9.206 1.00 2.64 H new ATOM 0 HD2 ARG B 96 -18.133 -11.351 10.991 1.00 2.91 H new ATOM 0 HD3 ARG B 96 -18.233 -9.615 10.769 1.00 2.91 H new ATOM 0 HE ARG B 96 -19.244 -11.696 8.949 1.00 2.99 H new ATOM 0 HH11 ARG B 96 -18.095 -8.347 9.078 1.00 3.61 H new ATOM 0 HH12 ARG B 96 -19.162 -7.812 7.776 1.00 3.61 H new ATOM 0 HH21 ARG B 96 -20.719 -10.943 7.358 1.00 4.29 H new ATOM 0 HH22 ARG B 96 -20.634 -9.266 6.810 1.00 4.29 H new ATOM 3237 N LYS B 97 -16.029 -7.570 13.352 1.00 4.40 N ATOM 3238 CA LYS B 97 -16.840 -7.051 14.443 1.00 5.30 C ATOM 3239 C LYS B 97 -18.153 -6.451 13.914 1.00 4.20 C ATOM 3240 O LYS B 97 -19.113 -6.297 14.669 1.00 4.35 O ATOM 3241 CB LYS B 97 -15.995 -6.058 15.255 1.00 7.11 C ATOM 3242 CG LYS B 97 -16.678 -5.657 16.570 1.00 8.32 C ATOM 3243 CD LYS B 97 -15.727 -4.921 17.531 1.00 10.44 C ATOM 3244 CE LYS B 97 -15.056 -5.842 18.565 1.00 12.39 C ATOM 3245 NZ LYS B 97 -14.089 -6.786 17.971 1.00 13.26 N ATOM 0 H LYS B 97 -15.229 -6.979 13.125 1.00 4.40 H new ATOM 0 HA LYS B 97 -17.140 -7.857 15.113 1.00 5.30 H new ATOM 0 HB2 LYS B 97 -15.024 -6.503 15.473 1.00 7.11 H new ATOM 0 HB3 LYS B 97 -15.810 -5.166 14.656 1.00 7.11 H new ATOM 0 HG2 LYS B 97 -17.533 -5.018 16.351 1.00 8.32 H new ATOM 0 HG3 LYS B 97 -17.065 -6.550 17.061 1.00 8.32 H new ATOM 0 HD2 LYS B 97 -14.954 -4.419 16.949 1.00 10.44 H new ATOM 0 HD3 LYS B 97 -16.284 -4.145 18.056 1.00 10.44 H new ATOM 0 HE2 LYS B 97 -14.545 -5.230 19.308 1.00 12.39 H new ATOM 0 HE3 LYS B 97 -15.826 -6.406 19.092 1.00 12.39 H new ATOM 0 HZ1 LYS B 97 -13.637 -7.341 18.726 1.00 13.26 H new ATOM 0 HZ2 LYS B 97 -14.585 -7.427 17.320 1.00 13.26 H new ATOM 0 HZ3 LYS B 97 -13.363 -6.256 17.448 1.00 13.26 H new ATOM 3259 N LYS B 98 -18.193 -6.122 12.621 1.00 3.82 N ATOM 3260 CA LYS B 98 -19.382 -5.905 11.823 1.00 3.97 C ATOM 3261 C LYS B 98 -19.082 -6.596 10.495 1.00 4.61 C ATOM 3262 O LYS B 98 -19.968 -6.605 9.608 1.00 5.25 O ATOM 3263 CB LYS B 98 -19.648 -4.404 11.630 1.00 5.04 C ATOM 3264 CG LYS B 98 -20.524 -3.809 12.740 1.00 5.82 C ATOM 3265 CD LYS B 98 -21.992 -4.230 12.562 1.00 6.21 C ATOM 3266 CE LYS B 98 -22.888 -3.562 13.613 1.00 7.39 C ATOM 3267 NZ LYS B 98 -24.302 -3.967 13.463 1.00 7.93 N ATOM 3268 OXT LYS B 98 -17.966 -7.163 10.387 1.00 5.28 O ATOM 0 H LYS B 98 -17.339 -5.994 12.078 1.00 3.82 H new ATOM 0 HA LYS B 98 -20.280 -6.303 12.296 1.00 3.97 H new ATOM 0 HB2 LYS B 98 -18.697 -3.872 11.599 1.00 5.04 H new ATOM 0 HB3 LYS B 98 -20.133 -4.246 10.667 1.00 5.04 H new ATOM 0 HG2 LYS B 98 -20.161 -4.141 13.713 1.00 5.82 H new ATOM 0 HG3 LYS B 98 -20.449 -2.722 12.726 1.00 5.82 H new ATOM 0 HD2 LYS B 98 -22.333 -3.959 11.563 1.00 6.21 H new ATOM 0 HD3 LYS B 98 -22.076 -5.314 12.644 1.00 6.21 H new ATOM 0 HE2 LYS B 98 -22.538 -3.826 14.611 1.00 7.39 H new ATOM 0 HE3 LYS B 98 -22.808 -2.479 13.524 1.00 7.39 H new ATOM 0 HZ1 LYS B 98 -24.877 -3.496 14.190 1.00 7.93 H new ATOM 0 HZ2 LYS B 98 -24.644 -3.692 12.520 1.00 7.93 H new ATOM 0 HZ3 LYS B 98 -24.381 -4.998 13.573 1.00 7.93 H new TER 3282 LYS B 98