USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1458 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 MET CE :methyl -144:sc= 0 (180deg=0) USER MOD Set 1.2: A 188 HIS : no HE2:sc= -0.0962 K(o=-0.096,f=-0.89) USER MOD Set 2.1: A 113 MET CE :methyl -169:sc=-0.00484 (180deg=-0.172) USER MOD Set 2.2: A 116 CYS SG : rot -11:sc= -2.94! USER MOD Set 2.3: A 124 HIS : no HE2:sc= -0.788 X(o=-3.7,f=-3.6) USER MOD Set 3.1: A 109 THR OG1 : rot -44:sc= -2.48! USER MOD Set 3.2: A 176 HIS : no HD1:sc= -6.66! C(o=-9.1!,f=-17!) USER MOD Set 4.1: A 106 LYS NZ :NH3+ 144:sc= 1.61 (180deg=1.07) USER MOD Set 4.2: A 111 MET CE :methyl 151:sc= -4! (180deg=-7.84!) USER MOD Set 5.1: A 29 CYS SG : rot 180:sc= 0.588 USER MOD Set 5.2: A 81 TYR OH : rot -5:sc= 0.44 USER MOD Set 6.1: A 23 THR OG1 : rot -100:sc= -0.439 USER MOD Set 6.2: A 31 MET CE :methyl 149:sc= -4.18! (180deg=-4.89!) USER MOD Set 7.1: A 7 LYS NZ :NH3+ -103:sc= 0.681 (180deg=-0.312) USER MOD Set 7.2: A 16 THR OG1 : rot 180:sc= 0.577 USER MOD Set 8.1: A 5 SER OG : rot 101:sc= 1.16 USER MOD Set 8.2: A 75 ASN : amide:sc= 0.485 K(o=1.6,f=-3.4) USER MOD Single : A 0 THR OG1 : rot 180:sc= -0.78 USER MOD Single : A 1 MET CE :methyl -126:sc= -1.6! (180deg=-3.92!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -5 GLY N :NH3+ -159:sc= 1.3 (180deg=1.2) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ -147:sc= 1.14 (180deg=-0.669) USER MOD Single : A 17 MET CE :methyl -152:sc= -0.291 (180deg=-2.01) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 22 SER OG : rot 180:sc= 0.0686 USER MOD Single : A 24 MET CE :methyl 139:sc= -0.236 (180deg=-2.91!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 SER OG : rot -124:sc= -1.93! USER MOD Single : A 57 LYS NZ :NH3+ -168:sc= -0.117 (180deg=-0.355) USER MOD Single : A 58 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.185) USER MOD Single : A 66 LYS NZ :NH3+ -157:sc= -1.15! (180deg=-4.34!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 33:sc= 0.989 USER MOD Single : A 72 MET CE :methyl -162:sc= -0.124 (180deg=-0.682) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 147:sc= -1.48 (180deg=-5.36!) USER MOD Single : A 83 LYS NZ :NH3+ -134:sc= -0.354 (180deg=-2.02!) USER MOD Single : A 84 LYS NZ :NH3+ 175:sc= 0.593 (180deg=0.486) USER MOD Single : A 85 GLN : amide:sc= -0.573 K(o=-0.57,f=-4.5!) USER MOD Single : A 89 LYS NZ :NH3+ 159:sc= -0.0761 (180deg=-0.419) USER MOD Single : A 92 MET CE :methyl 158:sc= -1.26 (180deg=-2.49!) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.0338 USER MOD Single : A 98 LYS NZ :NH3+ -105:sc= -2.2! (180deg=-4.89!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 142:sc= -5.1! (180deg=-7.3!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.042 USER MOD Single : A 114 THR OG1 : rot 73:sc= 0.133 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0.988 K(o=0.99,f=-1.3!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= -0.26 USER MOD Single : A 137 LYS NZ :NH3+ -167:sc=-0.00276 (180deg=-0.171) USER MOD Single : A 138 LYS NZ :NH3+ -171:sc= 0.926 (180deg=0.354) USER MOD Single : A 172 ASN : amide:sc= -2.21! K(o=-2.2!,f=-1.1) USER MOD Single : A 179 THR OG1 : rot 180:sc= -0.0916 USER MOD Single : A 183 GLN : amide:sc= -2.49 K(o=-2.5,f=-4.6!) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ -170:sc=-0.00705 (180deg=-0.078) USER MOD Single : A 199 TYR OH : rot 75:sc= 1.12 USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 202 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -26.124 -13.233 -2.371 1.00 10.08 N ATOM 2 CA GLY A -5 -26.856 -12.825 -3.594 1.00 9.65 C ATOM 3 C GLY A -5 -27.843 -11.722 -3.305 1.00 8.52 C ATOM 4 O GLY A -5 -27.599 -10.556 -3.624 1.00 8.35 O ATOM 0 H1 GLY A -5 -25.239 -13.709 -2.639 1.00 10.08 H new ATOM 0 H2 GLY A -5 -25.906 -12.392 -1.800 1.00 10.08 H new ATOM 0 H3 GLY A -5 -26.713 -13.885 -1.815 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -26.146 -12.490 -4.350 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -27.381 -13.685 -4.009 1.00 9.65 H new ATOM 10 N ILE A -4 -28.957 -12.076 -2.683 1.00 7.94 N ATOM 11 CA ILE A -4 -29.941 -11.090 -2.268 1.00 6.97 C ATOM 12 C ILE A -4 -29.630 -10.607 -0.861 1.00 6.09 C ATOM 13 O ILE A -4 -30.508 -10.523 0.001 1.00 5.96 O ATOM 14 CB ILE A -4 -31.387 -11.634 -2.333 1.00 7.12 C ATOM 15 CG1 ILE A -4 -31.513 -12.949 -1.554 1.00 7.77 C ATOM 16 CG2 ILE A -4 -31.815 -11.821 -3.782 1.00 7.21 C ATOM 17 CD1 ILE A -4 -32.926 -13.491 -1.496 1.00 8.21 C ATOM 0 H ILE A -4 -29.202 -13.040 -2.455 1.00 7.94 H new ATOM 0 HA ILE A -4 -29.878 -10.257 -2.968 1.00 6.97 H new ATOM 0 HB ILE A -4 -32.050 -10.905 -1.867 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -30.866 -13.696 -2.013 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -31.151 -12.795 -0.538 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -32.835 -12.204 -3.814 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -31.771 -10.863 -4.301 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -31.146 -12.529 -4.271 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -32.936 -14.422 -0.929 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -33.575 -12.763 -1.009 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -33.286 -13.679 -2.508 1.00 8.21 H new ATOM 29 N ASP A -3 -28.365 -10.275 -0.656 1.00 5.76 N ATOM 30 CA ASP A -3 -27.878 -9.820 0.636 1.00 5.11 C ATOM 31 C ASP A -3 -28.629 -8.569 1.063 1.00 4.13 C ATOM 32 O ASP A -3 -28.697 -7.589 0.316 1.00 4.11 O ATOM 33 CB ASP A -3 -26.370 -9.549 0.581 1.00 5.67 C ATOM 34 CG ASP A -3 -25.555 -10.815 0.383 1.00 6.72 C ATOM 35 OD1 ASP A -3 -25.299 -11.187 -0.786 1.00 7.08 O ATOM 36 OD2 ASP A -3 -25.164 -11.445 1.390 1.00 7.33 O ATOM 0 H ASP A -3 -27.648 -10.313 -1.380 1.00 5.76 H new ATOM 0 HA ASP A -3 -28.055 -10.605 1.372 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -26.159 -8.855 -0.232 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -26.058 -9.062 1.505 1.00 5.67 H new ATOM 41 N PRO A -2 -29.223 -8.598 2.263 1.00 3.75 N ATOM 42 CA PRO A -2 -30.074 -7.515 2.749 1.00 3.21 C ATOM 43 C PRO A -2 -29.282 -6.272 3.130 1.00 2.50 C ATOM 44 O PRO A -2 -28.329 -6.338 3.910 1.00 2.81 O ATOM 45 CB PRO A -2 -30.747 -8.118 3.982 1.00 3.86 C ATOM 46 CG PRO A -2 -29.797 -9.158 4.466 1.00 4.50 C ATOM 47 CD PRO A -2 -29.104 -9.694 3.243 1.00 4.43 C ATOM 0 HA PRO A -2 -30.774 -7.178 1.984 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -30.926 -7.360 4.745 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -31.715 -8.553 3.731 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -29.078 -8.733 5.166 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -30.325 -9.952 4.994 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -28.061 -9.936 3.448 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -29.578 -10.607 2.882 1.00 4.43 H new ATOM 55 N PHE A -1 -29.668 -5.146 2.559 1.00 2.13 N ATOM 56 CA PHE A -1 -29.087 -3.873 2.906 1.00 1.78 C ATOM 57 C PHE A -1 -30.188 -2.882 3.220 1.00 1.73 C ATOM 58 O PHE A -1 -30.662 -2.152 2.348 1.00 2.21 O ATOM 59 CB PHE A -1 -28.198 -3.353 1.780 1.00 2.13 C ATOM 60 CG PHE A -1 -26.886 -4.071 1.680 1.00 2.45 C ATOM 61 CD1 PHE A -1 -25.801 -3.651 2.427 1.00 2.78 C ATOM 62 CD2 PHE A -1 -26.740 -5.166 0.846 1.00 2.89 C ATOM 63 CE1 PHE A -1 -24.590 -4.311 2.346 1.00 3.51 C ATOM 64 CE2 PHE A -1 -25.532 -5.832 0.759 1.00 3.47 C ATOM 65 CZ PHE A -1 -24.455 -5.403 1.510 1.00 3.78 C ATOM 0 H PHE A -1 -30.393 -5.094 1.843 1.00 2.13 H new ATOM 0 HA PHE A -1 -28.460 -4.001 3.789 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -28.730 -3.449 0.833 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -28.012 -2.290 1.935 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -25.901 -2.797 3.081 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -27.580 -5.504 0.257 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -23.750 -3.974 2.935 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -25.430 -6.686 0.105 1.00 3.47 H new ATOM 0 HZ PHE A -1 -23.509 -5.920 1.444 1.00 3.78 H new ATOM 75 N THR A 0 -30.635 -2.914 4.458 1.00 1.54 N ATOM 76 CA THR A 0 -31.648 -1.996 4.938 1.00 1.59 C ATOM 77 C THR A 0 -31.010 -0.667 5.332 1.00 1.40 C ATOM 78 O THR A 0 -30.129 -0.168 4.630 1.00 1.49 O ATOM 79 CB THR A 0 -32.393 -2.618 6.130 1.00 1.75 C ATOM 80 OG1 THR A 0 -31.445 -3.216 7.023 1.00 1.70 O ATOM 81 CG2 THR A 0 -33.388 -3.668 5.657 1.00 2.11 C ATOM 0 H THR A 0 -30.307 -3.577 5.160 1.00 1.54 H new ATOM 0 HA THR A 0 -32.366 -1.806 4.140 1.00 1.59 H new ATOM 0 HB THR A 0 -32.944 -1.833 6.648 1.00 1.75 H new ATOM 0 HG1 THR A 0 -31.918 -3.612 7.785 1.00 1.70 H new ATOM 0 HG21 THR A 0 -33.903 -4.095 6.518 1.00 2.11 H new ATOM 0 HG22 THR A 0 -34.116 -3.205 4.991 1.00 2.11 H new ATOM 0 HG23 THR A 0 -32.858 -4.457 5.124 1.00 2.11 H new ATOM 89 N MET A 1 -31.425 -0.094 6.453 1.00 1.38 N ATOM 90 CA MET A 1 -30.840 1.162 6.903 1.00 1.36 C ATOM 91 C MET A 1 -29.601 0.884 7.743 1.00 1.21 C ATOM 92 O MET A 1 -29.265 1.602 8.682 1.00 1.42 O ATOM 93 CB MET A 1 -31.861 1.999 7.672 1.00 1.66 C ATOM 94 CG MET A 1 -31.481 3.467 7.825 1.00 1.86 C ATOM 95 SD MET A 1 -31.443 4.366 6.254 1.00 2.09 S ATOM 96 CE MET A 1 -29.775 4.043 5.674 1.00 1.64 C ATOM 0 H MET A 1 -32.153 -0.471 7.060 1.00 1.38 H new ATOM 0 HA MET A 1 -30.541 1.743 6.031 1.00 1.36 H new ATOM 0 HB2 MET A 1 -32.823 1.936 7.163 1.00 1.66 H new ATOM 0 HB3 MET A 1 -31.996 1.566 8.663 1.00 1.66 H new ATOM 0 HG2 MET A 1 -32.192 3.951 8.495 1.00 1.86 H new ATOM 0 HG3 MET A 1 -30.501 3.534 8.297 1.00 1.86 H new ATOM 0 HE1 MET A 1 -29.276 4.987 5.458 1.00 1.64 H new ATOM 0 HE2 MET A 1 -29.220 3.507 6.443 1.00 1.64 H new ATOM 0 HE3 MET A 1 -29.816 3.439 4.768 1.00 1.64 H new ATOM 106 N VAL A 2 -28.918 -0.162 7.345 1.00 1.00 N ATOM 107 CA VAL A 2 -27.650 -0.556 7.918 1.00 0.98 C ATOM 108 C VAL A 2 -26.678 -0.754 6.768 1.00 0.79 C ATOM 109 O VAL A 2 -26.058 -1.802 6.601 1.00 0.92 O ATOM 110 CB VAL A 2 -27.753 -1.843 8.778 1.00 1.21 C ATOM 111 CG1 VAL A 2 -28.604 -1.594 10.012 1.00 1.56 C ATOM 112 CG2 VAL A 2 -28.316 -3.004 7.973 1.00 1.32 C ATOM 0 H VAL A 2 -29.234 -0.778 6.596 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.306 0.224 8.597 1.00 0.98 H new ATOM 0 HB VAL A 2 -26.745 -2.111 9.095 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -28.665 -2.508 10.603 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -28.153 -0.804 10.612 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -29.606 -1.291 9.708 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -28.375 -3.890 8.605 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -29.312 -2.748 7.613 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -27.664 -3.207 7.123 1.00 1.32 H new ATOM 122 N ALA A 3 -26.587 0.277 5.957 1.00 0.66 N ATOM 123 CA ALA A 3 -25.779 0.254 4.768 1.00 0.55 C ATOM 124 C ALA A 3 -25.141 1.606 4.588 1.00 0.60 C ATOM 125 O ALA A 3 -25.760 2.640 4.847 1.00 1.10 O ATOM 126 CB ALA A 3 -26.613 -0.109 3.547 1.00 0.63 C ATOM 0 H ALA A 3 -27.077 1.159 6.109 1.00 0.66 H new ATOM 0 HA ALA A 3 -25.006 -0.507 4.874 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -25.977 -0.119 2.662 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -27.054 -1.096 3.688 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -27.406 0.628 3.416 1.00 0.63 H new ATOM 132 N LEU A 4 -23.909 1.589 4.159 1.00 0.45 N ATOM 133 CA LEU A 4 -23.162 2.802 3.959 1.00 0.41 C ATOM 134 C LEU A 4 -22.890 2.977 2.477 1.00 0.39 C ATOM 135 O LEU A 4 -22.460 2.041 1.805 1.00 0.38 O ATOM 136 CB LEU A 4 -21.856 2.750 4.751 1.00 0.41 C ATOM 137 CG LEU A 4 -22.011 2.513 6.256 1.00 0.56 C ATOM 138 CD1 LEU A 4 -20.664 2.608 6.953 1.00 1.16 C ATOM 139 CD2 LEU A 4 -22.997 3.497 6.867 1.00 1.46 C ATOM 0 H LEU A 4 -23.395 0.736 3.938 1.00 0.45 H new ATOM 0 HA LEU A 4 -23.738 3.655 4.317 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -21.231 1.958 4.338 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -21.322 3.688 4.601 1.00 0.41 H new ATOM 0 HG LEU A 4 -22.406 1.507 6.398 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -20.794 2.437 8.022 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -19.989 1.856 6.545 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -20.241 3.600 6.793 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -23.087 3.305 7.936 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -22.640 4.515 6.710 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -23.971 3.377 6.393 1.00 1.46 H new ATOM 151 N SER A 5 -23.137 4.171 1.975 1.00 0.41 N ATOM 152 CA SER A 5 -22.981 4.438 0.559 1.00 0.42 C ATOM 153 C SER A 5 -21.564 4.909 0.292 1.00 0.37 C ATOM 154 O SER A 5 -21.205 6.044 0.610 1.00 0.42 O ATOM 155 CB SER A 5 -23.999 5.476 0.083 1.00 0.51 C ATOM 156 OG SER A 5 -25.326 5.001 0.251 1.00 1.28 O ATOM 0 H SER A 5 -23.446 4.971 2.526 1.00 0.41 H new ATOM 0 HA SER A 5 -23.165 3.520 0.000 1.00 0.42 H new ATOM 0 HB2 SER A 5 -23.867 6.403 0.642 1.00 0.51 H new ATOM 0 HB3 SER A 5 -23.822 5.709 -0.967 1.00 0.51 H new ATOM 0 HG SER A 5 -25.716 5.398 1.058 1.00 1.28 H new ATOM 162 N LEU A 6 -20.753 4.024 -0.260 1.00 0.31 N ATOM 163 CA LEU A 6 -19.348 4.314 -0.463 1.00 0.28 C ATOM 164 C LEU A 6 -19.040 4.398 -1.946 1.00 0.28 C ATOM 165 O LEU A 6 -19.490 3.563 -2.734 1.00 0.31 O ATOM 166 CB LEU A 6 -18.479 3.231 0.187 1.00 0.26 C ATOM 167 CG LEU A 6 -18.780 2.942 1.661 1.00 0.33 C ATOM 168 CD1 LEU A 6 -17.809 1.909 2.211 1.00 0.61 C ATOM 169 CD2 LEU A 6 -18.723 4.219 2.482 1.00 0.62 C ATOM 0 H LEU A 6 -21.045 3.099 -0.575 1.00 0.31 H new ATOM 0 HA LEU A 6 -19.123 5.273 0.003 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -18.598 2.307 -0.378 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -17.434 3.527 0.099 1.00 0.26 H new ATOM 0 HG LEU A 6 -19.790 2.537 1.731 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -18.038 1.716 3.259 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -17.902 0.983 1.643 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -16.790 2.286 2.126 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -18.940 3.991 3.526 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -17.728 4.657 2.406 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -19.461 4.927 2.105 1.00 0.62 H new ATOM 181 N LYS A 7 -18.292 5.415 -2.332 1.00 0.29 N ATOM 182 CA LYS A 7 -17.841 5.520 -3.705 1.00 0.31 C ATOM 183 C LYS A 7 -16.567 4.735 -3.881 1.00 0.29 C ATOM 184 O LYS A 7 -15.562 5.011 -3.235 1.00 0.31 O ATOM 185 CB LYS A 7 -17.612 6.960 -4.127 1.00 0.39 C ATOM 186 CG LYS A 7 -18.884 7.764 -4.245 1.00 0.52 C ATOM 187 CD LYS A 7 -18.775 8.768 -5.371 1.00 0.63 C ATOM 188 CE LYS A 7 -18.966 8.119 -6.730 1.00 0.94 C ATOM 189 NZ LYS A 7 -20.356 7.630 -6.919 1.00 1.72 N ATOM 0 H LYS A 7 -17.987 6.172 -1.721 1.00 0.29 H new ATOM 0 HA LYS A 7 -18.628 5.112 -4.340 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -16.953 7.441 -3.404 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -17.095 6.971 -5.086 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -19.727 7.097 -4.425 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -19.082 8.282 -3.306 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -19.522 9.550 -5.234 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -17.798 9.251 -5.333 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -18.724 8.838 -7.513 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -18.271 7.286 -6.836 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -20.381 6.598 -6.795 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -20.980 8.078 -6.218 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -20.682 7.872 -7.877 1.00 1.72 H new ATOM 203 N ILE A 8 -16.615 3.769 -4.758 1.00 0.28 N ATOM 204 CA ILE A 8 -15.494 2.873 -4.953 1.00 0.28 C ATOM 205 C ILE A 8 -14.732 3.248 -6.209 1.00 0.31 C ATOM 206 O ILE A 8 -15.120 2.883 -7.317 1.00 0.34 O ATOM 207 CB ILE A 8 -15.942 1.400 -5.055 1.00 0.33 C ATOM 208 CG1 ILE A 8 -16.816 1.010 -3.855 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.724 0.497 -5.143 1.00 0.32 C ATOM 210 CD1 ILE A 8 -16.133 1.181 -2.515 1.00 0.51 C ATOM 0 H ILE A 8 -17.420 3.577 -5.354 1.00 0.28 H new ATOM 0 HA ILE A 8 -14.849 2.975 -4.080 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.540 1.279 -5.958 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -17.724 1.613 -3.868 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -17.123 -0.030 -3.965 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -15.046 -0.542 -5.215 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -14.141 0.758 -6.026 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -14.110 0.626 -4.251 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.815 0.885 -1.718 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -15.240 0.556 -2.479 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -15.851 2.225 -2.381 1.00 0.51 H new ATOM 222 N SER A 9 -13.649 3.976 -6.037 1.00 0.33 N ATOM 223 CA SER A 9 -12.846 4.386 -7.168 1.00 0.39 C ATOM 224 C SER A 9 -11.724 3.381 -7.385 1.00 0.37 C ATOM 225 O SER A 9 -10.695 3.413 -6.714 1.00 0.45 O ATOM 226 CB SER A 9 -12.301 5.801 -6.967 1.00 0.46 C ATOM 227 OG SER A 9 -13.357 6.740 -6.839 1.00 1.48 O ATOM 0 H SER A 9 -13.306 4.294 -5.131 1.00 0.33 H new ATOM 0 HA SER A 9 -13.470 4.408 -8.061 1.00 0.39 H new ATOM 0 HB2 SER A 9 -11.674 5.830 -6.076 1.00 0.46 H new ATOM 0 HB3 SER A 9 -11.668 6.074 -7.811 1.00 0.46 H new ATOM 0 HG SER A 9 -12.983 7.637 -6.710 1.00 1.48 H new ATOM 233 N ILE A 10 -11.956 2.461 -8.302 1.00 0.40 N ATOM 234 CA ILE A 10 -11.005 1.409 -8.600 1.00 0.42 C ATOM 235 C ILE A 10 -9.983 1.909 -9.618 1.00 0.50 C ATOM 236 O ILE A 10 -10.057 1.596 -10.807 1.00 0.53 O ATOM 237 CB ILE A 10 -11.727 0.157 -9.146 1.00 0.40 C ATOM 238 CG1 ILE A 10 -12.930 -0.175 -8.257 1.00 0.38 C ATOM 239 CG2 ILE A 10 -10.768 -1.027 -9.214 1.00 0.45 C ATOM 240 CD1 ILE A 10 -13.902 -1.153 -8.880 1.00 0.43 C ATOM 0 H ILE A 10 -12.809 2.423 -8.861 1.00 0.40 H new ATOM 0 HA ILE A 10 -10.491 1.134 -7.679 1.00 0.42 H new ATOM 0 HB ILE A 10 -12.080 0.364 -10.156 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -12.570 -0.587 -7.314 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -13.460 0.748 -8.020 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -11.294 -1.900 -9.601 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -9.935 -0.783 -9.874 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -10.388 -1.245 -8.216 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -14.725 -1.337 -8.190 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -14.293 -0.736 -9.808 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -13.389 -2.091 -9.091 1.00 0.43 H new ATOM 252 N GLY A 11 -9.056 2.729 -9.146 1.00 0.59 N ATOM 253 CA GLY A 11 -8.055 3.302 -10.021 1.00 0.68 C ATOM 254 C GLY A 11 -8.605 4.449 -10.843 1.00 0.75 C ATOM 255 O GLY A 11 -8.628 5.592 -10.387 1.00 0.96 O ATOM 0 H GLY A 11 -8.979 3.009 -8.168 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -7.213 3.655 -9.426 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -7.672 2.529 -10.688 1.00 0.68 H new ATOM 259 N ASN A 12 -9.061 4.144 -12.050 1.00 0.75 N ATOM 260 CA ASN A 12 -9.592 5.163 -12.951 1.00 0.90 C ATOM 261 C ASN A 12 -11.115 5.115 -12.965 1.00 0.84 C ATOM 262 O ASN A 12 -11.781 6.134 -13.145 1.00 1.09 O ATOM 263 CB ASN A 12 -9.059 4.956 -14.372 1.00 1.09 C ATOM 264 CG ASN A 12 -7.547 4.839 -14.421 1.00 1.77 C ATOM 265 OD1 ASN A 12 -6.834 5.837 -14.518 1.00 2.62 O ATOM 266 ND2 ASN A 12 -7.046 3.615 -14.358 1.00 2.17 N ATOM 0 H ASN A 12 -9.075 3.198 -12.430 1.00 0.75 H new ATOM 0 HA ASN A 12 -9.267 6.139 -12.590 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -9.503 4.054 -14.794 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -9.375 5.790 -14.999 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -6.036 3.475 -14.390 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -7.670 2.812 -14.278 1.00 2.17 H new ATOM 273 N VAL A 13 -11.654 3.921 -12.772 1.00 0.65 N ATOM 274 CA VAL A 13 -13.096 3.713 -12.752 1.00 0.61 C ATOM 275 C VAL A 13 -13.633 3.962 -11.341 1.00 0.53 C ATOM 276 O VAL A 13 -12.884 3.880 -10.372 1.00 0.50 O ATOM 277 CB VAL A 13 -13.438 2.270 -13.219 1.00 0.61 C ATOM 278 CG1 VAL A 13 -12.837 1.234 -12.285 1.00 0.55 C ATOM 279 CG2 VAL A 13 -14.938 2.052 -13.348 1.00 0.65 C ATOM 0 H VAL A 13 -11.108 3.072 -12.625 1.00 0.65 H new ATOM 0 HA VAL A 13 -13.569 4.416 -13.438 1.00 0.61 H new ATOM 0 HB VAL A 13 -12.997 2.148 -14.208 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -13.093 0.235 -12.637 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -11.753 1.346 -12.267 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -13.233 1.377 -11.280 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -15.130 1.031 -13.677 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -15.414 2.218 -12.382 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -15.346 2.751 -14.078 1.00 0.65 H new ATOM 289 N VAL A 14 -14.910 4.291 -11.222 1.00 0.51 N ATOM 290 CA VAL A 14 -15.526 4.467 -9.914 1.00 0.46 C ATOM 291 C VAL A 14 -16.955 3.938 -9.919 1.00 0.41 C ATOM 292 O VAL A 14 -17.770 4.289 -10.775 1.00 0.45 O ATOM 293 CB VAL A 14 -15.480 5.938 -9.412 1.00 0.53 C ATOM 294 CG1 VAL A 14 -15.965 6.902 -10.474 1.00 0.62 C ATOM 295 CG2 VAL A 14 -16.292 6.109 -8.129 1.00 0.50 C ATOM 0 H VAL A 14 -15.539 4.441 -12.011 1.00 0.51 H new ATOM 0 HA VAL A 14 -14.934 3.884 -9.208 1.00 0.46 H new ATOM 0 HB VAL A 14 -14.438 6.171 -9.194 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -15.919 7.921 -10.089 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -15.332 6.819 -11.357 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -16.994 6.661 -10.742 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -16.241 7.148 -7.802 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -17.331 5.838 -8.317 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -15.884 5.463 -7.351 1.00 0.50 H new ATOM 305 N LYS A 15 -17.231 3.073 -8.962 1.00 0.39 N ATOM 306 CA LYS A 15 -18.520 2.424 -8.840 1.00 0.41 C ATOM 307 C LYS A 15 -19.101 2.702 -7.466 1.00 0.35 C ATOM 308 O LYS A 15 -18.370 2.856 -6.496 1.00 0.31 O ATOM 309 CB LYS A 15 -18.401 0.914 -9.065 1.00 0.50 C ATOM 310 CG LYS A 15 -18.089 0.523 -10.501 1.00 0.67 C ATOM 311 CD LYS A 15 -19.109 1.107 -11.471 1.00 0.80 C ATOM 312 CE LYS A 15 -18.923 0.560 -12.876 1.00 1.02 C ATOM 313 NZ LYS A 15 -19.374 -0.851 -12.985 1.00 1.28 N ATOM 0 H LYS A 15 -16.561 2.800 -8.243 1.00 0.39 H new ATOM 0 HA LYS A 15 -19.184 2.827 -9.605 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.619 0.521 -8.415 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -19.335 0.438 -8.765 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -17.091 0.872 -10.766 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -18.080 -0.563 -10.590 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -20.116 0.879 -11.122 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -19.016 2.193 -11.488 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -19.481 1.175 -13.582 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -17.872 0.628 -13.156 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -18.780 -1.353 -13.676 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -19.293 -1.314 -12.057 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -20.365 -0.875 -13.298 1.00 1.28 H new ATOM 327 N THR A 16 -20.408 2.785 -7.388 1.00 0.38 N ATOM 328 CA THR A 16 -21.062 3.074 -6.128 1.00 0.37 C ATOM 329 C THR A 16 -21.582 1.787 -5.509 1.00 0.35 C ATOM 330 O THR A 16 -22.404 1.086 -6.109 1.00 0.39 O ATOM 331 CB THR A 16 -22.217 4.072 -6.305 1.00 0.45 C ATOM 332 OG1 THR A 16 -21.742 5.257 -6.959 1.00 0.50 O ATOM 333 CG2 THR A 16 -22.825 4.442 -4.960 1.00 0.45 C ATOM 0 H THR A 16 -21.040 2.657 -8.178 1.00 0.38 H new ATOM 0 HA THR A 16 -20.326 3.529 -5.466 1.00 0.37 H new ATOM 0 HB THR A 16 -22.986 3.600 -6.916 1.00 0.45 H new ATOM 0 HG1 THR A 16 -22.483 5.888 -7.071 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.640 5.149 -5.112 1.00 0.45 H new ATOM 0 HG22 THR A 16 -23.209 3.544 -4.475 1.00 0.45 H new ATOM 0 HG23 THR A 16 -22.062 4.898 -4.329 1.00 0.45 H new ATOM 341 N MET A 17 -21.088 1.467 -4.323 1.00 0.31 N ATOM 342 CA MET A 17 -21.462 0.240 -3.647 1.00 0.32 C ATOM 343 C MET A 17 -21.805 0.539 -2.203 1.00 0.32 C ATOM 344 O MET A 17 -21.248 1.459 -1.602 1.00 0.31 O ATOM 345 CB MET A 17 -20.331 -0.789 -3.725 1.00 0.34 C ATOM 346 CG MET A 17 -20.618 -1.943 -4.672 1.00 0.44 C ATOM 347 SD MET A 17 -21.646 -3.232 -3.927 1.00 1.04 S ATOM 348 CE MET A 17 -20.558 -3.854 -2.641 1.00 0.40 C ATOM 0 H MET A 17 -20.424 2.045 -3.809 1.00 0.31 H new ATOM 0 HA MET A 17 -22.336 -0.182 -4.143 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.417 -0.288 -4.044 1.00 0.34 H new ATOM 0 HB3 MET A 17 -20.145 -1.187 -2.728 1.00 0.34 H new ATOM 0 HG2 MET A 17 -21.115 -1.559 -5.563 1.00 0.44 H new ATOM 0 HG3 MET A 17 -19.675 -2.382 -4.998 1.00 0.44 H new ATOM 0 HE1 MET A 17 -20.793 -4.899 -2.440 1.00 0.40 H new ATOM 0 HE2 MET A 17 -19.522 -3.772 -2.970 1.00 0.40 H new ATOM 0 HE3 MET A 17 -20.698 -3.269 -1.732 1.00 0.40 H new ATOM 358 N GLN A 18 -22.723 -0.219 -1.653 1.00 0.36 N ATOM 359 CA GLN A 18 -23.084 -0.063 -0.262 1.00 0.37 C ATOM 360 C GLN A 18 -22.661 -1.280 0.532 1.00 0.35 C ATOM 361 O GLN A 18 -22.765 -2.412 0.057 1.00 0.38 O ATOM 362 CB GLN A 18 -24.578 0.192 -0.130 1.00 0.44 C ATOM 363 CG GLN A 18 -24.957 1.590 -0.573 1.00 0.49 C ATOM 364 CD GLN A 18 -26.375 1.685 -1.089 1.00 0.59 C ATOM 365 OE1 GLN A 18 -27.266 0.961 -0.646 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.586 2.573 -2.046 1.00 0.60 N ATOM 0 H GLN A 18 -23.235 -0.951 -2.146 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.559 0.801 0.145 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -25.124 -0.538 -0.727 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -24.880 0.046 0.907 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -24.835 2.276 0.265 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -24.270 1.916 -1.354 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -25.817 3.152 -2.383 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.518 2.679 -2.447 1.00 0.60 H new ATOM 375 N PHE A 19 -22.176 -1.041 1.732 1.00 0.34 N ATOM 376 CA PHE A 19 -21.690 -2.097 2.597 1.00 0.33 C ATOM 377 C PHE A 19 -22.339 -1.923 3.953 1.00 0.37 C ATOM 378 O PHE A 19 -22.809 -0.833 4.272 1.00 0.40 O ATOM 379 CB PHE A 19 -20.166 -2.024 2.755 1.00 0.29 C ATOM 380 CG PHE A 19 -19.394 -2.129 1.471 1.00 0.27 C ATOM 381 CD1 PHE A 19 -19.113 -0.999 0.726 1.00 0.30 C ATOM 382 CD2 PHE A 19 -18.965 -3.360 1.002 1.00 0.33 C ATOM 383 CE1 PHE A 19 -18.416 -1.093 -0.464 1.00 0.31 C ATOM 384 CE2 PHE A 19 -18.267 -3.462 -0.184 1.00 0.36 C ATOM 385 CZ PHE A 19 -17.939 -2.323 -0.887 1.00 0.31 C ATOM 0 H PHE A 19 -22.107 -0.107 2.137 1.00 0.34 H new ATOM 0 HA PHE A 19 -21.939 -3.064 2.161 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.910 -1.082 3.241 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -19.845 -2.824 3.422 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.442 -0.032 1.078 1.00 0.30 H new ATOM 0 HD2 PHE A 19 -19.180 -4.252 1.572 1.00 0.33 H new ATOM 0 HE1 PHE A 19 -18.244 -0.210 -1.062 1.00 0.31 H new ATOM 0 HE2 PHE A 19 -17.978 -4.432 -0.560 1.00 0.36 H new ATOM 0 HZ PHE A 19 -17.313 -2.389 -1.764 1.00 0.31 H new ATOM 395 N GLU A 20 -22.382 -2.972 4.743 1.00 0.39 N ATOM 396 CA GLU A 20 -22.915 -2.865 6.086 1.00 0.43 C ATOM 397 C GLU A 20 -21.919 -2.108 6.958 1.00 0.44 C ATOM 398 O GLU A 20 -20.715 -2.132 6.700 1.00 0.47 O ATOM 399 CB GLU A 20 -23.189 -4.248 6.678 1.00 0.50 C ATOM 400 CG GLU A 20 -23.980 -5.164 5.757 1.00 0.61 C ATOM 401 CD GLU A 20 -24.254 -6.518 6.379 1.00 0.90 C ATOM 402 OE1 GLU A 20 -23.294 -7.182 6.825 1.00 1.06 O ATOM 403 OE2 GLU A 20 -25.433 -6.920 6.442 1.00 1.42 O ATOM 0 H GLU A 20 -22.057 -3.903 4.483 1.00 0.39 H new ATOM 0 HA GLU A 20 -23.860 -2.324 6.050 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -22.239 -4.724 6.920 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -23.734 -4.131 7.614 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -24.926 -4.687 5.501 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -23.430 -5.300 4.826 1.00 0.61 H new ATOM 410 N PRO A 21 -22.395 -1.424 7.997 1.00 0.50 N ATOM 411 CA PRO A 21 -21.528 -0.687 8.906 1.00 0.53 C ATOM 412 C PRO A 21 -20.637 -1.647 9.692 1.00 0.53 C ATOM 413 O PRO A 21 -19.572 -1.280 10.187 1.00 0.65 O ATOM 414 CB PRO A 21 -22.500 0.061 9.832 1.00 0.57 C ATOM 415 CG PRO A 21 -23.863 -0.112 9.242 1.00 0.61 C ATOM 416 CD PRO A 21 -23.805 -1.328 8.369 1.00 0.62 C ATOM 0 HA PRO A 21 -20.851 -0.007 8.388 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -22.461 -0.343 10.844 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -22.237 1.117 9.900 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -24.611 -0.234 10.026 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.148 0.766 8.663 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -24.140 -2.219 8.901 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -24.444 -1.222 7.492 1.00 0.62 H new ATOM 424 N SER A 22 -21.076 -2.893 9.766 1.00 0.50 N ATOM 425 CA SER A 22 -20.330 -3.942 10.434 1.00 0.61 C ATOM 426 C SER A 22 -19.550 -4.794 9.428 1.00 0.84 C ATOM 427 O SER A 22 -19.020 -5.853 9.771 1.00 1.64 O ATOM 428 CB SER A 22 -21.305 -4.796 11.236 1.00 0.68 C ATOM 429 OG SER A 22 -22.540 -4.918 10.545 1.00 1.32 O ATOM 0 H SER A 22 -21.960 -3.204 9.364 1.00 0.50 H new ATOM 0 HA SER A 22 -19.597 -3.495 11.106 1.00 0.61 H new ATOM 0 HB2 SER A 22 -20.877 -5.784 11.407 1.00 0.68 H new ATOM 0 HB3 SER A 22 -21.472 -4.347 12.215 1.00 0.68 H new ATOM 0 HG SER A 22 -23.156 -5.470 11.071 1.00 1.32 H new ATOM 435 N THR A 23 -19.481 -4.321 8.189 1.00 0.41 N ATOM 436 CA THR A 23 -18.717 -4.978 7.159 1.00 0.49 C ATOM 437 C THR A 23 -17.245 -4.724 7.375 1.00 0.63 C ATOM 438 O THR A 23 -16.762 -3.592 7.280 1.00 1.47 O ATOM 439 CB THR A 23 -19.114 -4.499 5.752 1.00 0.51 C ATOM 440 OG1 THR A 23 -20.454 -4.901 5.457 1.00 0.68 O ATOM 441 CG2 THR A 23 -18.182 -5.045 4.691 1.00 0.50 C ATOM 0 H THR A 23 -19.955 -3.472 7.880 1.00 0.41 H new ATOM 0 HA THR A 23 -18.930 -6.045 7.224 1.00 0.49 H new ATOM 0 HB THR A 23 -19.041 -3.411 5.743 1.00 0.51 H new ATOM 0 HG1 THR A 23 -20.438 -5.701 4.891 1.00 0.68 H new ATOM 0 HG21 THR A 23 -18.495 -4.684 3.711 1.00 0.50 H new ATOM 0 HG22 THR A 23 -17.165 -4.710 4.893 1.00 0.50 H new ATOM 0 HG23 THR A 23 -18.214 -6.134 4.704 1.00 0.50 H new ATOM 449 N MET A 24 -16.559 -5.776 7.725 1.00 0.54 N ATOM 450 CA MET A 24 -15.115 -5.752 7.817 1.00 0.48 C ATOM 451 C MET A 24 -14.515 -5.505 6.448 1.00 0.43 C ATOM 452 O MET A 24 -15.136 -5.799 5.429 1.00 0.47 O ATOM 453 CB MET A 24 -14.581 -7.078 8.340 1.00 0.60 C ATOM 454 CG MET A 24 -13.668 -6.940 9.538 1.00 0.57 C ATOM 455 SD MET A 24 -14.572 -6.508 11.037 1.00 0.83 S ATOM 456 CE MET A 24 -13.252 -6.502 12.242 1.00 0.71 C ATOM 0 H MET A 24 -16.979 -6.676 7.956 1.00 0.54 H new ATOM 0 HA MET A 24 -14.838 -4.953 8.505 1.00 0.48 H new ATOM 0 HB2 MET A 24 -15.422 -7.717 8.608 1.00 0.60 H new ATOM 0 HB3 MET A 24 -14.040 -7.582 7.539 1.00 0.60 H new ATOM 0 HG2 MET A 24 -13.134 -7.877 9.695 1.00 0.57 H new ATOM 0 HG3 MET A 24 -12.918 -6.176 9.335 1.00 0.57 H new ATOM 0 HE1 MET A 24 -13.382 -5.658 12.920 1.00 0.71 H new ATOM 0 HE2 MET A 24 -13.275 -7.431 12.811 1.00 0.71 H new ATOM 0 HE3 MET A 24 -12.293 -6.413 11.731 1.00 0.71 H new ATOM 466 N VAL A 25 -13.324 -4.937 6.430 1.00 0.40 N ATOM 467 CA VAL A 25 -12.543 -4.844 5.204 1.00 0.38 C ATOM 468 C VAL A 25 -12.515 -6.182 4.456 1.00 0.39 C ATOM 469 O VAL A 25 -12.612 -6.213 3.228 1.00 0.39 O ATOM 470 CB VAL A 25 -11.116 -4.350 5.507 1.00 0.41 C ATOM 471 CG1 VAL A 25 -10.128 -4.711 4.406 1.00 0.42 C ATOM 472 CG2 VAL A 25 -11.145 -2.851 5.709 1.00 0.40 C ATOM 0 H VAL A 25 -12.873 -4.532 7.250 1.00 0.40 H new ATOM 0 HA VAL A 25 -13.026 -4.116 4.553 1.00 0.38 H new ATOM 0 HB VAL A 25 -10.774 -4.849 6.413 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -9.138 -4.340 4.670 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -10.091 -5.794 4.292 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.447 -4.258 3.468 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -10.138 -2.493 5.924 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.516 -2.369 4.804 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -11.802 -2.609 6.544 1.00 0.40 H new ATOM 482 N TYR A 26 -12.427 -7.289 5.197 1.00 0.42 N ATOM 483 CA TYR A 26 -12.405 -8.597 4.555 1.00 0.45 C ATOM 484 C TYR A 26 -13.771 -8.941 3.948 1.00 0.43 C ATOM 485 O TYR A 26 -13.847 -9.660 2.948 1.00 0.42 O ATOM 486 CB TYR A 26 -11.889 -9.714 5.488 1.00 0.52 C ATOM 487 CG TYR A 26 -12.824 -10.179 6.589 1.00 0.56 C ATOM 488 CD1 TYR A 26 -13.925 -10.973 6.300 1.00 0.70 C ATOM 489 CD2 TYR A 26 -12.631 -9.788 7.911 1.00 0.58 C ATOM 490 CE1 TYR A 26 -14.804 -11.366 7.292 1.00 0.78 C ATOM 491 CE2 TYR A 26 -13.502 -10.183 8.909 1.00 0.65 C ATOM 492 CZ TYR A 26 -14.491 -11.093 8.624 1.00 0.72 C ATOM 493 OH TYR A 26 -15.463 -11.358 9.582 1.00 0.83 O ATOM 0 H TYR A 26 -12.371 -7.305 6.215 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.686 -8.534 3.738 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -11.633 -10.577 4.874 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -10.965 -9.368 5.952 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -14.098 -11.289 5.282 1.00 0.70 H new ATOM 0 HD2 TYR A 26 -11.785 -9.165 8.161 1.00 0.58 H new ATOM 0 HE1 TYR A 26 -15.721 -11.878 7.039 1.00 0.78 H new ATOM 0 HE2 TYR A 26 -13.406 -9.779 9.906 1.00 0.65 H new ATOM 0 HH TYR A 26 -15.119 -11.125 10.470 1.00 0.83 H new ATOM 503 N ASP A 27 -14.847 -8.397 4.521 1.00 0.43 N ATOM 504 CA ASP A 27 -16.178 -8.619 3.974 1.00 0.44 C ATOM 505 C ASP A 27 -16.371 -7.772 2.733 1.00 0.39 C ATOM 506 O ASP A 27 -16.866 -8.247 1.712 1.00 0.40 O ATOM 507 CB ASP A 27 -17.279 -8.280 4.984 1.00 0.50 C ATOM 508 CG ASP A 27 -17.406 -9.282 6.106 1.00 0.91 C ATOM 509 OD1 ASP A 27 -17.614 -10.479 5.822 1.00 1.24 O ATOM 510 OD2 ASP A 27 -17.326 -8.870 7.283 1.00 1.48 O ATOM 0 H ASP A 27 -14.820 -7.808 5.353 1.00 0.43 H new ATOM 0 HA ASP A 27 -16.255 -9.678 3.729 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -17.079 -7.296 5.409 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -18.232 -8.213 4.460 1.00 0.50 H new ATOM 515 N ALA A 28 -15.983 -6.509 2.834 1.00 0.37 N ATOM 516 CA ALA A 28 -16.094 -5.581 1.723 1.00 0.33 C ATOM 517 C ALA A 28 -15.413 -6.137 0.484 1.00 0.32 C ATOM 518 O ALA A 28 -16.012 -6.188 -0.590 1.00 0.31 O ATOM 519 CB ALA A 28 -15.500 -4.233 2.101 1.00 0.33 C ATOM 0 H ALA A 28 -15.586 -6.103 3.681 1.00 0.37 H new ATOM 0 HA ALA A 28 -17.151 -5.444 1.494 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -15.590 -3.547 1.259 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -16.036 -3.827 2.959 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.448 -4.358 2.357 1.00 0.33 H new ATOM 525 N CYS A 29 -14.173 -6.586 0.656 1.00 0.35 N ATOM 526 CA CYS A 29 -13.376 -7.106 -0.449 1.00 0.37 C ATOM 527 C CYS A 29 -14.070 -8.261 -1.173 1.00 0.38 C ATOM 528 O CYS A 29 -13.980 -8.364 -2.396 1.00 0.40 O ATOM 529 CB CYS A 29 -11.998 -7.554 0.044 1.00 0.45 C ATOM 530 SG CYS A 29 -10.909 -8.157 -1.271 1.00 1.37 S ATOM 0 H CYS A 29 -13.696 -6.600 1.558 1.00 0.35 H new ATOM 0 HA CYS A 29 -13.258 -6.292 -1.164 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -11.514 -6.718 0.548 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -12.127 -8.342 0.786 1.00 0.45 H new ATOM 0 HG CYS A 29 -9.767 -8.511 -0.760 1.00 1.37 H new ATOM 536 N ARG A 30 -14.777 -9.122 -0.444 1.00 0.40 N ATOM 537 CA ARG A 30 -15.385 -10.289 -1.079 1.00 0.44 C ATOM 538 C ARG A 30 -16.675 -9.933 -1.805 1.00 0.42 C ATOM 539 O ARG A 30 -16.969 -10.489 -2.862 1.00 0.45 O ATOM 540 CB ARG A 30 -15.625 -11.437 -0.093 1.00 0.49 C ATOM 541 CG ARG A 30 -16.422 -11.077 1.149 1.00 0.53 C ATOM 542 CD ARG A 30 -16.935 -12.332 1.829 1.00 0.71 C ATOM 543 NE ARG A 30 -17.584 -12.051 3.104 1.00 1.12 N ATOM 544 CZ ARG A 30 -18.644 -12.712 3.564 1.00 1.68 C ATOM 545 NH1 ARG A 30 -19.231 -13.645 2.820 1.00 1.94 N ATOM 546 NH2 ARG A 30 -19.116 -12.427 4.767 1.00 2.41 N ATOM 0 H ARG A 30 -14.940 -9.039 0.559 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.663 -10.637 -1.818 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -16.144 -12.240 -0.617 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -14.658 -11.833 0.219 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -15.796 -10.511 1.839 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -17.259 -10.434 0.878 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -17.641 -12.836 1.169 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -16.104 -13.019 1.991 1.00 0.71 H new ATOM 0 HE ARG A 30 -17.202 -11.301 3.680 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -18.869 -13.858 1.890 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -20.043 -14.147 3.179 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -18.668 -11.706 5.333 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -19.928 -12.928 5.128 1.00 2.41 H new ATOM 560 N MET A 31 -17.444 -9.008 -1.248 1.00 0.39 N ATOM 561 CA MET A 31 -18.710 -8.623 -1.852 1.00 0.40 C ATOM 562 C MET A 31 -18.506 -7.664 -3.016 1.00 0.38 C ATOM 563 O MET A 31 -19.245 -7.711 -3.995 1.00 0.44 O ATOM 564 CB MET A 31 -19.621 -7.989 -0.813 1.00 0.39 C ATOM 565 CG MET A 31 -19.823 -8.868 0.406 1.00 0.43 C ATOM 566 SD MET A 31 -20.744 -8.032 1.703 1.00 0.45 S ATOM 567 CE MET A 31 -19.624 -6.674 1.999 1.00 0.39 C ATOM 0 H MET A 31 -17.215 -8.514 -0.385 1.00 0.39 H new ATOM 0 HA MET A 31 -19.179 -9.528 -2.238 1.00 0.40 H new ATOM 0 HB2 MET A 31 -19.199 -7.034 -0.501 1.00 0.39 H new ATOM 0 HB3 MET A 31 -20.589 -7.776 -1.267 1.00 0.39 H new ATOM 0 HG2 MET A 31 -20.353 -9.775 0.114 1.00 0.43 H new ATOM 0 HG3 MET A 31 -18.852 -9.177 0.794 1.00 0.43 H new ATOM 0 HE1 MET A 31 -20.190 -5.798 2.315 1.00 0.39 H new ATOM 0 HE2 MET A 31 -18.916 -6.950 2.781 1.00 0.39 H new ATOM 0 HE3 MET A 31 -19.081 -6.444 1.082 1.00 0.39 H new ATOM 577 N ILE A 32 -17.508 -6.794 -2.919 1.00 0.34 N ATOM 578 CA ILE A 32 -17.237 -5.853 -3.997 1.00 0.33 C ATOM 579 C ILE A 32 -16.821 -6.606 -5.262 1.00 0.36 C ATOM 580 O ILE A 32 -17.319 -6.331 -6.348 1.00 0.40 O ATOM 581 CB ILE A 32 -16.162 -4.807 -3.608 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.996 -3.791 -4.737 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.826 -5.462 -3.285 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.904 -2.784 -4.485 1.00 0.48 C ATOM 0 H ILE A 32 -16.882 -6.721 -2.117 1.00 0.34 H new ATOM 0 HA ILE A 32 -18.159 -5.305 -4.191 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.501 -4.297 -2.706 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -15.782 -4.322 -5.664 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.939 -3.264 -4.882 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -14.100 -4.695 -3.017 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.951 -6.151 -2.449 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -14.469 -6.010 -4.157 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.843 -2.095 -5.327 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -15.126 -2.226 -3.575 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.952 -3.301 -4.370 1.00 0.48 H new ATOM 596 N ARG A 33 -15.934 -7.580 -5.095 1.00 0.36 N ATOM 597 CA ARG A 33 -15.501 -8.438 -6.193 1.00 0.41 C ATOM 598 C ARG A 33 -16.668 -9.242 -6.757 1.00 0.45 C ATOM 599 O ARG A 33 -16.673 -9.602 -7.934 1.00 0.49 O ATOM 600 CB ARG A 33 -14.392 -9.381 -5.724 1.00 0.45 C ATOM 601 CG ARG A 33 -13.073 -8.678 -5.447 1.00 1.01 C ATOM 602 CD ARG A 33 -11.989 -9.663 -5.037 1.00 0.94 C ATOM 603 NE ARG A 33 -12.206 -10.205 -3.695 1.00 0.64 N ATOM 604 CZ ARG A 33 -12.292 -11.508 -3.421 1.00 0.84 C ATOM 605 NH1 ARG A 33 -12.263 -12.401 -4.400 1.00 1.32 N ATOM 606 NH2 ARG A 33 -12.421 -11.921 -2.164 1.00 1.22 N ATOM 0 H ARG A 33 -15.496 -7.797 -4.200 1.00 0.36 H new ATOM 0 HA ARG A 33 -15.114 -7.799 -6.986 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -14.719 -9.891 -4.818 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -14.233 -10.148 -6.482 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -12.755 -8.136 -6.338 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -13.212 -7.940 -4.657 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -11.955 -10.482 -5.756 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -11.019 -9.167 -5.073 1.00 0.94 H new ATOM 0 HE ARG A 33 -12.297 -9.546 -2.922 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -12.175 -12.093 -5.368 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -12.329 -13.396 -4.185 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.455 -11.241 -1.405 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -12.486 -12.918 -1.959 1.00 1.22 H new ATOM 620 N GLU A 34 -17.654 -9.509 -5.907 1.00 0.46 N ATOM 621 CA GLU A 34 -18.783 -10.354 -6.274 1.00 0.51 C ATOM 622 C GLU A 34 -19.587 -9.733 -7.420 1.00 0.50 C ATOM 623 O GLU A 34 -19.686 -10.311 -8.500 1.00 0.54 O ATOM 624 CB GLU A 34 -19.687 -10.556 -5.052 1.00 0.55 C ATOM 625 CG GLU A 34 -20.841 -11.519 -5.271 1.00 0.90 C ATOM 626 CD GLU A 34 -20.391 -12.960 -5.354 1.00 1.51 C ATOM 627 OE1 GLU A 34 -19.857 -13.474 -4.348 1.00 1.50 O ATOM 628 OE2 GLU A 34 -20.590 -13.592 -6.411 1.00 2.40 O ATOM 0 H GLU A 34 -17.693 -9.149 -4.953 1.00 0.46 H new ATOM 0 HA GLU A 34 -18.400 -11.317 -6.613 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -19.080 -10.920 -4.223 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -20.090 -9.589 -4.751 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -21.557 -11.413 -4.456 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -21.362 -11.252 -6.190 1.00 0.90 H new ATOM 635 N ARG A 35 -20.151 -8.551 -7.187 1.00 0.51 N ATOM 636 CA ARG A 35 -20.946 -7.885 -8.217 1.00 0.55 C ATOM 637 C ARG A 35 -20.086 -7.064 -9.176 1.00 0.49 C ATOM 638 O ARG A 35 -20.449 -6.894 -10.339 1.00 0.54 O ATOM 639 CB ARG A 35 -22.064 -7.020 -7.616 1.00 0.72 C ATOM 640 CG ARG A 35 -21.613 -6.024 -6.561 1.00 0.77 C ATOM 641 CD ARG A 35 -21.747 -6.593 -5.160 1.00 0.79 C ATOM 642 NE ARG A 35 -23.073 -7.165 -4.912 1.00 1.02 N ATOM 643 CZ ARG A 35 -23.920 -6.715 -3.991 1.00 1.46 C ATOM 644 NH1 ARG A 35 -23.635 -5.615 -3.306 1.00 1.79 N ATOM 645 NH2 ARG A 35 -25.066 -7.352 -3.784 1.00 1.90 N ATOM 0 H ARG A 35 -20.075 -8.040 -6.308 1.00 0.51 H new ATOM 0 HA ARG A 35 -21.414 -8.682 -8.795 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -22.553 -6.474 -8.423 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -22.814 -7.677 -7.176 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -20.575 -5.745 -6.743 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -22.206 -5.113 -6.643 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -20.989 -7.362 -5.009 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -21.552 -5.806 -4.431 1.00 0.79 H new ATOM 0 HE ARG A 35 -23.365 -7.959 -5.482 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -22.765 -5.113 -3.486 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -24.286 -5.271 -2.600 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -25.294 -8.183 -4.330 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -25.719 -7.011 -3.079 1.00 1.90 H new ATOM 659 N ILE A 36 -18.960 -6.544 -8.695 1.00 0.45 N ATOM 660 CA ILE A 36 -18.098 -5.703 -9.523 1.00 0.43 C ATOM 661 C ILE A 36 -16.884 -6.492 -10.023 1.00 0.45 C ATOM 662 O ILE A 36 -15.892 -6.642 -9.308 1.00 0.44 O ATOM 663 CB ILE A 36 -17.611 -4.449 -8.754 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.788 -3.726 -8.093 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.880 -3.499 -9.691 1.00 0.44 C ATOM 666 CD1 ILE A 36 -18.382 -2.488 -7.316 1.00 0.44 C ATOM 0 H ILE A 36 -18.624 -6.688 -7.743 1.00 0.45 H new ATOM 0 HA ILE A 36 -18.696 -5.378 -10.374 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.922 -4.778 -7.976 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -19.507 -3.443 -8.861 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -19.296 -4.417 -7.420 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -16.545 -2.624 -9.134 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -16.017 -4.006 -10.123 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -17.553 -3.185 -10.489 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -19.267 -2.028 -6.876 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -17.686 -2.767 -6.525 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.901 -1.778 -7.989 1.00 0.44 H new ATOM 678 N PRO A 37 -16.945 -7.013 -11.259 1.00 0.53 N ATOM 679 CA PRO A 37 -15.867 -7.812 -11.845 1.00 0.60 C ATOM 680 C PRO A 37 -14.729 -6.950 -12.383 1.00 0.61 C ATOM 681 O PRO A 37 -13.733 -7.460 -12.889 1.00 0.71 O ATOM 682 CB PRO A 37 -16.551 -8.566 -12.996 1.00 0.73 C ATOM 683 CG PRO A 37 -17.999 -8.191 -12.937 1.00 0.76 C ATOM 684 CD PRO A 37 -18.067 -6.893 -12.188 1.00 0.60 C ATOM 0 HA PRO A 37 -15.407 -8.467 -11.104 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -16.116 -8.289 -13.956 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -16.423 -9.643 -12.887 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -18.414 -8.084 -13.939 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -18.580 -8.962 -12.432 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -17.957 -6.034 -12.851 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -19.017 -6.773 -11.666 1.00 0.60 H new ATOM 692 N GLU A 38 -14.887 -5.641 -12.282 1.00 0.57 N ATOM 693 CA GLU A 38 -13.851 -4.711 -12.713 1.00 0.61 C ATOM 694 C GLU A 38 -13.093 -4.178 -11.506 1.00 0.54 C ATOM 695 O GLU A 38 -12.284 -3.257 -11.616 1.00 0.62 O ATOM 696 CB GLU A 38 -14.466 -3.576 -13.531 1.00 0.75 C ATOM 697 CG GLU A 38 -15.543 -2.801 -12.801 1.00 0.99 C ATOM 698 CD GLU A 38 -16.394 -1.982 -13.739 1.00 1.67 C ATOM 699 OE1 GLU A 38 -15.938 -0.917 -14.192 1.00 2.46 O ATOM 700 OE2 GLU A 38 -17.531 -2.404 -14.030 1.00 2.04 O ATOM 0 H GLU A 38 -15.723 -5.195 -11.905 1.00 0.57 H new ATOM 0 HA GLU A 38 -13.141 -5.236 -13.352 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -13.675 -2.887 -13.828 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -14.889 -3.990 -14.447 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -16.178 -3.496 -12.251 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -15.079 -2.143 -12.066 1.00 0.99 H new ATOM 707 N ALA A 39 -13.356 -4.778 -10.351 1.00 0.47 N ATOM 708 CA ALA A 39 -12.649 -4.429 -9.130 1.00 0.47 C ATOM 709 C ALA A 39 -11.283 -5.095 -9.101 1.00 0.49 C ATOM 710 O ALA A 39 -10.275 -4.462 -8.790 1.00 0.55 O ATOM 711 CB ALA A 39 -13.465 -4.835 -7.909 1.00 0.47 C ATOM 0 H ALA A 39 -14.057 -5.511 -10.237 1.00 0.47 H new ATOM 0 HA ALA A 39 -12.508 -3.348 -9.108 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.922 -4.567 -7.003 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -14.424 -4.317 -7.924 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -13.634 -5.912 -7.926 1.00 0.47 H new ATOM 717 N LEU A 40 -11.248 -6.370 -9.458 1.00 0.50 N ATOM 718 CA LEU A 40 -10.013 -7.135 -9.416 1.00 0.59 C ATOM 719 C LEU A 40 -9.202 -6.964 -10.703 1.00 0.67 C ATOM 720 O LEU A 40 -9.098 -7.875 -11.522 1.00 0.99 O ATOM 721 CB LEU A 40 -10.259 -8.634 -9.092 1.00 0.65 C ATOM 722 CG LEU A 40 -11.528 -9.307 -9.666 1.00 0.62 C ATOM 723 CD1 LEU A 40 -12.782 -8.859 -8.931 1.00 1.29 C ATOM 724 CD2 LEU A 40 -11.672 -9.038 -11.151 1.00 1.19 C ATOM 0 H LEU A 40 -12.061 -6.896 -9.780 1.00 0.50 H new ATOM 0 HA LEU A 40 -9.420 -6.730 -8.596 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -9.395 -9.197 -9.445 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -10.287 -8.740 -8.008 1.00 0.65 H new ATOM 0 HG LEU A 40 -11.411 -10.380 -9.518 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -13.653 -9.353 -9.362 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -12.700 -9.124 -7.877 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -12.893 -7.779 -9.026 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -12.573 -9.525 -11.523 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -11.743 -7.964 -11.321 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -10.803 -9.432 -11.678 1.00 1.19 H new ATOM 736 N ALA A 41 -8.620 -5.785 -10.872 1.00 0.65 N ATOM 737 CA ALA A 41 -7.781 -5.494 -12.031 1.00 0.74 C ATOM 738 C ALA A 41 -6.402 -6.144 -11.880 1.00 0.81 C ATOM 739 O ALA A 41 -5.379 -5.585 -12.284 1.00 1.15 O ATOM 740 CB ALA A 41 -7.658 -3.989 -12.215 1.00 0.92 C ATOM 0 H ALA A 41 -8.713 -5.008 -10.217 1.00 0.65 H new ATOM 0 HA ALA A 41 -8.249 -5.916 -12.920 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -7.031 -3.778 -13.081 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -8.648 -3.559 -12.370 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -7.207 -3.549 -11.325 1.00 0.92 H new ATOM 746 N GLY A 42 -6.407 -7.343 -11.321 1.00 0.75 N ATOM 747 CA GLY A 42 -5.199 -8.078 -11.036 1.00 0.86 C ATOM 748 C GLY A 42 -5.507 -9.208 -10.079 1.00 0.80 C ATOM 749 O GLY A 42 -6.624 -9.726 -10.093 1.00 0.82 O ATOM 0 H GLY A 42 -7.261 -7.833 -11.052 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -4.776 -8.475 -11.959 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -4.451 -7.414 -10.602 1.00 0.86 H new ATOM 753 N PRO A 43 -4.558 -9.610 -9.230 1.00 0.83 N ATOM 754 CA PRO A 43 -4.809 -10.612 -8.201 1.00 0.82 C ATOM 755 C PRO A 43 -5.623 -10.024 -7.052 1.00 0.72 C ATOM 756 O PRO A 43 -5.191 -9.066 -6.411 1.00 0.66 O ATOM 757 CB PRO A 43 -3.410 -11.016 -7.720 1.00 0.94 C ATOM 758 CG PRO A 43 -2.436 -10.286 -8.593 1.00 1.09 C ATOM 759 CD PRO A 43 -3.178 -9.128 -9.194 1.00 0.98 C ATOM 0 HA PRO A 43 -5.385 -11.457 -8.578 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -3.268 -10.750 -6.673 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -3.269 -12.094 -7.797 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -1.581 -9.939 -8.013 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -2.047 -10.942 -9.372 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -3.080 -8.227 -8.588 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -2.809 -8.884 -10.190 1.00 0.98 H new ATOM 767 N PRO A 44 -6.814 -10.584 -6.785 1.00 0.76 N ATOM 768 CA PRO A 44 -7.722 -10.081 -5.743 1.00 0.73 C ATOM 769 C PRO A 44 -7.075 -10.016 -4.360 1.00 0.69 C ATOM 770 O PRO A 44 -7.451 -9.196 -3.528 1.00 0.74 O ATOM 771 CB PRO A 44 -8.877 -11.093 -5.740 1.00 0.93 C ATOM 772 CG PRO A 44 -8.369 -12.280 -6.487 1.00 0.99 C ATOM 773 CD PRO A 44 -7.382 -11.749 -7.482 1.00 0.89 C ATOM 0 HA PRO A 44 -8.030 -9.057 -5.955 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -9.161 -11.362 -4.722 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.764 -10.678 -6.219 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -7.897 -12.994 -5.812 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -9.183 -12.805 -6.987 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.618 -12.486 -7.727 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -7.863 -11.466 -8.418 1.00 0.89 H new ATOM 781 N ASN A 45 -6.091 -10.873 -4.126 1.00 0.72 N ATOM 782 CA ASN A 45 -5.415 -10.923 -2.832 1.00 0.77 C ATOM 783 C ASN A 45 -4.371 -9.820 -2.722 1.00 0.71 C ATOM 784 O ASN A 45 -3.839 -9.556 -1.646 1.00 0.85 O ATOM 785 CB ASN A 45 -4.762 -12.289 -2.615 1.00 0.87 C ATOM 786 CG ASN A 45 -5.782 -13.407 -2.544 1.00 1.41 C ATOM 787 OD1 ASN A 45 -6.271 -13.751 -1.468 1.00 2.21 O ATOM 788 ND2 ASN A 45 -6.106 -13.980 -3.691 1.00 1.37 N ATOM 0 H ASN A 45 -5.742 -11.543 -4.812 1.00 0.72 H new ATOM 0 HA ASN A 45 -6.165 -10.768 -2.057 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -4.063 -12.489 -3.427 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -4.182 -12.270 -1.692 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -6.787 -14.740 -3.707 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -5.675 -13.662 -4.559 1.00 1.37 H new ATOM 795 N ASP A 46 -4.091 -9.174 -3.844 1.00 0.61 N ATOM 796 CA ASP A 46 -3.125 -8.085 -3.888 1.00 0.68 C ATOM 797 C ASP A 46 -3.846 -6.743 -3.895 1.00 0.57 C ATOM 798 O ASP A 46 -3.223 -5.692 -4.027 1.00 0.61 O ATOM 799 CB ASP A 46 -2.234 -8.202 -5.133 1.00 0.83 C ATOM 800 CG ASP A 46 -1.254 -9.362 -5.067 1.00 1.22 C ATOM 801 OD1 ASP A 46 -1.706 -10.526 -5.022 1.00 1.38 O ATOM 802 OD2 ASP A 46 -0.028 -9.121 -5.049 1.00 1.90 O ATOM 0 H ASP A 46 -4.523 -9.387 -4.743 1.00 0.61 H new ATOM 0 HA ASP A 46 -2.496 -8.149 -3.000 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -2.866 -8.320 -6.013 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -1.678 -7.273 -5.261 1.00 0.83 H new ATOM 807 N PHE A 47 -5.165 -6.791 -3.756 1.00 0.53 N ATOM 808 CA PHE A 47 -5.993 -5.588 -3.756 1.00 0.47 C ATOM 809 C PHE A 47 -6.607 -5.362 -2.381 1.00 0.44 C ATOM 810 O PHE A 47 -7.059 -6.305 -1.730 1.00 0.48 O ATOM 811 CB PHE A 47 -7.099 -5.696 -4.813 1.00 0.49 C ATOM 812 CG PHE A 47 -6.653 -5.350 -6.208 1.00 0.51 C ATOM 813 CD1 PHE A 47 -5.635 -6.056 -6.827 1.00 0.79 C ATOM 814 CD2 PHE A 47 -7.251 -4.307 -6.898 1.00 0.78 C ATOM 815 CE1 PHE A 47 -5.223 -5.730 -8.103 1.00 0.85 C ATOM 816 CE2 PHE A 47 -6.842 -3.975 -8.174 1.00 0.80 C ATOM 817 CZ PHE A 47 -5.827 -4.688 -8.777 1.00 0.63 C ATOM 0 H PHE A 47 -5.690 -7.658 -3.641 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.357 -4.737 -4.000 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.491 -6.713 -4.810 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -7.921 -5.037 -4.532 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -5.158 -6.872 -6.305 1.00 0.79 H new ATOM 0 HD2 PHE A 47 -8.048 -3.747 -6.431 1.00 0.78 H new ATOM 0 HE1 PHE A 47 -4.428 -6.290 -8.574 1.00 0.85 H new ATOM 0 HE2 PHE A 47 -7.316 -3.159 -8.699 1.00 0.80 H new ATOM 0 HZ PHE A 47 -5.505 -4.431 -9.775 1.00 0.63 H new ATOM 827 N GLY A 48 -6.596 -4.118 -1.930 1.00 0.42 N ATOM 828 CA GLY A 48 -7.169 -3.797 -0.639 1.00 0.41 C ATOM 829 C GLY A 48 -7.938 -2.492 -0.643 1.00 0.35 C ATOM 830 O GLY A 48 -8.124 -1.869 -1.693 1.00 0.34 O ATOM 0 H GLY A 48 -6.201 -3.324 -2.434 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -7.834 -4.604 -0.332 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.372 -3.741 0.103 1.00 0.41 H new ATOM 834 N LEU A 49 -8.365 -2.069 0.537 1.00 0.31 N ATOM 835 CA LEU A 49 -9.232 -0.909 0.666 1.00 0.28 C ATOM 836 C LEU A 49 -8.467 0.316 1.158 1.00 0.29 C ATOM 837 O LEU A 49 -8.023 0.374 2.304 1.00 0.31 O ATOM 838 CB LEU A 49 -10.390 -1.218 1.616 1.00 0.26 C ATOM 839 CG LEU A 49 -11.229 -2.443 1.245 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.362 -2.628 2.238 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.777 -2.315 -0.167 1.00 0.25 C ATOM 0 H LEU A 49 -8.124 -2.514 1.422 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.626 -0.681 -0.324 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -9.987 -1.364 2.618 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -11.046 -0.348 1.659 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.585 -3.322 1.282 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -12.950 -3.503 1.961 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -11.950 -2.769 3.237 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -13.001 -1.745 2.230 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.370 -3.197 -0.409 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.405 -1.426 -0.235 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -10.950 -2.230 -0.872 1.00 0.25 H new ATOM 853 N PHE A 50 -8.292 1.268 0.266 1.00 0.29 N ATOM 854 CA PHE A 50 -7.689 2.545 0.611 1.00 0.30 C ATOM 855 C PHE A 50 -8.773 3.602 0.779 1.00 0.30 C ATOM 856 O PHE A 50 -9.660 3.728 -0.056 1.00 0.31 O ATOM 857 CB PHE A 50 -6.693 2.972 -0.471 1.00 0.34 C ATOM 858 CG PHE A 50 -5.935 4.229 -0.141 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.793 4.179 0.642 1.00 0.37 C ATOM 860 CD2 PHE A 50 -6.361 5.459 -0.619 1.00 0.36 C ATOM 861 CE1 PHE A 50 -4.093 5.329 0.945 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.664 6.613 -0.319 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.527 6.548 0.464 1.00 0.37 C ATOM 0 H PHE A 50 -8.561 1.183 -0.714 1.00 0.29 H new ATOM 0 HA PHE A 50 -7.151 2.438 1.553 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.981 2.163 -0.635 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -7.230 3.119 -1.408 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.446 3.228 1.020 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -7.248 5.515 -1.233 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -3.206 5.275 1.558 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -6.007 7.565 -0.696 1.00 0.38 H new ATOM 0 HZ PHE A 50 -3.979 7.449 0.699 1.00 0.37 H new ATOM 873 N LEU A 51 -8.708 4.351 1.861 1.00 0.30 N ATOM 874 CA LEU A 51 -9.681 5.398 2.099 1.00 0.32 C ATOM 875 C LEU A 51 -9.137 6.714 1.561 1.00 0.36 C ATOM 876 O LEU A 51 -8.144 7.243 2.068 1.00 0.38 O ATOM 877 CB LEU A 51 -10.000 5.501 3.597 1.00 0.33 C ATOM 878 CG LEU A 51 -11.347 6.150 3.954 1.00 0.35 C ATOM 879 CD1 LEU A 51 -11.341 7.644 3.674 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.477 5.473 3.192 1.00 0.41 C ATOM 0 H LEU A 51 -7.996 4.256 2.586 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.610 5.161 1.580 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -9.978 4.498 4.023 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -9.205 6.070 4.080 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.508 6.015 5.024 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -12.310 8.068 3.939 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -10.561 8.122 4.267 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -11.147 7.815 2.615 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -13.425 5.942 3.454 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -12.306 5.575 2.120 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.511 4.416 3.455 1.00 0.41 H new ATOM 892 N SER A 52 -9.781 7.221 0.522 1.00 0.42 N ATOM 893 CA SER A 52 -9.323 8.422 -0.151 1.00 0.53 C ATOM 894 C SER A 52 -9.826 9.674 0.554 1.00 0.61 C ATOM 895 O SER A 52 -11.012 10.009 0.486 1.00 0.93 O ATOM 896 CB SER A 52 -9.789 8.419 -1.607 1.00 0.67 C ATOM 897 OG SER A 52 -9.338 7.258 -2.284 1.00 1.28 O ATOM 0 H SER A 52 -10.628 6.815 0.125 1.00 0.42 H new ATOM 0 HA SER A 52 -8.233 8.430 -0.122 1.00 0.53 H new ATOM 0 HB2 SER A 52 -10.877 8.466 -1.644 1.00 0.67 H new ATOM 0 HB3 SER A 52 -9.414 9.308 -2.114 1.00 0.67 H new ATOM 0 HG SER A 52 -8.832 7.520 -3.081 1.00 1.28 H new ATOM 903 N ASP A 53 -8.921 10.349 1.243 1.00 0.74 N ATOM 904 CA ASP A 53 -9.239 11.622 1.871 1.00 0.90 C ATOM 905 C ASP A 53 -9.056 12.745 0.865 1.00 1.04 C ATOM 906 O ASP A 53 -10.029 13.327 0.383 1.00 1.28 O ATOM 907 CB ASP A 53 -8.345 11.862 3.093 1.00 0.89 C ATOM 908 CG ASP A 53 -8.540 13.242 3.694 1.00 1.18 C ATOM 909 OD1 ASP A 53 -9.425 13.396 4.563 1.00 1.42 O ATOM 910 OD2 ASP A 53 -7.804 14.175 3.304 1.00 1.24 O ATOM 0 H ASP A 53 -7.960 10.037 1.382 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.276 11.599 2.205 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.558 11.107 3.849 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.301 11.739 2.805 1.00 0.89 H new ATOM 915 N ASP A 54 -7.798 13.005 0.530 1.00 0.93 N ATOM 916 CA ASP A 54 -7.417 14.060 -0.405 1.00 1.10 C ATOM 917 C ASP A 54 -5.905 14.172 -0.430 1.00 1.02 C ATOM 918 O ASP A 54 -5.277 14.140 -1.486 1.00 1.22 O ATOM 919 CB ASP A 54 -8.026 15.411 -0.007 1.00 1.26 C ATOM 920 CG ASP A 54 -7.530 16.555 -0.871 1.00 1.47 C ATOM 921 OD1 ASP A 54 -7.848 16.571 -2.081 1.00 1.73 O ATOM 922 OD2 ASP A 54 -6.814 17.436 -0.351 1.00 1.45 O ATOM 0 H ASP A 54 -7.004 12.484 0.903 1.00 0.93 H new ATOM 0 HA ASP A 54 -7.797 13.801 -1.393 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -9.112 15.351 -0.080 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -7.787 15.619 1.036 1.00 1.26 H new ATOM 927 N ASP A 55 -5.329 14.280 0.754 1.00 0.87 N ATOM 928 CA ASP A 55 -3.885 14.335 0.906 1.00 0.94 C ATOM 929 C ASP A 55 -3.344 12.930 1.168 1.00 0.87 C ATOM 930 O ASP A 55 -3.957 12.156 1.907 1.00 0.71 O ATOM 931 CB ASP A 55 -3.522 15.284 2.052 1.00 0.99 C ATOM 932 CG ASP A 55 -2.034 15.352 2.320 1.00 1.39 C ATOM 933 OD1 ASP A 55 -1.530 14.492 3.062 1.00 1.79 O ATOM 934 OD2 ASP A 55 -1.368 16.280 1.813 1.00 1.58 O ATOM 0 H ASP A 55 -5.845 14.332 1.633 1.00 0.87 H new ATOM 0 HA ASP A 55 -3.432 14.714 -0.010 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -3.889 16.283 1.818 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -4.034 14.961 2.959 1.00 0.99 H new ATOM 939 N PRO A 56 -2.206 12.574 0.546 1.00 1.06 N ATOM 940 CA PRO A 56 -1.587 11.245 0.681 1.00 1.08 C ATOM 941 C PRO A 56 -1.316 10.841 2.132 1.00 0.98 C ATOM 942 O PRO A 56 -1.366 9.662 2.472 1.00 0.97 O ATOM 943 CB PRO A 56 -0.262 11.378 -0.088 1.00 1.35 C ATOM 944 CG PRO A 56 -0.062 12.845 -0.281 1.00 1.48 C ATOM 945 CD PRO A 56 -1.435 13.434 -0.363 1.00 1.33 C ATOM 0 HA PRO A 56 -2.249 10.468 0.299 1.00 1.08 H new ATOM 0 HB2 PRO A 56 0.563 10.939 0.473 1.00 1.35 H new ATOM 0 HB3 PRO A 56 -0.309 10.858 -1.045 1.00 1.35 H new ATOM 0 HG2 PRO A 56 0.500 13.276 0.548 1.00 1.48 H new ATOM 0 HG3 PRO A 56 0.505 13.047 -1.190 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -1.449 14.476 -0.044 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -1.828 13.406 -1.379 1.00 1.33 H new ATOM 953 N LYS A 57 -1.043 11.818 2.986 1.00 0.99 N ATOM 954 CA LYS A 57 -0.730 11.546 4.384 1.00 1.02 C ATOM 955 C LYS A 57 -2.009 11.280 5.168 1.00 0.82 C ATOM 956 O LYS A 57 -2.041 10.439 6.064 1.00 0.87 O ATOM 957 CB LYS A 57 0.008 12.733 5.005 1.00 1.25 C ATOM 958 CG LYS A 57 1.208 13.209 4.203 1.00 1.51 C ATOM 959 CD LYS A 57 2.433 12.343 4.438 1.00 1.62 C ATOM 960 CE LYS A 57 2.895 12.416 5.886 1.00 2.08 C ATOM 961 NZ LYS A 57 3.123 13.817 6.335 1.00 2.93 N ATOM 0 H LYS A 57 -1.032 12.807 2.736 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.090 10.664 4.427 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -0.691 13.562 5.119 1.00 1.25 H new ATOM 0 HB3 LYS A 57 0.340 12.457 6.006 1.00 1.25 H new ATOM 0 HG2 LYS A 57 0.959 13.204 3.142 1.00 1.51 H new ATOM 0 HG3 LYS A 57 1.437 14.240 4.472 1.00 1.51 H new ATOM 0 HD2 LYS A 57 2.205 11.309 4.179 1.00 1.62 H new ATOM 0 HD3 LYS A 57 3.240 12.666 3.780 1.00 1.62 H new ATOM 0 HE2 LYS A 57 2.148 11.948 6.528 1.00 2.08 H new ATOM 0 HE3 LYS A 57 3.817 11.845 6.000 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 3.625 13.812 7.246 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 3.695 14.320 5.627 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 2.208 14.299 6.446 1.00 2.93 H new ATOM 975 N LYS A 58 -3.060 12.011 4.816 1.00 0.69 N ATOM 976 CA LYS A 58 -4.348 11.893 5.491 1.00 0.65 C ATOM 977 C LYS A 58 -5.076 10.638 5.046 1.00 0.56 C ATOM 978 O LYS A 58 -5.915 10.101 5.772 1.00 0.63 O ATOM 979 CB LYS A 58 -5.207 13.113 5.194 1.00 0.73 C ATOM 980 CG LYS A 58 -4.596 14.408 5.680 1.00 0.94 C ATOM 981 CD LYS A 58 -5.357 15.606 5.155 1.00 1.24 C ATOM 982 CE LYS A 58 -4.758 16.898 5.666 1.00 1.55 C ATOM 983 NZ LYS A 58 -4.912 17.034 7.136 1.00 2.16 N ATOM 0 H LYS A 58 -3.045 12.697 4.061 1.00 0.69 H new ATOM 0 HA LYS A 58 -4.166 11.830 6.564 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.373 13.179 4.119 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -6.184 12.983 5.660 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -4.594 14.425 6.770 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -3.556 14.465 5.358 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -5.343 15.601 4.065 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -6.401 15.540 5.460 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -3.700 16.936 5.406 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -5.238 17.742 5.171 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -4.695 18.011 7.419 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -5.890 16.805 7.405 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -4.259 16.381 7.615 1.00 2.16 H new ATOM 997 N GLY A 59 -4.772 10.204 3.832 1.00 0.54 N ATOM 998 CA GLY A 59 -5.307 8.954 3.334 1.00 0.59 C ATOM 999 C GLY A 59 -4.877 7.790 4.200 1.00 0.54 C ATOM 1000 O GLY A 59 -3.799 7.823 4.799 1.00 0.58 O ATOM 0 H GLY A 59 -4.162 10.698 3.180 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.395 9.007 3.306 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -4.969 8.793 2.310 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.701 6.758 4.276 1.00 0.49 N ATOM 1005 CA ILE A 60 -5.419 5.638 5.160 1.00 0.47 C ATOM 1006 C ILE A 60 -5.716 4.309 4.488 1.00 0.42 C ATOM 1007 O ILE A 60 -6.588 4.217 3.622 1.00 0.41 O ATOM 1008 CB ILE A 60 -6.227 5.720 6.479 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -7.721 5.883 6.182 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -5.721 6.858 7.353 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -8.596 5.862 7.417 1.00 0.65 C ATOM 0 H ILE A 60 -6.565 6.672 3.741 1.00 0.49 H new ATOM 0 HA ILE A 60 -4.356 5.699 5.392 1.00 0.47 H new ATOM 0 HB ILE A 60 -6.086 4.788 7.027 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -7.876 6.824 5.654 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -8.037 5.085 5.510 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -6.303 6.896 8.274 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -4.671 6.692 7.594 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -5.826 7.802 6.818 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -9.639 5.983 7.126 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -8.472 4.911 7.935 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -8.308 6.677 8.081 1.00 0.65 H new ATOM 1023 N TRP A 61 -4.979 3.286 4.890 1.00 0.42 N ATOM 1024 CA TRP A 61 -5.257 1.932 4.452 1.00 0.40 C ATOM 1025 C TRP A 61 -6.205 1.272 5.430 1.00 0.40 C ATOM 1026 O TRP A 61 -6.028 1.368 6.645 1.00 0.48 O ATOM 1027 CB TRP A 61 -3.977 1.100 4.333 1.00 0.44 C ATOM 1028 CG TRP A 61 -3.246 1.308 3.046 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -2.118 2.039 2.854 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.598 0.771 1.767 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.742 1.993 1.535 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.635 1.222 0.846 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.632 -0.044 1.313 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.678 0.882 -0.502 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.676 -0.382 -0.026 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.704 0.082 -0.918 1.00 0.48 C ATOM 0 H TRP A 61 -4.182 3.370 5.521 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.713 1.984 3.463 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -3.314 1.348 5.162 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -4.229 0.044 4.431 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.592 2.579 3.628 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -0.928 2.459 1.134 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -5.387 -0.406 1.996 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.928 1.237 -1.194 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -5.473 -1.014 -0.389 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.766 -0.198 -1.959 1.00 0.48 H new ATOM 1047 N LEU A 62 -7.216 0.625 4.901 1.00 0.36 N ATOM 1048 CA LEU A 62 -8.193 -0.042 5.726 1.00 0.37 C ATOM 1049 C LEU A 62 -7.799 -1.498 5.908 1.00 0.42 C ATOM 1050 O LEU A 62 -7.882 -2.294 4.972 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.572 0.063 5.083 1.00 0.33 C ATOM 1052 CG LEU A 62 -10.015 1.486 4.742 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.333 1.474 3.996 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -10.134 2.322 6.001 1.00 0.35 C ATOM 0 H LEU A 62 -7.383 0.547 3.898 1.00 0.36 H new ATOM 0 HA LEU A 62 -8.229 0.436 6.705 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.578 -0.533 4.170 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -10.306 -0.379 5.757 1.00 0.33 H new ATOM 0 HG LEU A 62 -9.257 1.931 4.097 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.629 2.497 3.764 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -11.222 0.909 3.070 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -12.098 1.007 4.616 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.450 3.332 5.739 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.870 1.873 6.668 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -9.167 2.363 6.503 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.353 -1.839 7.104 1.00 0.48 N ATOM 1067 CA GLU A 63 -6.923 -3.195 7.401 1.00 0.55 C ATOM 1068 C GLU A 63 -8.117 -4.113 7.596 1.00 0.52 C ATOM 1069 O GLU A 63 -9.222 -3.657 7.892 1.00 0.48 O ATOM 1070 CB GLU A 63 -6.081 -3.216 8.666 1.00 0.65 C ATOM 1071 CG GLU A 63 -6.808 -2.637 9.863 1.00 0.68 C ATOM 1072 CD GLU A 63 -6.464 -1.179 10.108 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -5.389 -0.906 10.686 1.00 1.42 O ATOM 1074 OE2 GLU A 63 -7.279 -0.301 9.751 1.00 1.30 O ATOM 0 H GLU A 63 -7.279 -1.192 7.889 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.332 -3.547 6.555 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -5.789 -4.243 8.886 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -5.163 -2.653 8.496 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -7.883 -2.732 9.711 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -6.559 -3.219 10.750 1.00 0.68 H new ATOM 1081 N ALA A 64 -7.892 -5.406 7.464 1.00 0.58 N ATOM 1082 CA ALA A 64 -8.966 -6.374 7.602 1.00 0.58 C ATOM 1083 C ALA A 64 -9.285 -6.651 9.065 1.00 0.60 C ATOM 1084 O ALA A 64 -10.239 -7.363 9.373 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.621 -7.660 6.870 1.00 0.64 C ATOM 0 H ALA A 64 -6.978 -5.811 7.262 1.00 0.58 H new ATOM 0 HA ALA A 64 -9.860 -5.947 7.148 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.437 -8.374 6.984 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.471 -7.447 5.812 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -7.708 -8.083 7.288 1.00 0.64 H new ATOM 1091 N GLY A 65 -8.505 -6.058 9.957 1.00 0.64 N ATOM 1092 CA GLY A 65 -8.720 -6.257 11.376 1.00 0.70 C ATOM 1093 C GLY A 65 -9.786 -5.344 11.945 1.00 0.70 C ATOM 1094 O GLY A 65 -10.091 -5.410 13.135 1.00 0.84 O ATOM 0 H GLY A 65 -7.726 -5.442 9.723 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -9.005 -7.294 11.553 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -7.783 -6.089 11.907 1.00 0.70 H new ATOM 1098 N LYS A 66 -10.365 -4.492 11.105 1.00 0.60 N ATOM 1099 CA LYS A 66 -11.424 -3.609 11.557 1.00 0.61 C ATOM 1100 C LYS A 66 -12.529 -3.497 10.508 1.00 0.54 C ATOM 1101 O LYS A 66 -12.315 -3.774 9.318 1.00 0.47 O ATOM 1102 CB LYS A 66 -10.867 -2.219 11.906 1.00 0.66 C ATOM 1103 CG LYS A 66 -11.077 -1.162 10.830 1.00 0.60 C ATOM 1104 CD LYS A 66 -10.208 -1.393 9.608 1.00 0.56 C ATOM 1105 CE LYS A 66 -10.648 -0.520 8.443 1.00 0.61 C ATOM 1106 NZ LYS A 66 -12.013 -0.865 7.981 1.00 1.29 N ATOM 0 H LYS A 66 -10.120 -4.397 10.119 1.00 0.60 H new ATOM 0 HA LYS A 66 -11.856 -4.041 12.460 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -11.334 -1.876 12.829 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -9.799 -2.310 12.104 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -12.125 -1.157 10.530 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -10.860 -0.178 11.245 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -9.168 -1.178 9.853 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -10.257 -2.442 9.317 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -10.620 0.528 8.743 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -9.945 -0.634 7.618 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -12.134 -0.558 6.995 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -12.151 -1.894 8.042 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -12.714 -0.386 8.581 1.00 1.29 H new ATOM 1120 N ALA A 67 -13.701 -3.075 10.950 1.00 0.57 N ATOM 1121 CA ALA A 67 -14.830 -2.879 10.063 1.00 0.52 C ATOM 1122 C ALA A 67 -14.767 -1.489 9.443 1.00 0.47 C ATOM 1123 O ALA A 67 -13.935 -0.670 9.827 1.00 0.47 O ATOM 1124 CB ALA A 67 -16.129 -3.092 10.819 1.00 0.59 C ATOM 0 H ALA A 67 -13.894 -2.860 11.928 1.00 0.57 H new ATOM 0 HA ALA A 67 -14.790 -3.610 9.256 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -16.972 -2.942 10.144 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -16.157 -4.107 11.215 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -16.192 -2.380 11.642 1.00 0.59 H new ATOM 1130 N LEU A 68 -15.613 -1.228 8.468 1.00 0.45 N ATOM 1131 CA LEU A 68 -15.570 0.040 7.752 1.00 0.40 C ATOM 1132 C LEU A 68 -16.029 1.200 8.633 1.00 0.43 C ATOM 1133 O LEU A 68 -15.300 2.173 8.823 1.00 0.44 O ATOM 1134 CB LEU A 68 -16.432 -0.038 6.502 1.00 0.37 C ATOM 1135 CG LEU A 68 -16.015 -1.108 5.493 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -16.983 -1.149 4.323 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -14.597 -0.852 5.008 1.00 0.37 C ATOM 0 H LEU A 68 -16.338 -1.871 8.150 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.534 0.227 7.468 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.463 -0.225 6.802 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -16.415 0.933 6.007 1.00 0.37 H new ATOM 0 HG LEU A 68 -16.041 -2.079 5.988 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -16.668 -1.917 3.617 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -17.984 -1.380 4.687 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -16.992 -0.180 3.824 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.313 -1.622 4.290 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.547 0.126 4.530 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -13.912 -0.877 5.856 1.00 0.37 H new ATOM 1149 N ASP A 69 -17.219 1.057 9.203 1.00 0.47 N ATOM 1150 CA ASP A 69 -17.858 2.116 9.996 1.00 0.52 C ATOM 1151 C ASP A 69 -17.096 2.362 11.295 1.00 0.58 C ATOM 1152 O ASP A 69 -17.343 3.336 12.007 1.00 0.65 O ATOM 1153 CB ASP A 69 -19.318 1.731 10.284 1.00 0.58 C ATOM 1154 CG ASP A 69 -20.016 2.631 11.289 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -20.603 3.653 10.882 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -20.002 2.305 12.495 1.00 1.16 O ATOM 0 H ASP A 69 -17.774 0.204 9.132 1.00 0.47 H new ATOM 0 HA ASP A 69 -17.840 3.044 9.424 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -19.877 1.749 9.349 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.345 0.705 10.652 1.00 0.58 H new ATOM 1161 N TYR A 70 -16.173 1.461 11.595 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.255 1.629 12.701 1.00 0.65 C ATOM 1163 C TYR A 70 -14.539 2.975 12.584 1.00 0.62 C ATOM 1164 O TYR A 70 -14.414 3.718 13.560 1.00 0.67 O ATOM 1165 CB TYR A 70 -14.253 0.476 12.683 1.00 0.69 C ATOM 1166 CG TYR A 70 -13.227 0.538 13.775 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -13.571 0.260 15.084 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -11.916 0.872 13.490 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -12.630 0.312 16.090 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -10.965 0.926 14.486 1.00 1.05 C ATOM 1171 CZ TYR A 70 -11.325 0.645 15.786 1.00 1.22 C ATOM 1172 OH TYR A 70 -10.379 0.690 16.785 1.00 1.45 O ATOM 0 H TYR A 70 -16.043 0.593 11.075 1.00 0.59 H new ATOM 0 HA TYR A 70 -15.798 1.619 13.646 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -14.797 -0.465 12.764 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -13.743 0.468 11.720 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -14.591 -0.002 15.322 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -11.633 1.094 12.472 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -12.912 0.094 17.109 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -9.944 1.187 14.249 1.00 1.05 H new ATOM 0 HH TYR A 70 -9.512 0.939 16.403 1.00 1.45 H new ATOM 1182 N TYR A 71 -14.066 3.275 11.378 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.488 4.580 11.077 1.00 0.58 C ATOM 1184 C TYR A 71 -14.595 5.604 10.801 1.00 0.60 C ATOM 1185 O TYR A 71 -15.742 5.408 11.192 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.529 4.479 9.887 1.00 0.56 C ATOM 1187 CG TYR A 71 -11.196 3.849 10.232 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -11.036 2.468 10.232 1.00 0.62 C ATOM 1189 CD2 TYR A 71 -10.099 4.630 10.557 1.00 0.58 C ATOM 1190 CE1 TYR A 71 -9.820 1.887 10.547 1.00 0.66 C ATOM 1191 CE2 TYR A 71 -8.882 4.056 10.870 1.00 0.63 C ATOM 1192 CZ TYR A 71 -8.745 2.691 10.867 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.529 2.125 11.182 1.00 0.72 O ATOM 0 H TYR A 71 -14.072 2.628 10.590 1.00 0.57 H new ATOM 0 HA TYR A 71 -12.920 4.918 11.944 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -13.003 3.896 9.098 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -12.356 5.477 9.485 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -11.876 1.837 9.982 1.00 0.62 H new ATOM 0 HD2 TYR A 71 -10.197 5.706 10.566 1.00 0.58 H new ATOM 0 HE1 TYR A 71 -9.713 0.812 10.542 1.00 0.66 H new ATOM 0 HE2 TYR A 71 -8.038 4.682 11.117 1.00 0.63 H new ATOM 0 HH TYR A 71 -7.411 1.297 10.671 1.00 0.72 H new ATOM 1203 N MET A 72 -14.255 6.691 10.124 1.00 0.60 N ATOM 1204 CA MET A 72 -15.224 7.751 9.848 1.00 0.69 C ATOM 1205 C MET A 72 -15.992 7.496 8.551 1.00 0.63 C ATOM 1206 O MET A 72 -16.558 8.423 7.968 1.00 0.75 O ATOM 1207 CB MET A 72 -14.518 9.107 9.763 1.00 0.83 C ATOM 1208 CG MET A 72 -13.853 9.538 11.059 1.00 1.02 C ATOM 1209 SD MET A 72 -13.075 11.165 10.941 1.00 1.73 S ATOM 1210 CE MET A 72 -11.890 10.884 9.627 1.00 2.38 C ATOM 0 H MET A 72 -13.320 6.865 9.755 1.00 0.60 H new ATOM 0 HA MET A 72 -15.939 7.758 10.671 1.00 0.69 H new ATOM 0 HB2 MET A 72 -13.765 9.064 8.976 1.00 0.83 H new ATOM 0 HB3 MET A 72 -15.244 9.865 9.469 1.00 0.83 H new ATOM 0 HG2 MET A 72 -14.597 9.553 11.856 1.00 1.02 H new ATOM 0 HG3 MET A 72 -13.101 8.800 11.339 1.00 1.02 H new ATOM 0 HE1 MET A 72 -11.130 11.665 9.649 1.00 2.38 H new ATOM 0 HE2 MET A 72 -11.416 9.912 9.766 1.00 2.38 H new ATOM 0 HE3 MET A 72 -12.402 10.904 8.665 1.00 2.38 H new ATOM 1220 N LEU A 73 -16.041 6.245 8.107 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.688 5.936 6.835 1.00 0.54 C ATOM 1222 C LEU A 73 -18.168 5.749 7.038 1.00 0.50 C ATOM 1223 O LEU A 73 -18.613 5.227 8.060 1.00 0.60 O ATOM 1224 CB LEU A 73 -16.122 4.686 6.151 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.748 4.202 6.613 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -14.310 3.018 5.771 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.719 5.311 6.533 1.00 0.88 C ATOM 0 H LEU A 73 -15.649 5.441 8.597 1.00 0.56 H new ATOM 0 HA LEU A 73 -16.489 6.785 6.182 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -16.833 3.872 6.292 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -16.070 4.881 5.080 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.827 3.894 7.656 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.330 2.677 6.105 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -15.032 2.208 5.878 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -14.253 3.317 4.724 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.752 4.935 6.868 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -13.636 5.657 5.503 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -14.027 6.140 7.170 1.00 0.88 H new ATOM 1239 N ARG A 74 -18.913 6.176 6.041 1.00 0.48 N ATOM 1240 CA ARG A 74 -20.362 6.169 6.080 1.00 0.52 C ATOM 1241 C ARG A 74 -20.901 6.645 4.745 1.00 0.46 C ATOM 1242 O ARG A 74 -20.151 6.751 3.774 1.00 0.45 O ATOM 1243 CB ARG A 74 -20.891 7.043 7.236 1.00 0.65 C ATOM 1244 CG ARG A 74 -20.066 8.293 7.514 1.00 1.17 C ATOM 1245 CD ARG A 74 -20.103 9.269 6.355 1.00 1.64 C ATOM 1246 NE ARG A 74 -18.995 10.211 6.410 1.00 2.05 N ATOM 1247 CZ ARG A 74 -19.141 11.530 6.487 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -20.355 12.059 6.597 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -18.074 12.315 6.470 1.00 3.29 N ATOM 0 H ARG A 74 -18.527 6.542 5.171 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.708 5.152 6.262 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -21.914 7.342 7.009 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -20.929 6.439 8.143 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -20.442 8.783 8.412 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -19.033 8.008 7.715 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -20.067 8.719 5.415 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -21.046 9.815 6.369 1.00 1.64 H new ATOM 0 HE ARG A 74 -18.047 9.836 6.388 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -21.175 11.453 6.622 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -20.467 13.071 6.656 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -17.142 11.907 6.398 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -18.185 13.327 6.529 1.00 3.29 H new ATOM 1263 N ASN A 75 -22.183 6.942 4.708 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.842 7.378 3.482 1.00 0.47 C ATOM 1265 C ASN A 75 -22.201 8.644 2.930 1.00 0.48 C ATOM 1266 O ASN A 75 -22.413 9.741 3.450 1.00 0.56 O ATOM 1267 CB ASN A 75 -24.340 7.604 3.722 1.00 0.52 C ATOM 1268 CG ASN A 75 -25.132 6.311 3.686 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -25.646 5.919 2.645 1.00 0.72 O ATOM 1270 ND2 ASN A 75 -25.231 5.633 4.812 1.00 0.51 N ATOM 0 H ASN A 75 -22.800 6.890 5.519 1.00 0.49 H new ATOM 0 HA ASN A 75 -22.721 6.586 2.743 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -24.482 8.087 4.689 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -24.728 8.286 2.965 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -25.748 4.754 4.834 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -24.791 5.988 5.661 1.00 0.51 H new ATOM 1277 N GLY A 76 -21.385 8.476 1.899 1.00 0.45 N ATOM 1278 CA GLY A 76 -20.785 9.612 1.232 1.00 0.51 C ATOM 1279 C GLY A 76 -19.272 9.526 1.148 1.00 0.47 C ATOM 1280 O GLY A 76 -18.656 10.263 0.378 1.00 0.55 O ATOM 0 H GLY A 76 -21.127 7.568 1.512 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -21.194 9.692 0.225 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -21.062 10.524 1.761 1.00 0.51 H new ATOM 1284 N ASP A 77 -18.665 8.628 1.920 1.00 0.42 N ATOM 1285 CA ASP A 77 -17.209 8.524 1.945 1.00 0.42 C ATOM 1286 C ASP A 77 -16.714 7.761 0.719 1.00 0.38 C ATOM 1287 O ASP A 77 -17.347 6.800 0.277 1.00 0.40 O ATOM 1288 CB ASP A 77 -16.740 7.826 3.224 1.00 0.44 C ATOM 1289 CG ASP A 77 -15.368 8.298 3.679 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -14.566 8.706 2.812 1.00 1.05 O ATOM 1291 OD2 ASP A 77 -15.075 8.243 4.891 1.00 1.00 O ATOM 0 H ASP A 77 -19.151 7.970 2.529 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.792 9.531 1.928 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -17.464 8.007 4.018 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -16.713 6.749 3.057 1.00 0.44 H new ATOM 1296 N THR A 78 -15.603 8.207 0.154 1.00 0.36 N ATOM 1297 CA THR A 78 -15.018 7.555 -1.003 1.00 0.35 C ATOM 1298 C THR A 78 -13.967 6.541 -0.567 1.00 0.31 C ATOM 1299 O THR A 78 -13.078 6.856 0.227 1.00 0.34 O ATOM 1300 CB THR A 78 -14.372 8.587 -1.954 1.00 0.42 C ATOM 1301 OG1 THR A 78 -15.343 9.573 -2.338 1.00 0.50 O ATOM 1302 CG2 THR A 78 -13.810 7.914 -3.201 1.00 0.42 C ATOM 0 H THR A 78 -15.087 9.023 0.482 1.00 0.36 H new ATOM 0 HA THR A 78 -15.819 7.041 -1.535 1.00 0.35 H new ATOM 0 HB THR A 78 -13.550 9.066 -1.422 1.00 0.42 H new ATOM 0 HG1 THR A 78 -14.927 10.225 -2.939 1.00 0.50 H new ATOM 0 HG21 THR A 78 -13.362 8.667 -3.850 1.00 0.42 H new ATOM 0 HG22 THR A 78 -13.051 7.187 -2.911 1.00 0.42 H new ATOM 0 HG23 THR A 78 -14.614 7.407 -3.734 1.00 0.42 H new ATOM 1310 N MET A 79 -14.053 5.335 -1.101 1.00 0.27 N ATOM 1311 CA MET A 79 -13.128 4.285 -0.745 1.00 0.27 C ATOM 1312 C MET A 79 -12.508 3.719 -2.012 1.00 0.28 C ATOM 1313 O MET A 79 -13.185 3.099 -2.833 1.00 0.27 O ATOM 1314 CB MET A 79 -13.835 3.179 0.041 1.00 0.23 C ATOM 1315 CG MET A 79 -12.876 2.254 0.773 1.00 0.27 C ATOM 1316 SD MET A 79 -13.723 0.963 1.703 1.00 0.65 S ATOM 1317 CE MET A 79 -14.404 -0.020 0.375 1.00 0.24 C ATOM 0 H MET A 79 -14.759 5.063 -1.785 1.00 0.27 H new ATOM 0 HA MET A 79 -12.346 4.699 -0.108 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.513 3.633 0.763 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.446 2.590 -0.643 1.00 0.23 H new ATOM 0 HG2 MET A 79 -12.202 1.793 0.052 1.00 0.27 H new ATOM 0 HG3 MET A 79 -12.260 2.842 1.454 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.427 -1.068 0.673 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.417 0.317 0.156 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.784 0.091 -0.515 1.00 0.24 H new ATOM 1327 N GLU A 80 -11.225 3.958 -2.167 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.502 3.531 -3.345 1.00 0.35 C ATOM 1329 C GLU A 80 -10.190 2.047 -3.233 1.00 0.33 C ATOM 1330 O GLU A 80 -9.591 1.608 -2.249 1.00 0.33 O ATOM 1331 CB GLU A 80 -9.207 4.343 -3.450 1.00 0.40 C ATOM 1332 CG GLU A 80 -8.533 4.292 -4.809 1.00 0.53 C ATOM 1333 CD GLU A 80 -7.352 5.236 -4.893 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -7.573 6.463 -5.016 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -6.201 4.763 -4.824 1.00 1.04 O ATOM 0 H GLU A 80 -10.654 4.453 -1.482 1.00 0.32 H new ATOM 0 HA GLU A 80 -11.103 3.696 -4.239 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -9.426 5.383 -3.207 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.506 3.981 -2.698 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -8.198 3.274 -5.010 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -9.257 4.548 -5.583 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.583 1.266 -4.226 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.234 -0.139 -4.247 1.00 0.33 C ATOM 1344 C TYR A 81 -9.014 -0.296 -5.126 1.00 0.36 C ATOM 1345 O TYR A 81 -9.107 -0.264 -6.354 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.398 -0.988 -4.773 1.00 0.33 C ATOM 1347 CG TYR A 81 -11.186 -2.483 -4.639 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -11.483 -3.148 -3.456 1.00 0.34 C ATOM 1349 CD2 TYR A 81 -10.682 -3.227 -5.697 1.00 0.37 C ATOM 1350 CE1 TYR A 81 -11.284 -4.511 -3.333 1.00 0.36 C ATOM 1351 CE2 TYR A 81 -10.482 -4.589 -5.583 1.00 0.39 C ATOM 1352 CZ TYR A 81 -10.808 -5.229 -4.388 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.583 -6.584 -4.282 1.00 0.42 O ATOM 0 H TYR A 81 -11.139 1.581 -5.021 1.00 0.33 H new ATOM 0 HA TYR A 81 -10.020 -0.487 -3.236 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.306 -0.712 -4.237 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.562 -0.748 -5.824 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -11.876 -2.591 -2.618 1.00 0.34 H new ATOM 0 HD2 TYR A 81 -10.442 -2.732 -6.626 1.00 0.37 H new ATOM 0 HE1 TYR A 81 -11.506 -5.007 -2.400 1.00 0.36 H new ATOM 0 HE2 TYR A 81 -10.077 -5.152 -6.411 1.00 0.39 H new ATOM 0 HH TYR A 81 -10.735 -6.869 -3.357 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.872 -0.433 -4.496 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.619 -0.392 -5.220 1.00 0.39 C ATOM 1365 C ARG A 82 -5.710 -1.525 -4.805 1.00 0.40 C ATOM 1366 O ARG A 82 -5.953 -2.204 -3.807 1.00 0.42 O ATOM 1367 CB ARG A 82 -5.904 0.946 -5.011 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.616 1.279 -3.556 1.00 0.44 C ATOM 1369 CD ARG A 82 -4.523 2.325 -3.439 1.00 0.56 C ATOM 1370 NE ARG A 82 -3.230 1.800 -3.884 1.00 0.65 N ATOM 1371 CZ ARG A 82 -2.209 2.558 -4.283 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -2.307 3.885 -4.262 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -1.081 1.986 -4.687 1.00 1.03 N ATOM 0 H ARG A 82 -7.781 -0.573 -3.490 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.855 -0.503 -6.278 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -4.963 0.932 -5.562 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.513 1.741 -5.440 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.525 1.643 -3.077 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.316 0.375 -3.026 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -4.788 3.198 -4.036 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -4.445 2.658 -2.404 1.00 0.56 H new ATOM 0 HE ARG A 82 -3.103 0.788 -3.889 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -3.167 4.328 -3.939 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -1.522 4.459 -4.569 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -0.998 0.969 -4.691 1.00 1.03 H new ATOM 0 HH22 ARG A 82 -0.298 2.563 -4.993 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.661 -1.720 -5.580 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.645 -2.692 -5.253 1.00 0.45 C ATOM 1389 C LYS A 83 -2.951 -2.270 -3.965 1.00 0.42 C ATOM 1390 O LYS A 83 -2.558 -1.109 -3.817 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.645 -2.798 -6.409 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.650 -3.937 -6.279 1.00 0.60 C ATOM 1393 CD LYS A 83 -0.797 -4.058 -7.528 1.00 0.70 C ATOM 1394 CE LYS A 83 0.097 -5.284 -7.481 1.00 1.25 C ATOM 1395 NZ LYS A 83 -0.685 -6.544 -7.562 1.00 1.74 N ATOM 0 H LYS A 83 -4.493 -1.211 -6.448 1.00 0.43 H new ATOM 0 HA LYS A 83 -4.095 -3.673 -5.103 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.198 -2.920 -7.341 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -2.096 -1.860 -6.485 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -1.011 -3.769 -5.412 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -2.183 -4.872 -6.106 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -1.442 -4.111 -8.405 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -0.183 -3.164 -7.637 1.00 0.70 H new ATOM 0 HE2 LYS A 83 0.809 -5.245 -8.305 1.00 1.25 H new ATOM 0 HE3 LYS A 83 0.677 -5.275 -6.558 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 -0.345 -7.211 -6.840 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 -1.691 -6.339 -7.397 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 -0.567 -6.965 -8.505 1.00 1.74 H new ATOM 1409 N LYS A 84 -2.838 -3.206 -3.029 1.00 0.44 N ATOM 1410 CA LYS A 84 -2.198 -2.953 -1.742 1.00 0.46 C ATOM 1411 C LYS A 84 -0.771 -2.480 -1.940 1.00 0.46 C ATOM 1412 O LYS A 84 -0.261 -1.652 -1.188 1.00 0.52 O ATOM 1413 CB LYS A 84 -2.202 -4.225 -0.888 1.00 0.54 C ATOM 1414 CG LYS A 84 -3.516 -4.484 -0.174 1.00 0.55 C ATOM 1415 CD LYS A 84 -3.765 -3.440 0.901 1.00 0.66 C ATOM 1416 CE LYS A 84 -3.762 -4.047 2.295 1.00 0.67 C ATOM 1417 NZ LYS A 84 -2.458 -4.675 2.633 1.00 1.32 N ATOM 0 H LYS A 84 -3.186 -4.158 -3.140 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.761 -2.173 -1.229 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -1.972 -5.079 -1.525 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.405 -4.156 -0.147 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -4.334 -4.472 -0.894 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -3.501 -5.477 0.275 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -2.999 -2.667 0.840 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -4.723 -2.954 0.719 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -3.990 -3.272 3.027 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -4.552 -4.795 2.365 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -2.475 -5.000 3.621 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -2.290 -5.486 2.005 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -1.695 -3.979 2.510 1.00 1.32 H new ATOM 1431 N GLN A 85 -0.145 -2.998 -2.974 1.00 0.44 N ATOM 1432 CA GLN A 85 1.246 -2.724 -3.246 1.00 0.47 C ATOM 1433 C GLN A 85 1.406 -1.515 -4.149 1.00 0.52 C ATOM 1434 O GLN A 85 0.505 -1.162 -4.912 1.00 0.83 O ATOM 1435 CB GLN A 85 1.905 -3.938 -3.908 1.00 0.53 C ATOM 1436 CG GLN A 85 1.051 -5.189 -3.892 1.00 0.50 C ATOM 1437 CD GLN A 85 1.835 -6.438 -4.229 1.00 0.64 C ATOM 1438 OE1 GLN A 85 1.990 -6.791 -5.398 1.00 1.10 O ATOM 1439 NE2 GLN A 85 2.313 -7.126 -3.207 1.00 0.72 N ATOM 0 H GLN A 85 -0.588 -3.621 -3.649 1.00 0.44 H new ATOM 0 HA GLN A 85 1.732 -2.513 -2.293 1.00 0.47 H new ATOM 0 HB2 GLN A 85 2.146 -3.689 -4.941 1.00 0.53 H new ATOM 0 HB3 GLN A 85 2.847 -4.148 -3.402 1.00 0.53 H new ATOM 0 HG2 GLN A 85 0.600 -5.303 -2.906 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.234 -5.075 -4.605 1.00 0.50 H new ATOM 0 HE21 GLN A 85 2.161 -6.796 -2.254 1.00 0.72 H new ATOM 0 HE22 GLN A 85 2.834 -7.987 -3.371 1.00 0.72 H new ATOM 1448 N ARG A 86 2.557 -0.880 -4.038 1.00 0.50 N ATOM 1449 CA ARG A 86 2.956 0.179 -4.948 1.00 0.52 C ATOM 1450 C ARG A 86 4.254 -0.230 -5.650 1.00 0.50 C ATOM 1451 O ARG A 86 5.011 -1.045 -5.117 1.00 0.53 O ATOM 1452 CB ARG A 86 3.161 1.485 -4.180 1.00 0.67 C ATOM 1453 CG ARG A 86 4.203 1.360 -3.089 1.00 0.85 C ATOM 1454 CD ARG A 86 4.826 2.694 -2.739 1.00 0.98 C ATOM 1455 NE ARG A 86 4.056 3.433 -1.741 1.00 1.13 N ATOM 1456 CZ ARG A 86 4.038 4.762 -1.624 1.00 1.24 C ATOM 1457 NH1 ARG A 86 4.702 5.526 -2.474 1.00 1.62 N ATOM 1458 NH2 ARG A 86 3.349 5.324 -0.645 1.00 1.85 N ATOM 0 H ARG A 86 3.244 -1.084 -3.312 1.00 0.50 H new ATOM 0 HA ARG A 86 2.173 0.336 -5.690 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.461 2.268 -4.876 1.00 0.67 H new ATOM 0 HB3 ARG A 86 2.214 1.796 -3.739 1.00 0.67 H new ATOM 0 HG2 ARG A 86 3.745 0.930 -2.198 1.00 0.85 H new ATOM 0 HG3 ARG A 86 4.983 0.670 -3.411 1.00 0.85 H new ATOM 0 HD2 ARG A 86 5.836 2.531 -2.364 1.00 0.98 H new ATOM 0 HD3 ARG A 86 4.915 3.297 -3.643 1.00 0.98 H new ATOM 0 HE ARG A 86 3.491 2.893 -1.086 1.00 1.13 H new ATOM 0 HH11 ARG A 86 5.237 5.101 -3.231 1.00 1.62 H new ATOM 0 HH12 ARG A 86 4.679 6.541 -2.373 1.00 1.62 H new ATOM 0 HH21 ARG A 86 2.835 4.742 0.016 1.00 1.85 H new ATOM 0 HH22 ARG A 86 3.332 6.340 -0.551 1.00 1.85 H new ATOM 1472 N PRO A 87 4.516 0.293 -6.858 1.00 0.52 N ATOM 1473 CA PRO A 87 5.733 -0.039 -7.608 1.00 0.52 C ATOM 1474 C PRO A 87 6.993 0.585 -7.002 1.00 0.53 C ATOM 1475 O PRO A 87 7.137 1.807 -6.946 1.00 0.62 O ATOM 1476 CB PRO A 87 5.462 0.526 -9.003 1.00 0.57 C ATOM 1477 CG PRO A 87 4.465 1.614 -8.799 1.00 0.86 C ATOM 1478 CD PRO A 87 3.645 1.228 -7.596 1.00 0.60 C ATOM 0 HA PRO A 87 5.929 -1.111 -7.602 1.00 0.52 H new ATOM 0 HB2 PRO A 87 6.376 0.910 -9.456 1.00 0.57 H new ATOM 0 HB3 PRO A 87 5.074 -0.243 -9.670 1.00 0.57 H new ATOM 0 HG2 PRO A 87 4.963 2.570 -8.638 1.00 0.86 H new ATOM 0 HG3 PRO A 87 3.832 1.729 -9.679 1.00 0.86 H new ATOM 0 HD2 PRO A 87 3.389 2.098 -6.991 1.00 0.60 H new ATOM 0 HD3 PRO A 87 2.707 0.755 -7.887 1.00 0.60 H new ATOM 1486 N LEU A 88 7.888 -0.268 -6.529 1.00 0.50 N ATOM 1487 CA LEU A 88 9.150 0.177 -5.949 1.00 0.53 C ATOM 1488 C LEU A 88 10.294 -0.014 -6.938 1.00 0.44 C ATOM 1489 O LEU A 88 10.516 -1.125 -7.420 1.00 0.42 O ATOM 1490 CB LEU A 88 9.453 -0.582 -4.651 1.00 0.63 C ATOM 1491 CG LEU A 88 8.985 0.094 -3.355 1.00 0.88 C ATOM 1492 CD1 LEU A 88 9.796 1.347 -3.077 1.00 1.19 C ATOM 1493 CD2 LEU A 88 7.506 0.432 -3.421 1.00 1.51 C ATOM 0 H LEU A 88 7.764 -1.280 -6.535 1.00 0.50 H new ATOM 0 HA LEU A 88 9.055 1.238 -5.719 1.00 0.53 H new ATOM 0 HB2 LEU A 88 8.990 -1.567 -4.712 1.00 0.63 H new ATOM 0 HB3 LEU A 88 10.530 -0.739 -4.588 1.00 0.63 H new ATOM 0 HG LEU A 88 9.141 -0.610 -2.538 1.00 0.88 H new ATOM 0 HD11 LEU A 88 9.447 1.809 -2.154 1.00 1.19 H new ATOM 0 HD12 LEU A 88 10.849 1.084 -2.975 1.00 1.19 H new ATOM 0 HD13 LEU A 88 9.676 2.049 -3.902 1.00 1.19 H new ATOM 0 HD21 LEU A 88 7.200 0.910 -2.490 1.00 1.51 H new ATOM 0 HD22 LEU A 88 7.325 1.111 -4.254 1.00 1.51 H new ATOM 0 HD23 LEU A 88 6.930 -0.482 -3.566 1.00 1.51 H new ATOM 1505 N LYS A 89 11.008 1.059 -7.248 1.00 0.44 N ATOM 1506 CA LYS A 89 12.232 0.945 -8.029 1.00 0.42 C ATOM 1507 C LYS A 89 13.422 0.929 -7.088 1.00 0.39 C ATOM 1508 O LYS A 89 13.685 1.900 -6.383 1.00 0.42 O ATOM 1509 CB LYS A 89 12.372 2.071 -9.062 1.00 0.51 C ATOM 1510 CG LYS A 89 11.517 1.865 -10.305 1.00 0.69 C ATOM 1511 CD LYS A 89 10.071 2.264 -10.069 1.00 0.93 C ATOM 1512 CE LYS A 89 9.887 3.769 -10.182 1.00 1.49 C ATOM 1513 NZ LYS A 89 10.089 4.247 -11.576 1.00 2.11 N ATOM 0 H LYS A 89 10.764 2.011 -6.974 1.00 0.44 H new ATOM 0 HA LYS A 89 12.191 0.012 -8.591 1.00 0.42 H new ATOM 0 HB2 LYS A 89 12.099 3.017 -8.595 1.00 0.51 H new ATOM 0 HB3 LYS A 89 13.417 2.153 -9.359 1.00 0.51 H new ATOM 0 HG2 LYS A 89 11.926 2.451 -11.128 1.00 0.69 H new ATOM 0 HG3 LYS A 89 11.560 0.818 -10.606 1.00 0.69 H new ATOM 0 HD2 LYS A 89 9.430 1.762 -10.794 1.00 0.93 H new ATOM 0 HD3 LYS A 89 9.756 1.930 -9.080 1.00 0.93 H new ATOM 0 HE2 LYS A 89 8.886 4.039 -9.847 1.00 1.49 H new ATOM 0 HE3 LYS A 89 10.591 4.272 -9.520 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 9.625 5.170 -11.697 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 11.107 4.344 -11.766 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 9.676 3.562 -12.241 1.00 2.11 H new ATOM 1527 N ILE A 90 14.144 -0.173 -7.100 1.00 0.36 N ATOM 1528 CA ILE A 90 15.154 -0.433 -6.087 1.00 0.33 C ATOM 1529 C ILE A 90 16.513 -0.670 -6.727 1.00 0.35 C ATOM 1530 O ILE A 90 16.616 -1.398 -7.712 1.00 0.36 O ATOM 1531 CB ILE A 90 14.773 -1.665 -5.230 1.00 0.32 C ATOM 1532 CG1 ILE A 90 13.405 -1.463 -4.566 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.837 -1.948 -4.176 1.00 0.33 C ATOM 1534 CD1 ILE A 90 13.358 -0.302 -3.594 1.00 0.36 C ATOM 0 H ILE A 90 14.052 -0.907 -7.802 1.00 0.36 H new ATOM 0 HA ILE A 90 15.208 0.446 -5.445 1.00 0.33 H new ATOM 0 HB ILE A 90 14.712 -2.527 -5.894 1.00 0.32 H new ATOM 0 HG12 ILE A 90 12.656 -1.305 -5.342 1.00 0.35 H new ATOM 0 HG13 ILE A 90 13.130 -2.376 -4.039 1.00 0.35 H new ATOM 0 HG21 ILE A 90 15.544 -2.818 -3.588 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.791 -2.145 -4.666 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.938 -1.084 -3.519 1.00 0.33 H new ATOM 0 HD11 ILE A 90 12.358 -0.225 -3.167 1.00 0.36 H new ATOM 0 HD12 ILE A 90 14.082 -0.466 -2.796 1.00 0.36 H new ATOM 0 HD13 ILE A 90 13.600 0.622 -4.119 1.00 0.36 H new ATOM 1546 N ARG A 91 17.550 -0.048 -6.177 1.00 0.38 N ATOM 1547 CA ARG A 91 18.912 -0.285 -6.618 1.00 0.43 C ATOM 1548 C ARG A 91 19.553 -1.322 -5.715 1.00 0.42 C ATOM 1549 O ARG A 91 19.682 -1.097 -4.516 1.00 0.44 O ATOM 1550 CB ARG A 91 19.732 1.004 -6.530 1.00 0.52 C ATOM 1551 CG ARG A 91 20.417 1.402 -7.821 1.00 0.57 C ATOM 1552 CD ARG A 91 19.396 1.832 -8.840 1.00 0.74 C ATOM 1553 NE ARG A 91 19.927 2.819 -9.771 1.00 0.72 N ATOM 1554 CZ ARG A 91 19.177 3.512 -10.622 1.00 1.09 C ATOM 1555 NH1 ARG A 91 17.885 3.244 -10.743 1.00 1.82 N ATOM 1556 NH2 ARG A 91 19.722 4.465 -11.363 1.00 1.12 N ATOM 0 H ARG A 91 17.467 0.629 -5.419 1.00 0.38 H new ATOM 0 HA ARG A 91 18.891 -0.633 -7.651 1.00 0.43 H new ATOM 0 HB2 ARG A 91 19.076 1.816 -6.216 1.00 0.52 H new ATOM 0 HB3 ARG A 91 20.488 0.886 -5.754 1.00 0.52 H new ATOM 0 HG2 ARG A 91 21.119 2.215 -7.633 1.00 0.57 H new ATOM 0 HG3 ARG A 91 20.996 0.563 -8.207 1.00 0.57 H new ATOM 0 HD2 ARG A 91 19.051 0.960 -9.396 1.00 0.74 H new ATOM 0 HD3 ARG A 91 18.528 2.248 -8.328 1.00 0.74 H new ATOM 0 HE ARG A 91 20.933 2.988 -9.770 1.00 0.72 H new ATOM 0 HH11 ARG A 91 17.463 2.504 -10.182 1.00 1.82 H new ATOM 0 HH12 ARG A 91 17.312 3.778 -11.397 1.00 1.82 H new ATOM 0 HH21 ARG A 91 20.718 4.668 -11.281 1.00 1.12 H new ATOM 0 HH22 ARG A 91 19.145 4.996 -12.016 1.00 1.12 H new ATOM 1570 N MET A 92 19.949 -2.447 -6.272 1.00 0.42 N ATOM 1571 CA MET A 92 20.633 -3.471 -5.502 1.00 0.44 C ATOM 1572 C MET A 92 22.099 -3.115 -5.359 1.00 0.48 C ATOM 1573 O MET A 92 22.557 -2.142 -5.957 1.00 0.51 O ATOM 1574 CB MET A 92 20.481 -4.826 -6.186 1.00 0.46 C ATOM 1575 CG MET A 92 19.442 -5.730 -5.547 1.00 0.57 C ATOM 1576 SD MET A 92 17.959 -4.858 -5.009 1.00 1.04 S ATOM 1577 CE MET A 92 17.239 -4.404 -6.579 1.00 0.34 C ATOM 0 H MET A 92 19.810 -2.678 -7.256 1.00 0.42 H new ATOM 0 HA MET A 92 20.187 -3.529 -4.509 1.00 0.44 H new ATOM 0 HB2 MET A 92 20.214 -4.666 -7.231 1.00 0.46 H new ATOM 0 HB3 MET A 92 21.445 -5.335 -6.178 1.00 0.46 H new ATOM 0 HG2 MET A 92 19.159 -6.505 -6.260 1.00 0.57 H new ATOM 0 HG3 MET A 92 19.889 -6.233 -4.689 1.00 0.57 H new ATOM 0 HE1 MET A 92 16.172 -4.220 -6.451 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.721 -3.500 -6.952 1.00 0.34 H new ATOM 0 HE3 MET A 92 17.384 -5.214 -7.294 1.00 0.34 H new ATOM 1587 N LEU A 93 22.825 -3.925 -4.596 1.00 0.49 N ATOM 1588 CA LEU A 93 24.199 -3.618 -4.192 1.00 0.55 C ATOM 1589 C LEU A 93 25.085 -3.301 -5.393 1.00 0.61 C ATOM 1590 O LEU A 93 25.909 -2.387 -5.346 1.00 0.69 O ATOM 1591 CB LEU A 93 24.811 -4.785 -3.401 1.00 0.57 C ATOM 1592 CG LEU A 93 24.142 -5.139 -2.061 1.00 0.57 C ATOM 1593 CD1 LEU A 93 23.874 -3.890 -1.238 1.00 0.68 C ATOM 1594 CD2 LEU A 93 22.859 -5.935 -2.269 1.00 0.79 C ATOM 0 H LEU A 93 22.480 -4.815 -4.238 1.00 0.49 H new ATOM 0 HA LEU A 93 24.152 -2.734 -3.555 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.793 -5.672 -4.035 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.858 -4.553 -3.207 1.00 0.57 H new ATOM 0 HG LEU A 93 24.837 -5.770 -1.507 1.00 0.57 H new ATOM 0 HD11 LEU A 93 23.401 -4.169 -0.297 1.00 0.68 H new ATOM 0 HD12 LEU A 93 24.815 -3.380 -1.034 1.00 0.68 H new ATOM 0 HD13 LEU A 93 23.213 -3.224 -1.792 1.00 0.68 H new ATOM 0 HD21 LEU A 93 22.414 -6.167 -1.301 1.00 0.79 H new ATOM 0 HD22 LEU A 93 22.157 -5.346 -2.859 1.00 0.79 H new ATOM 0 HD23 LEU A 93 23.087 -6.862 -2.795 1.00 0.79 H new ATOM 1606 N ASP A 94 24.907 -4.052 -6.471 1.00 0.61 N ATOM 1607 CA ASP A 94 25.715 -3.861 -7.676 1.00 0.69 C ATOM 1608 C ASP A 94 25.176 -2.714 -8.522 1.00 0.66 C ATOM 1609 O ASP A 94 25.754 -2.365 -9.550 1.00 0.70 O ATOM 1610 CB ASP A 94 25.740 -5.137 -8.520 1.00 0.76 C ATOM 1611 CG ASP A 94 26.288 -6.330 -7.771 1.00 1.47 C ATOM 1612 OD1 ASP A 94 27.518 -6.396 -7.574 1.00 2.26 O ATOM 1613 OD2 ASP A 94 25.500 -7.199 -7.356 1.00 1.93 O ATOM 0 H ASP A 94 24.214 -4.797 -6.540 1.00 0.61 H new ATOM 0 HA ASP A 94 26.728 -3.620 -7.353 1.00 0.69 H new ATOM 0 HB2 ASP A 94 24.729 -5.361 -8.859 1.00 0.76 H new ATOM 0 HB3 ASP A 94 26.344 -4.965 -9.411 1.00 0.76 H new ATOM 1618 N GLY A 95 24.055 -2.146 -8.099 1.00 0.61 N ATOM 1619 CA GLY A 95 23.419 -1.089 -8.858 1.00 0.61 C ATOM 1620 C GLY A 95 22.298 -1.649 -9.684 1.00 0.58 C ATOM 1621 O GLY A 95 21.612 -0.921 -10.404 1.00 0.64 O ATOM 0 H GLY A 95 23.572 -2.401 -7.237 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.036 -0.325 -8.182 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.151 -0.604 -9.505 1.00 0.61 H new ATOM 1625 N THR A 96 22.112 -2.956 -9.564 1.00 0.54 N ATOM 1626 CA THR A 96 21.078 -3.662 -10.294 1.00 0.54 C ATOM 1627 C THR A 96 19.711 -3.183 -9.845 1.00 0.47 C ATOM 1628 O THR A 96 19.340 -3.350 -8.688 1.00 0.47 O ATOM 1629 CB THR A 96 21.198 -5.178 -10.059 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.576 -5.567 -10.144 1.00 0.81 O ATOM 1631 CG2 THR A 96 20.385 -5.957 -11.082 1.00 0.61 C ATOM 0 H THR A 96 22.675 -3.553 -8.958 1.00 0.54 H new ATOM 0 HA THR A 96 21.201 -3.459 -11.358 1.00 0.54 H new ATOM 0 HB THR A 96 20.807 -5.404 -9.067 1.00 0.62 H new ATOM 0 HG1 THR A 96 22.653 -6.532 -9.993 1.00 0.81 H new ATOM 0 HG21 THR A 96 20.488 -7.025 -10.892 1.00 0.61 H new ATOM 0 HG22 THR A 96 19.335 -5.674 -11.004 1.00 0.61 H new ATOM 0 HG23 THR A 96 20.748 -5.730 -12.084 1.00 0.61 H new ATOM 1639 N VAL A 97 18.966 -2.585 -10.746 1.00 0.45 N ATOM 1640 CA VAL A 97 17.707 -1.979 -10.375 1.00 0.41 C ATOM 1641 C VAL A 97 16.526 -2.764 -10.937 1.00 0.38 C ATOM 1642 O VAL A 97 16.541 -3.215 -12.083 1.00 0.41 O ATOM 1643 CB VAL A 97 17.652 -0.489 -10.796 1.00 0.50 C ATOM 1644 CG1 VAL A 97 18.113 -0.308 -12.228 1.00 1.07 C ATOM 1645 CG2 VAL A 97 16.261 0.097 -10.597 1.00 1.11 C ATOM 0 H VAL A 97 19.207 -2.505 -11.734 1.00 0.45 H new ATOM 0 HA VAL A 97 17.633 -2.013 -9.288 1.00 0.41 H new ATOM 0 HB VAL A 97 18.337 0.057 -10.148 1.00 0.50 H new ATOM 0 HG11 VAL A 97 18.064 0.748 -12.495 1.00 1.07 H new ATOM 0 HG12 VAL A 97 19.140 -0.660 -12.327 1.00 1.07 H new ATOM 0 HG13 VAL A 97 17.468 -0.881 -12.893 1.00 1.07 H new ATOM 0 HG21 VAL A 97 16.260 1.143 -10.903 1.00 1.11 H new ATOM 0 HG22 VAL A 97 15.543 -0.458 -11.200 1.00 1.11 H new ATOM 0 HG23 VAL A 97 15.983 0.026 -9.545 1.00 1.11 H new ATOM 1655 N LYS A 98 15.522 -2.941 -10.097 1.00 0.35 N ATOM 1656 CA LYS A 98 14.319 -3.658 -10.484 1.00 0.35 C ATOM 1657 C LYS A 98 13.095 -2.950 -9.933 1.00 0.36 C ATOM 1658 O LYS A 98 13.204 -2.140 -9.010 1.00 0.37 O ATOM 1659 CB LYS A 98 14.344 -5.114 -10.001 1.00 0.38 C ATOM 1660 CG LYS A 98 14.076 -5.290 -8.513 1.00 0.41 C ATOM 1661 CD LYS A 98 13.727 -6.734 -8.171 1.00 0.43 C ATOM 1662 CE LYS A 98 12.379 -7.138 -8.750 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.465 -7.539 -10.184 1.00 0.94 N ATOM 0 H LYS A 98 15.516 -2.596 -9.137 1.00 0.35 H new ATOM 0 HA LYS A 98 14.275 -3.671 -11.573 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.601 -5.682 -10.561 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.317 -5.545 -10.235 1.00 0.38 H new ATOM 0 HG2 LYS A 98 14.955 -4.984 -7.946 1.00 0.41 H new ATOM 0 HG3 LYS A 98 13.258 -4.636 -8.211 1.00 0.41 H new ATOM 0 HD2 LYS A 98 14.502 -7.397 -8.556 1.00 0.43 H new ATOM 0 HD3 LYS A 98 13.710 -6.858 -7.088 1.00 0.43 H new ATOM 0 HE2 LYS A 98 11.972 -7.966 -8.169 1.00 0.43 H new ATOM 0 HE3 LYS A 98 11.682 -6.306 -8.651 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 12.078 -6.780 -10.781 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 13.459 -7.707 -10.439 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 11.917 -8.410 -10.334 1.00 0.94 H new ATOM 1677 N THR A 99 11.942 -3.244 -10.506 1.00 0.40 N ATOM 1678 CA THR A 99 10.689 -2.722 -10.008 1.00 0.44 C ATOM 1679 C THR A 99 9.859 -3.861 -9.436 1.00 0.47 C ATOM 1680 O THR A 99 9.558 -4.822 -10.143 1.00 0.58 O ATOM 1681 CB THR A 99 9.888 -2.048 -11.135 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.763 -1.255 -11.952 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.785 -1.178 -10.558 1.00 0.57 C ATOM 0 H THR A 99 11.851 -3.847 -11.324 1.00 0.40 H new ATOM 0 HA THR A 99 10.909 -1.983 -9.237 1.00 0.44 H new ATOM 0 HB THR A 99 9.432 -2.824 -11.749 1.00 0.48 H new ATOM 0 HG1 THR A 99 10.246 -0.830 -12.668 1.00 0.50 H new ATOM 0 HG21 THR A 99 8.229 -0.709 -11.370 1.00 0.57 H new ATOM 0 HG22 THR A 99 8.110 -1.793 -9.964 1.00 0.57 H new ATOM 0 HG23 THR A 99 9.224 -0.406 -9.926 1.00 0.57 H new ATOM 1691 N ILE A 100 9.511 -3.781 -8.163 1.00 0.42 N ATOM 1692 CA ILE A 100 8.691 -4.808 -7.549 1.00 0.44 C ATOM 1693 C ILE A 100 7.616 -4.148 -6.692 1.00 0.45 C ATOM 1694 O ILE A 100 7.844 -3.090 -6.105 1.00 0.45 O ATOM 1695 CB ILE A 100 9.559 -5.798 -6.721 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.729 -6.990 -6.209 1.00 0.61 C ATOM 1697 CG2 ILE A 100 10.253 -5.079 -5.570 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.093 -6.787 -4.847 1.00 0.50 C ATOM 0 H ILE A 100 9.782 -3.021 -7.539 1.00 0.42 H new ATOM 0 HA ILE A 100 8.205 -5.394 -8.329 1.00 0.44 H new ATOM 0 HB ILE A 100 10.326 -6.197 -7.385 1.00 0.48 H new ATOM 0 HG12 ILE A 100 7.943 -7.204 -6.933 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.371 -7.870 -6.167 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.854 -5.792 -5.005 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.898 -4.295 -5.967 1.00 0.48 H new ATOM 0 HG23 ILE A 100 9.504 -4.636 -4.914 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.530 -7.679 -4.572 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.871 -6.606 -4.105 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.420 -5.930 -4.884 1.00 0.50 H new ATOM 1710 N MET A 101 6.437 -4.747 -6.659 1.00 0.47 N ATOM 1711 CA MET A 101 5.314 -4.155 -5.951 1.00 0.50 C ATOM 1712 C MET A 101 5.179 -4.696 -4.538 1.00 0.50 C ATOM 1713 O MET A 101 4.943 -5.884 -4.319 1.00 0.52 O ATOM 1714 CB MET A 101 4.030 -4.372 -6.739 1.00 0.56 C ATOM 1715 CG MET A 101 4.076 -3.744 -8.120 1.00 0.64 C ATOM 1716 SD MET A 101 2.456 -3.242 -8.716 1.00 0.98 S ATOM 1717 CE MET A 101 2.049 -1.999 -7.494 1.00 0.59 C ATOM 0 H MET A 101 6.233 -5.638 -7.112 1.00 0.47 H new ATOM 0 HA MET A 101 5.503 -3.085 -5.863 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.845 -5.442 -6.837 1.00 0.56 H new ATOM 0 HB3 MET A 101 3.192 -3.954 -6.182 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.734 -2.875 -8.097 1.00 0.64 H new ATOM 0 HG3 MET A 101 4.511 -4.455 -8.822 1.00 0.64 H new ATOM 0 HE1 MET A 101 1.528 -1.172 -7.976 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.406 -2.437 -6.730 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.964 -1.631 -7.031 1.00 0.59 H new ATOM 1727 N VAL A 102 5.350 -3.791 -3.588 1.00 0.50 N ATOM 1728 CA VAL A 102 5.214 -4.110 -2.173 1.00 0.53 C ATOM 1729 C VAL A 102 4.038 -3.392 -1.552 1.00 0.49 C ATOM 1730 O VAL A 102 3.813 -2.209 -1.819 1.00 0.50 O ATOM 1731 CB VAL A 102 6.470 -3.757 -1.365 1.00 0.61 C ATOM 1732 CG1 VAL A 102 7.279 -5.007 -1.100 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.306 -2.706 -2.079 1.00 0.90 C ATOM 0 H VAL A 102 5.586 -2.816 -3.774 1.00 0.50 H new ATOM 0 HA VAL A 102 5.058 -5.188 -2.134 1.00 0.53 H new ATOM 0 HB VAL A 102 6.160 -3.332 -0.410 1.00 0.61 H new ATOM 0 HG11 VAL A 102 8.169 -4.749 -0.526 1.00 0.73 H new ATOM 0 HG12 VAL A 102 6.676 -5.718 -0.535 1.00 0.73 H new ATOM 0 HG13 VAL A 102 7.576 -5.456 -2.048 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.189 -2.476 -1.482 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.615 -3.087 -3.053 1.00 0.90 H new ATOM 0 HG23 VAL A 102 6.714 -1.801 -2.214 1.00 0.90 H new ATOM 1743 N ASP A 103 3.302 -4.120 -0.724 1.00 0.48 N ATOM 1744 CA ASP A 103 2.142 -3.584 -0.021 1.00 0.47 C ATOM 1745 C ASP A 103 2.510 -2.323 0.747 1.00 0.46 C ATOM 1746 O ASP A 103 3.271 -2.367 1.704 1.00 0.51 O ATOM 1747 CB ASP A 103 1.575 -4.647 0.927 1.00 0.51 C ATOM 1748 CG ASP A 103 0.587 -4.092 1.934 1.00 1.22 C ATOM 1749 OD1 ASP A 103 -0.352 -3.377 1.538 1.00 1.56 O ATOM 1750 OD2 ASP A 103 0.745 -4.378 3.137 1.00 1.96 O ATOM 0 H ASP A 103 3.492 -5.101 -0.520 1.00 0.48 H new ATOM 0 HA ASP A 103 1.380 -3.319 -0.753 1.00 0.47 H new ATOM 0 HB2 ASP A 103 1.085 -5.423 0.339 1.00 0.51 H new ATOM 0 HB3 ASP A 103 2.398 -5.123 1.461 1.00 0.51 H new ATOM 1755 N ASP A 104 1.986 -1.198 0.301 1.00 0.46 N ATOM 1756 CA ASP A 104 2.258 0.091 0.930 1.00 0.47 C ATOM 1757 C ASP A 104 1.871 0.082 2.406 1.00 0.46 C ATOM 1758 O ASP A 104 2.432 0.827 3.214 1.00 0.54 O ATOM 1759 CB ASP A 104 1.493 1.201 0.205 1.00 0.54 C ATOM 1760 CG ASP A 104 1.679 2.555 0.859 1.00 0.66 C ATOM 1761 OD1 ASP A 104 2.764 3.151 0.711 1.00 1.08 O ATOM 1762 OD2 ASP A 104 0.740 3.022 1.529 1.00 0.64 O ATOM 0 H ASP A 104 1.362 -1.146 -0.504 1.00 0.46 H new ATOM 0 HA ASP A 104 3.330 0.278 0.858 1.00 0.47 H new ATOM 0 HB2 ASP A 104 1.828 1.252 -0.831 1.00 0.54 H new ATOM 0 HB3 ASP A 104 0.432 0.953 0.185 1.00 0.54 H new ATOM 1767 N SER A 105 0.943 -0.793 2.762 1.00 0.43 N ATOM 1768 CA SER A 105 0.398 -0.811 4.108 1.00 0.49 C ATOM 1769 C SER A 105 1.358 -1.475 5.104 1.00 0.57 C ATOM 1770 O SER A 105 1.242 -1.267 6.313 1.00 0.96 O ATOM 1771 CB SER A 105 -0.958 -1.523 4.104 1.00 0.52 C ATOM 1772 OG SER A 105 -1.626 -1.384 5.346 1.00 1.27 O ATOM 0 H SER A 105 0.553 -1.499 2.137 1.00 0.43 H new ATOM 0 HA SER A 105 0.263 0.220 4.435 1.00 0.49 H new ATOM 0 HB2 SER A 105 -1.581 -1.115 3.308 1.00 0.52 H new ATOM 0 HB3 SER A 105 -0.813 -2.581 3.885 1.00 0.52 H new ATOM 0 HG SER A 105 -2.488 -1.849 5.308 1.00 1.27 H new ATOM 1778 N LYS A 106 2.312 -2.258 4.608 1.00 0.45 N ATOM 1779 CA LYS A 106 3.226 -2.971 5.494 1.00 0.49 C ATOM 1780 C LYS A 106 4.535 -2.199 5.681 1.00 0.52 C ATOM 1781 O LYS A 106 4.863 -1.303 4.894 1.00 0.65 O ATOM 1782 CB LYS A 106 3.480 -4.390 4.962 1.00 0.58 C ATOM 1783 CG LYS A 106 4.058 -4.439 3.558 1.00 0.69 C ATOM 1784 CD LYS A 106 5.560 -4.280 3.563 1.00 0.58 C ATOM 1785 CE LYS A 106 6.063 -3.684 2.268 1.00 1.00 C ATOM 1786 NZ LYS A 106 5.814 -2.220 2.213 1.00 2.02 N ATOM 0 H LYS A 106 2.471 -2.413 3.613 1.00 0.45 H new ATOM 0 HA LYS A 106 2.761 -3.053 6.476 1.00 0.49 H new ATOM 0 HB2 LYS A 106 4.162 -4.903 5.641 1.00 0.58 H new ATOM 0 HB3 LYS A 106 2.541 -4.943 4.975 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.795 -5.387 3.090 1.00 0.69 H new ATOM 0 HG3 LYS A 106 3.611 -3.650 2.953 1.00 0.69 H new ATOM 0 HD2 LYS A 106 5.856 -3.642 4.396 1.00 0.58 H new ATOM 0 HD3 LYS A 106 6.028 -5.251 3.723 1.00 0.58 H new ATOM 0 HE2 LYS A 106 7.131 -3.877 2.167 1.00 1.00 H new ATOM 0 HE3 LYS A 106 5.570 -4.170 1.426 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 6.604 -1.751 1.726 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 4.931 -2.037 1.695 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 5.732 -1.845 3.180 1.00 2.02 H new ATOM 1800 N THR A 107 5.285 -2.573 6.712 1.00 0.53 N ATOM 1801 CA THR A 107 6.513 -1.881 7.095 1.00 0.57 C ATOM 1802 C THR A 107 7.643 -2.059 6.073 1.00 0.52 C ATOM 1803 O THR A 107 7.510 -2.775 5.085 1.00 0.54 O ATOM 1804 CB THR A 107 6.988 -2.365 8.475 1.00 0.69 C ATOM 1805 OG1 THR A 107 6.777 -3.779 8.587 1.00 0.76 O ATOM 1806 CG2 THR A 107 6.243 -1.645 9.589 1.00 0.74 C ATOM 0 H THR A 107 5.058 -3.368 7.309 1.00 0.53 H new ATOM 0 HA THR A 107 6.272 -0.819 7.131 1.00 0.57 H new ATOM 0 HB THR A 107 8.051 -2.143 8.573 1.00 0.69 H new ATOM 0 HG1 THR A 107 7.082 -4.087 9.466 1.00 0.76 H new ATOM 0 HG21 THR A 107 6.597 -2.005 10.555 1.00 0.74 H new ATOM 0 HG22 THR A 107 6.423 -0.573 9.513 1.00 0.74 H new ATOM 0 HG23 THR A 107 5.175 -1.841 9.498 1.00 0.74 H new ATOM 1814 N VAL A 108 8.763 -1.398 6.326 1.00 0.49 N ATOM 1815 CA VAL A 108 9.901 -1.415 5.414 1.00 0.47 C ATOM 1816 C VAL A 108 10.608 -2.769 5.403 1.00 0.42 C ATOM 1817 O VAL A 108 10.881 -3.324 4.343 1.00 0.44 O ATOM 1818 CB VAL A 108 10.915 -0.331 5.806 1.00 0.55 C ATOM 1819 CG1 VAL A 108 12.140 -0.367 4.904 1.00 0.61 C ATOM 1820 CG2 VAL A 108 10.264 1.040 5.783 1.00 0.60 C ATOM 0 H VAL A 108 8.910 -0.837 7.165 1.00 0.49 H new ATOM 0 HA VAL A 108 9.509 -1.222 4.415 1.00 0.47 H new ATOM 0 HB VAL A 108 11.250 -0.535 6.823 1.00 0.55 H new ATOM 0 HG11 VAL A 108 12.839 0.413 5.208 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.624 -1.340 4.986 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.836 -0.199 3.871 1.00 0.61 H new ATOM 0 HG21 VAL A 108 10.998 1.796 6.063 1.00 0.60 H new ATOM 0 HG22 VAL A 108 9.892 1.250 4.780 1.00 0.60 H new ATOM 0 HG23 VAL A 108 9.434 1.060 6.489 1.00 0.60 H new ATOM 1830 N THR A 109 10.946 -3.256 6.585 1.00 0.43 N ATOM 1831 CA THR A 109 11.601 -4.559 6.744 1.00 0.43 C ATOM 1832 C THR A 109 10.937 -5.665 5.920 1.00 0.44 C ATOM 1833 O THR A 109 11.618 -6.378 5.178 1.00 0.45 O ATOM 1834 CB THR A 109 11.629 -4.976 8.220 1.00 0.51 C ATOM 1835 OG1 THR A 109 12.154 -3.899 8.998 1.00 0.56 O ATOM 1836 CG2 THR A 109 12.486 -6.213 8.424 1.00 0.56 C ATOM 0 H THR A 109 10.778 -2.767 7.464 1.00 0.43 H new ATOM 0 HA THR A 109 12.618 -4.434 6.372 1.00 0.43 H new ATOM 0 HB THR A 109 10.612 -5.211 8.535 1.00 0.51 H new ATOM 0 HG1 THR A 109 12.935 -3.519 8.545 1.00 0.56 H new ATOM 0 HG21 THR A 109 12.487 -6.485 9.480 1.00 0.56 H new ATOM 0 HG22 THR A 109 12.081 -7.037 7.837 1.00 0.56 H new ATOM 0 HG23 THR A 109 13.506 -6.006 8.102 1.00 0.56 H new ATOM 1844 N ASP A 110 9.619 -5.800 6.039 1.00 0.47 N ATOM 1845 CA ASP A 110 8.882 -6.816 5.290 1.00 0.51 C ATOM 1846 C ASP A 110 9.069 -6.615 3.788 1.00 0.49 C ATOM 1847 O ASP A 110 9.202 -7.574 3.027 1.00 0.54 O ATOM 1848 CB ASP A 110 7.395 -6.762 5.648 1.00 0.57 C ATOM 1849 CG ASP A 110 6.578 -7.791 4.894 1.00 0.65 C ATOM 1850 OD1 ASP A 110 6.543 -8.964 5.325 1.00 0.76 O ATOM 1851 OD2 ASP A 110 5.963 -7.433 3.872 1.00 0.70 O ATOM 0 H ASP A 110 9.039 -5.220 6.646 1.00 0.47 H new ATOM 0 HA ASP A 110 9.274 -7.796 5.560 1.00 0.51 H new ATOM 0 HB2 ASP A 110 7.277 -6.923 6.719 1.00 0.57 H new ATOM 0 HB3 ASP A 110 7.008 -5.766 5.431 1.00 0.57 H new ATOM 1856 N MET A 111 9.105 -5.355 3.382 1.00 0.46 N ATOM 1857 CA MET A 111 9.360 -4.992 1.996 1.00 0.46 C ATOM 1858 C MET A 111 10.737 -5.466 1.557 1.00 0.40 C ATOM 1859 O MET A 111 10.885 -6.042 0.483 1.00 0.43 O ATOM 1860 CB MET A 111 9.234 -3.477 1.835 1.00 0.51 C ATOM 1861 CG MET A 111 9.934 -2.895 0.619 1.00 0.50 C ATOM 1862 SD MET A 111 9.454 -1.181 0.330 1.00 0.75 S ATOM 1863 CE MET A 111 9.522 -0.543 2.000 1.00 0.67 C ATOM 0 H MET A 111 8.959 -4.558 4.001 1.00 0.46 H new ATOM 0 HA MET A 111 8.622 -5.482 1.360 1.00 0.46 H new ATOM 0 HB2 MET A 111 8.176 -3.220 1.783 1.00 0.51 H new ATOM 0 HB3 MET A 111 9.635 -2.998 2.729 1.00 0.51 H new ATOM 0 HG2 MET A 111 11.014 -2.952 0.759 1.00 0.50 H new ATOM 0 HG3 MET A 111 9.694 -3.493 -0.260 1.00 0.50 H new ATOM 0 HE1 MET A 111 9.765 0.519 1.974 1.00 0.67 H new ATOM 0 HE2 MET A 111 8.555 -0.683 2.482 1.00 0.67 H new ATOM 0 HE3 MET A 111 10.288 -1.077 2.562 1.00 0.67 H new ATOM 1873 N LEU A 112 11.735 -5.240 2.400 1.00 0.36 N ATOM 1874 CA LEU A 112 13.098 -5.632 2.075 1.00 0.34 C ATOM 1875 C LEU A 112 13.190 -7.148 1.966 1.00 0.37 C ATOM 1876 O LEU A 112 13.924 -7.673 1.132 1.00 0.42 O ATOM 1877 CB LEU A 112 14.080 -5.119 3.127 1.00 0.35 C ATOM 1878 CG LEU A 112 15.467 -4.775 2.584 1.00 0.38 C ATOM 1879 CD1 LEU A 112 15.389 -3.540 1.700 1.00 0.39 C ATOM 1880 CD2 LEU A 112 16.448 -4.557 3.716 1.00 0.46 C ATOM 0 H LEU A 112 11.627 -4.790 3.309 1.00 0.36 H new ATOM 0 HA LEU A 112 13.364 -5.187 1.116 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.658 -4.231 3.598 1.00 0.35 H new ATOM 0 HB3 LEU A 112 14.186 -5.874 3.906 1.00 0.35 H new ATOM 0 HG LEU A 112 15.823 -5.614 1.986 1.00 0.38 H new ATOM 0 HD11 LEU A 112 16.382 -3.303 1.318 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.715 -3.732 0.865 1.00 0.39 H new ATOM 0 HD13 LEU A 112 15.014 -2.699 2.283 1.00 0.39 H new ATOM 0 HD21 LEU A 112 17.428 -4.313 3.306 1.00 0.46 H new ATOM 0 HD22 LEU A 112 16.103 -3.735 4.344 1.00 0.46 H new ATOM 0 HD23 LEU A 112 16.520 -5.465 4.315 1.00 0.46 H new ATOM 1892 N MET A 113 12.432 -7.842 2.812 1.00 0.39 N ATOM 1893 CA MET A 113 12.324 -9.297 2.741 1.00 0.46 C ATOM 1894 C MET A 113 11.834 -9.712 1.364 1.00 0.49 C ATOM 1895 O MET A 113 12.442 -10.547 0.693 1.00 0.56 O ATOM 1896 CB MET A 113 11.346 -9.814 3.797 1.00 0.55 C ATOM 1897 CG MET A 113 11.150 -11.324 3.757 1.00 0.61 C ATOM 1898 SD MET A 113 9.834 -11.892 4.854 1.00 0.98 S ATOM 1899 CE MET A 113 10.538 -11.522 6.457 1.00 1.34 C ATOM 0 H MET A 113 11.881 -7.417 3.558 1.00 0.39 H new ATOM 0 HA MET A 113 13.310 -9.724 2.927 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.707 -9.529 4.785 1.00 0.55 H new ATOM 0 HB3 MET A 113 10.381 -9.327 3.657 1.00 0.55 H new ATOM 0 HG2 MET A 113 10.921 -11.628 2.736 1.00 0.61 H new ATOM 0 HG3 MET A 113 12.084 -11.814 4.034 1.00 0.61 H new ATOM 0 HE1 MET A 113 9.935 -11.989 7.236 1.00 1.34 H new ATOM 0 HE2 MET A 113 11.556 -11.908 6.505 1.00 1.34 H new ATOM 0 HE3 MET A 113 10.552 -10.443 6.608 1.00 1.34 H new ATOM 1909 N THR A 114 10.744 -9.089 0.953 1.00 0.47 N ATOM 1910 CA THR A 114 10.135 -9.356 -0.334 1.00 0.50 C ATOM 1911 C THR A 114 11.110 -9.064 -1.480 1.00 0.46 C ATOM 1912 O THR A 114 11.216 -9.841 -2.425 1.00 0.49 O ATOM 1913 CB THR A 114 8.855 -8.517 -0.505 1.00 0.54 C ATOM 1914 OG1 THR A 114 7.882 -8.889 0.482 1.00 0.62 O ATOM 1915 CG2 THR A 114 8.260 -8.689 -1.894 1.00 0.60 C ATOM 0 H THR A 114 10.257 -8.383 1.505 1.00 0.47 H new ATOM 0 HA THR A 114 9.876 -10.414 -0.368 1.00 0.50 H new ATOM 0 HB THR A 114 9.127 -7.470 -0.374 1.00 0.54 H new ATOM 0 HG1 THR A 114 8.156 -8.545 1.358 1.00 0.62 H new ATOM 0 HG21 THR A 114 7.358 -8.083 -1.981 1.00 0.60 H new ATOM 0 HG22 THR A 114 8.985 -8.370 -2.643 1.00 0.60 H new ATOM 0 HG23 THR A 114 8.010 -9.738 -2.055 1.00 0.60 H new ATOM 1923 N ILE A 115 11.856 -7.967 -1.369 1.00 0.43 N ATOM 1924 CA ILE A 115 12.747 -7.539 -2.444 1.00 0.41 C ATOM 1925 C ILE A 115 13.994 -8.417 -2.513 1.00 0.42 C ATOM 1926 O ILE A 115 14.400 -8.840 -3.596 1.00 0.43 O ATOM 1927 CB ILE A 115 13.171 -6.063 -2.279 1.00 0.40 C ATOM 1928 CG1 ILE A 115 11.938 -5.155 -2.275 1.00 0.42 C ATOM 1929 CG2 ILE A 115 14.126 -5.655 -3.393 1.00 0.42 C ATOM 1930 CD1 ILE A 115 12.252 -3.701 -1.997 1.00 0.44 C ATOM 0 H ILE A 115 11.861 -7.361 -0.549 1.00 0.43 H new ATOM 0 HA ILE A 115 12.186 -7.641 -3.373 1.00 0.41 H new ATOM 0 HB ILE A 115 13.688 -5.955 -1.325 1.00 0.40 H new ATOM 0 HG12 ILE A 115 11.439 -5.231 -3.241 1.00 0.42 H new ATOM 0 HG13 ILE A 115 11.235 -5.515 -1.524 1.00 0.42 H new ATOM 0 HG21 ILE A 115 14.415 -4.612 -3.261 1.00 0.42 H new ATOM 0 HG22 ILE A 115 15.015 -6.285 -3.359 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.633 -5.776 -4.357 1.00 0.42 H new ATOM 0 HD11 ILE A 115 11.330 -3.121 -2.010 1.00 0.44 H new ATOM 0 HD12 ILE A 115 12.723 -3.611 -1.018 1.00 0.44 H new ATOM 0 HD13 ILE A 115 12.930 -3.322 -2.762 1.00 0.44 H new ATOM 1942 N CYS A 116 14.594 -8.706 -1.361 1.00 0.43 N ATOM 1943 CA CYS A 116 15.802 -9.525 -1.327 1.00 0.47 C ATOM 1944 C CYS A 116 15.505 -10.930 -1.844 1.00 0.50 C ATOM 1945 O CYS A 116 16.372 -11.592 -2.412 1.00 0.53 O ATOM 1946 CB CYS A 116 16.390 -9.596 0.088 1.00 0.51 C ATOM 1947 SG CYS A 116 15.364 -10.476 1.293 1.00 1.56 S ATOM 0 H CYS A 116 14.268 -8.389 -0.448 1.00 0.43 H new ATOM 0 HA CYS A 116 16.541 -9.055 -1.976 1.00 0.47 H new ATOM 0 HB2 CYS A 116 17.364 -10.082 0.037 1.00 0.51 H new ATOM 0 HB3 CYS A 116 16.559 -8.581 0.448 1.00 0.51 H new ATOM 0 HG CYS A 116 14.187 -10.692 0.785 1.00 1.56 H new ATOM 1953 N ALA A 117 14.265 -11.369 -1.658 1.00 0.50 N ATOM 1954 CA ALA A 117 13.830 -12.671 -2.139 1.00 0.54 C ATOM 1955 C ALA A 117 13.687 -12.663 -3.657 1.00 0.54 C ATOM 1956 O ALA A 117 13.843 -13.696 -4.308 1.00 0.58 O ATOM 1957 CB ALA A 117 12.515 -13.067 -1.485 1.00 0.57 C ATOM 0 H ALA A 117 13.541 -10.837 -1.174 1.00 0.50 H new ATOM 0 HA ALA A 117 14.588 -13.407 -1.869 1.00 0.54 H new ATOM 0 HB1 ALA A 117 12.204 -14.044 -1.856 1.00 0.57 H new ATOM 0 HB2 ALA A 117 12.646 -13.114 -0.404 1.00 0.57 H new ATOM 0 HB3 ALA A 117 11.752 -12.327 -1.726 1.00 0.57 H new ATOM 1963 N ARG A 118 13.405 -11.488 -4.215 1.00 0.50 N ATOM 1964 CA ARG A 118 13.278 -11.341 -5.660 1.00 0.51 C ATOM 1965 C ARG A 118 14.630 -11.541 -6.331 1.00 0.52 C ATOM 1966 O ARG A 118 14.726 -12.198 -7.366 1.00 0.55 O ATOM 1967 CB ARG A 118 12.717 -9.960 -6.038 1.00 0.49 C ATOM 1968 CG ARG A 118 11.372 -9.643 -5.407 1.00 0.49 C ATOM 1969 CD ARG A 118 10.290 -10.607 -5.862 1.00 0.58 C ATOM 1970 NE ARG A 118 10.040 -10.517 -7.300 1.00 0.84 N ATOM 1971 CZ ARG A 118 8.823 -10.495 -7.846 1.00 1.16 C ATOM 1972 NH1 ARG A 118 7.739 -10.580 -7.081 1.00 1.23 N ATOM 1973 NH2 ARG A 118 8.692 -10.398 -9.164 1.00 1.75 N ATOM 0 H ARG A 118 13.261 -10.626 -3.688 1.00 0.50 H new ATOM 0 HA ARG A 118 12.580 -12.102 -6.008 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.435 -9.195 -5.742 1.00 0.49 H new ATOM 0 HB3 ARG A 118 12.620 -9.903 -7.122 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.462 -9.685 -4.321 1.00 0.49 H new ATOM 0 HG3 ARG A 118 11.082 -8.624 -5.664 1.00 0.49 H new ATOM 0 HD2 ARG A 118 10.583 -11.626 -5.609 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.368 -10.397 -5.321 1.00 0.58 H new ATOM 0 HE ARG A 118 10.846 -10.468 -7.924 1.00 0.84 H new ATOM 0 HH11 ARG A 118 7.834 -10.663 -6.069 1.00 1.23 H new ATOM 0 HH12 ARG A 118 6.812 -10.562 -7.506 1.00 1.23 H new ATOM 0 HH21 ARG A 118 9.521 -10.341 -9.756 1.00 1.75 H new ATOM 0 HH22 ARG A 118 7.763 -10.381 -9.584 1.00 1.75 H new ATOM 1987 N ILE A 119 15.674 -10.977 -5.728 1.00 0.52 N ATOM 1988 CA ILE A 119 17.017 -11.051 -6.293 1.00 0.54 C ATOM 1989 C ILE A 119 17.676 -12.382 -5.946 1.00 0.58 C ATOM 1990 O ILE A 119 18.499 -12.900 -6.702 1.00 0.66 O ATOM 1991 CB ILE A 119 17.931 -9.921 -5.758 1.00 0.51 C ATOM 1992 CG1 ILE A 119 17.115 -8.695 -5.336 1.00 0.49 C ATOM 1993 CG2 ILE A 119 18.952 -9.530 -6.817 1.00 0.56 C ATOM 1994 CD1 ILE A 119 16.421 -7.991 -6.479 1.00 0.69 C ATOM 0 H ILE A 119 15.615 -10.464 -4.848 1.00 0.52 H new ATOM 0 HA ILE A 119 16.903 -10.947 -7.372 1.00 0.54 H new ATOM 0 HB ILE A 119 18.451 -10.298 -4.877 1.00 0.51 H new ATOM 0 HG12 ILE A 119 16.367 -9.004 -4.606 1.00 0.49 H new ATOM 0 HG13 ILE A 119 17.776 -7.987 -4.835 1.00 0.49 H new ATOM 0 HG21 ILE A 119 19.590 -8.735 -6.431 1.00 0.56 H new ATOM 0 HG22 ILE A 119 19.564 -10.396 -7.070 1.00 0.56 H new ATOM 0 HG23 ILE A 119 18.434 -9.179 -7.710 1.00 0.56 H new ATOM 0 HD11 ILE A 119 15.866 -7.135 -6.096 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.163 -7.649 -7.200 1.00 0.69 H new ATOM 0 HD13 ILE A 119 15.733 -8.681 -6.967 1.00 0.69 H new ATOM 2006 N GLY A 120 17.312 -12.926 -4.794 1.00 0.57 N ATOM 2007 CA GLY A 120 17.948 -14.136 -4.314 1.00 0.62 C ATOM 2008 C GLY A 120 19.029 -13.831 -3.296 1.00 0.64 C ATOM 2009 O GLY A 120 20.031 -14.538 -3.202 1.00 0.70 O ATOM 0 H GLY A 120 16.587 -12.551 -4.182 1.00 0.57 H new ATOM 0 HA2 GLY A 120 17.199 -14.789 -3.866 1.00 0.62 H new ATOM 0 HA3 GLY A 120 18.381 -14.678 -5.154 1.00 0.62 H new ATOM 2013 N ILE A 121 18.821 -12.764 -2.539 1.00 0.66 N ATOM 2014 CA ILE A 121 19.772 -12.336 -1.523 1.00 0.71 C ATOM 2015 C ILE A 121 19.545 -13.105 -0.220 1.00 0.82 C ATOM 2016 O ILE A 121 20.487 -13.370 0.529 1.00 1.54 O ATOM 2017 CB ILE A 121 19.654 -10.816 -1.267 1.00 0.63 C ATOM 2018 CG1 ILE A 121 19.947 -10.033 -2.552 1.00 0.59 C ATOM 2019 CG2 ILE A 121 20.589 -10.377 -0.151 1.00 0.67 C ATOM 2020 CD1 ILE A 121 19.769 -8.535 -2.406 1.00 0.56 C ATOM 0 H ILE A 121 17.993 -12.173 -2.611 1.00 0.66 H new ATOM 0 HA ILE A 121 20.776 -12.550 -1.889 1.00 0.71 H new ATOM 0 HB ILE A 121 18.632 -10.603 -0.954 1.00 0.63 H new ATOM 0 HG12 ILE A 121 20.970 -10.239 -2.868 1.00 0.59 H new ATOM 0 HG13 ILE A 121 19.290 -10.393 -3.344 1.00 0.59 H new ATOM 0 HG21 ILE A 121 20.486 -9.304 0.009 1.00 0.67 H new ATOM 0 HG22 ILE A 121 20.334 -10.907 0.767 1.00 0.67 H new ATOM 0 HG23 ILE A 121 21.618 -10.606 -0.428 1.00 0.67 H new ATOM 0 HD11 ILE A 121 19.994 -8.048 -3.355 1.00 0.56 H new ATOM 0 HD12 ILE A 121 18.740 -8.317 -2.121 1.00 0.56 H new ATOM 0 HD13 ILE A 121 20.445 -8.161 -1.637 1.00 0.56 H new ATOM 2032 N THR A 122 18.283 -13.462 0.030 1.00 0.96 N ATOM 2033 CA THR A 122 17.900 -14.273 1.189 1.00 1.00 C ATOM 2034 C THR A 122 17.939 -13.474 2.499 1.00 0.90 C ATOM 2035 O THR A 122 16.914 -13.317 3.168 1.00 1.04 O ATOM 2036 CB THR A 122 18.789 -15.530 1.314 1.00 1.18 C ATOM 2037 OG1 THR A 122 18.802 -16.243 0.069 1.00 1.55 O ATOM 2038 CG2 THR A 122 18.288 -16.447 2.419 1.00 1.65 C ATOM 0 H THR A 122 17.498 -13.197 -0.565 1.00 0.96 H new ATOM 0 HA THR A 122 16.869 -14.584 1.017 1.00 1.00 H new ATOM 0 HB THR A 122 19.800 -15.207 1.564 1.00 1.18 H new ATOM 0 HG1 THR A 122 19.369 -17.038 0.153 1.00 1.55 H new ATOM 0 HG21 THR A 122 18.932 -17.324 2.485 1.00 1.65 H new ATOM 0 HG22 THR A 122 18.303 -15.914 3.369 1.00 1.65 H new ATOM 0 HG23 THR A 122 17.269 -16.762 2.196 1.00 1.65 H new ATOM 2046 N ASN A 123 19.112 -12.971 2.865 1.00 0.91 N ATOM 2047 CA ASN A 123 19.263 -12.221 4.108 1.00 0.87 C ATOM 2048 C ASN A 123 19.004 -10.747 3.853 1.00 0.77 C ATOM 2049 O ASN A 123 19.566 -10.167 2.930 1.00 1.05 O ATOM 2050 CB ASN A 123 20.663 -12.415 4.694 1.00 1.10 C ATOM 2051 CG ASN A 123 20.708 -12.118 6.183 1.00 1.31 C ATOM 2052 OD1 ASN A 123 19.740 -12.352 6.902 1.00 2.13 O ATOM 2053 ND2 ASN A 123 21.825 -11.596 6.655 1.00 1.50 N ATOM 0 H ASN A 123 19.970 -13.068 2.322 1.00 0.91 H new ATOM 0 HA ASN A 123 18.537 -12.595 4.829 1.00 0.87 H new ATOM 0 HB2 ASN A 123 20.989 -13.440 4.520 1.00 1.10 H new ATOM 0 HB3 ASN A 123 21.366 -11.764 4.174 1.00 1.10 H new ATOM 0 HD21 ASN A 123 21.904 -11.373 7.647 1.00 1.50 H new ATOM 0 HD22 ASN A 123 22.609 -11.415 6.027 1.00 1.50 H new ATOM 2060 N HIS A 124 18.146 -10.144 4.662 1.00 0.61 N ATOM 2061 CA HIS A 124 17.769 -8.752 4.447 1.00 0.59 C ATOM 2062 C HIS A 124 17.940 -7.923 5.711 1.00 0.57 C ATOM 2063 O HIS A 124 17.799 -6.702 5.683 1.00 0.66 O ATOM 2064 CB HIS A 124 16.321 -8.649 3.946 1.00 0.63 C ATOM 2065 CG HIS A 124 15.302 -9.250 4.868 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.544 -8.506 5.744 1.00 0.55 N ATOM 2067 CD2 HIS A 124 14.910 -10.533 5.036 1.00 0.66 C ATOM 2068 CE1 HIS A 124 13.734 -9.304 6.410 1.00 0.57 C ATOM 2069 NE2 HIS A 124 13.935 -10.542 6.001 1.00 0.66 N ATOM 0 H HIS A 124 17.701 -10.589 5.465 1.00 0.61 H new ATOM 0 HA HIS A 124 18.437 -8.352 3.685 1.00 0.59 H new ATOM 0 HB2 HIS A 124 16.077 -7.598 3.790 1.00 0.63 H new ATOM 0 HB3 HIS A 124 16.249 -9.140 2.975 1.00 0.63 H new ATOM 0 HD1 HIS A 124 14.601 -7.494 5.860 1.00 0.55 H new ATOM 0 HD2 HIS A 124 15.294 -11.393 4.507 1.00 0.66 H new ATOM 0 HE1 HIS A 124 13.025 -8.996 7.164 1.00 0.57 H new ATOM 2078 N ASP A 125 18.251 -8.580 6.818 1.00 0.62 N ATOM 2079 CA ASP A 125 18.365 -7.896 8.099 1.00 0.72 C ATOM 2080 C ASP A 125 19.619 -7.030 8.135 1.00 0.64 C ATOM 2081 O ASP A 125 19.714 -6.081 8.910 1.00 0.66 O ATOM 2082 CB ASP A 125 18.386 -8.911 9.243 1.00 0.97 C ATOM 2083 CG ASP A 125 18.297 -8.252 10.604 1.00 1.54 C ATOM 2084 OD1 ASP A 125 17.197 -7.801 10.984 1.00 2.14 O ATOM 2085 OD2 ASP A 125 19.334 -8.171 11.297 1.00 2.11 O ATOM 0 H ASP A 125 18.429 -9.584 6.856 1.00 0.62 H new ATOM 0 HA ASP A 125 17.497 -7.249 8.223 1.00 0.72 H new ATOM 0 HB2 ASP A 125 17.554 -9.605 9.124 1.00 0.97 H new ATOM 0 HB3 ASP A 125 19.302 -9.499 9.186 1.00 0.97 H new ATOM 2090 N GLU A 126 20.564 -7.342 7.257 1.00 0.62 N ATOM 2091 CA GLU A 126 21.829 -6.628 7.216 1.00 0.62 C ATOM 2092 C GLU A 126 21.790 -5.466 6.229 1.00 0.52 C ATOM 2093 O GLU A 126 22.827 -4.901 5.881 1.00 0.61 O ATOM 2094 CB GLU A 126 22.973 -7.582 6.867 1.00 0.76 C ATOM 2095 CG GLU A 126 22.712 -8.455 5.648 1.00 1.19 C ATOM 2096 CD GLU A 126 23.936 -9.246 5.240 1.00 1.84 C ATOM 2097 OE1 GLU A 126 24.956 -8.632 4.873 1.00 2.27 O ATOM 2098 OE2 GLU A 126 23.888 -10.493 5.299 1.00 2.30 O ATOM 0 H GLU A 126 20.476 -8.086 6.564 1.00 0.62 H new ATOM 0 HA GLU A 126 22.003 -6.214 8.209 1.00 0.62 H new ATOM 0 HB2 GLU A 126 23.877 -6.998 6.694 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.168 -8.225 7.725 1.00 0.76 H new ATOM 0 HG2 GLU A 126 21.893 -9.141 5.863 1.00 1.19 H new ATOM 0 HG3 GLU A 126 22.392 -7.828 4.816 1.00 1.19 H new ATOM 2105 N TYR A 127 20.595 -5.095 5.795 1.00 0.43 N ATOM 2106 CA TYR A 127 20.435 -3.984 4.868 1.00 0.38 C ATOM 2107 C TYR A 127 19.448 -2.969 5.414 1.00 0.39 C ATOM 2108 O TYR A 127 18.520 -3.326 6.136 1.00 0.42 O ATOM 2109 CB TYR A 127 19.926 -4.471 3.512 1.00 0.36 C ATOM 2110 CG TYR A 127 20.819 -5.470 2.830 1.00 0.36 C ATOM 2111 CD1 TYR A 127 22.014 -5.082 2.255 1.00 0.38 C ATOM 2112 CD2 TYR A 127 20.455 -6.801 2.755 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.828 -5.994 1.622 1.00 0.41 C ATOM 2114 CE2 TYR A 127 21.258 -7.725 2.126 1.00 0.43 C ATOM 2115 CZ TYR A 127 22.448 -7.320 1.559 1.00 0.43 C ATOM 2116 OH TYR A 127 23.258 -8.238 0.927 1.00 0.49 O ATOM 0 H TYR A 127 19.722 -5.546 6.069 1.00 0.43 H new ATOM 0 HA TYR A 127 21.414 -3.521 4.746 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.941 -4.917 3.647 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.799 -3.610 2.856 1.00 0.36 H new ATOM 0 HD1 TYR A 127 22.314 -4.046 2.303 1.00 0.38 H new ATOM 0 HD2 TYR A 127 19.524 -7.122 3.198 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.759 -5.674 1.177 1.00 0.41 H new ATOM 0 HE2 TYR A 127 20.958 -8.761 2.077 1.00 0.43 H new ATOM 0 HH TYR A 127 22.845 -9.125 0.973 1.00 0.49 H new ATOM 2126 N SER A 128 19.652 -1.712 5.069 1.00 0.40 N ATOM 2127 CA SER A 128 18.690 -0.666 5.365 1.00 0.42 C ATOM 2128 C SER A 128 18.139 -0.128 4.053 1.00 0.41 C ATOM 2129 O SER A 128 18.617 -0.509 2.981 1.00 0.54 O ATOM 2130 CB SER A 128 19.347 0.455 6.169 1.00 0.47 C ATOM 2131 OG SER A 128 19.892 -0.043 7.376 1.00 1.13 O ATOM 0 H SER A 128 20.485 -1.387 4.578 1.00 0.40 H new ATOM 0 HA SER A 128 17.877 -1.074 5.966 1.00 0.42 H new ATOM 0 HB2 SER A 128 20.133 0.921 5.575 1.00 0.47 H new ATOM 0 HB3 SER A 128 18.612 1.229 6.389 1.00 0.47 H new ATOM 0 HG SER A 128 20.309 0.691 7.874 1.00 1.13 H new ATOM 2137 N LEU A 129 17.146 0.743 4.112 1.00 0.42 N ATOM 2138 CA LEU A 129 16.593 1.279 2.879 1.00 0.42 C ATOM 2139 C LEU A 129 16.855 2.772 2.820 1.00 0.43 C ATOM 2140 O LEU A 129 16.869 3.434 3.844 1.00 0.48 O ATOM 2141 CB LEU A 129 15.092 0.966 2.783 1.00 0.43 C ATOM 2142 CG LEU A 129 14.556 0.714 1.365 1.00 0.45 C ATOM 2143 CD1 LEU A 129 13.219 -0.004 1.424 1.00 1.33 C ATOM 2144 CD2 LEU A 129 14.409 2.014 0.590 1.00 1.13 C ATOM 0 H LEU A 129 16.717 1.086 4.971 1.00 0.42 H new ATOM 0 HA LEU A 129 17.078 0.808 2.024 1.00 0.42 H new ATOM 0 HB2 LEU A 129 14.883 0.087 3.393 1.00 0.43 H new ATOM 0 HB3 LEU A 129 14.537 1.796 3.220 1.00 0.43 H new ATOM 0 HG LEU A 129 15.279 0.086 0.845 1.00 0.45 H new ATOM 0 HD11 LEU A 129 12.853 -0.175 0.412 1.00 1.33 H new ATOM 0 HD12 LEU A 129 13.342 -0.961 1.932 1.00 1.33 H new ATOM 0 HD13 LEU A 129 12.501 0.608 1.971 1.00 1.33 H new ATOM 0 HD21 LEU A 129 14.028 1.801 -0.409 1.00 1.13 H new ATOM 0 HD22 LEU A 129 13.713 2.672 1.111 1.00 1.13 H new ATOM 0 HD23 LEU A 129 15.380 2.502 0.511 1.00 1.13 H new ATOM 2156 N VAL A 130 17.101 3.289 1.631 1.00 0.42 N ATOM 2157 CA VAL A 130 17.336 4.711 1.451 1.00 0.46 C ATOM 2158 C VAL A 130 16.634 5.201 0.193 1.00 0.46 C ATOM 2159 O VAL A 130 16.922 4.749 -0.918 1.00 0.45 O ATOM 2160 CB VAL A 130 18.852 5.035 1.401 1.00 0.48 C ATOM 2161 CG1 VAL A 130 19.589 4.010 0.576 1.00 0.49 C ATOM 2162 CG2 VAL A 130 19.119 6.424 0.846 1.00 0.60 C ATOM 0 H VAL A 130 17.144 2.743 0.771 1.00 0.42 H new ATOM 0 HA VAL A 130 16.921 5.236 2.312 1.00 0.46 H new ATOM 0 HB VAL A 130 19.217 5.005 2.428 1.00 0.48 H new ATOM 0 HG11 VAL A 130 20.651 4.256 0.554 1.00 0.49 H new ATOM 0 HG12 VAL A 130 19.454 3.023 1.017 1.00 0.49 H new ATOM 0 HG13 VAL A 130 19.195 4.010 -0.440 1.00 0.49 H new ATOM 0 HG21 VAL A 130 20.193 6.609 0.829 1.00 0.60 H new ATOM 0 HG22 VAL A 130 18.723 6.493 -0.167 1.00 0.60 H new ATOM 0 HG23 VAL A 130 18.633 7.168 1.477 1.00 0.60 H new ATOM 2172 N ARG A 131 15.681 6.096 0.373 1.00 0.48 N ATOM 2173 CA ARG A 131 14.945 6.639 -0.748 1.00 0.50 C ATOM 2174 C ARG A 131 15.495 7.993 -1.140 1.00 0.57 C ATOM 2175 O ARG A 131 15.198 9.003 -0.494 1.00 0.64 O ATOM 2176 CB ARG A 131 13.476 6.823 -0.392 1.00 0.54 C ATOM 2177 CG ARG A 131 12.750 5.560 0.015 1.00 0.51 C ATOM 2178 CD ARG A 131 11.279 5.859 0.214 1.00 0.62 C ATOM 2179 NE ARG A 131 10.684 6.448 -0.989 1.00 0.96 N ATOM 2180 CZ ARG A 131 9.739 5.873 -1.733 1.00 1.65 C ATOM 2181 NH1 ARG A 131 9.290 4.659 -1.433 1.00 2.18 N ATOM 2182 NH2 ARG A 131 9.244 6.522 -2.780 1.00 2.01 N ATOM 0 H ARG A 131 15.400 6.460 1.283 1.00 0.48 H new ATOM 0 HA ARG A 131 15.047 5.934 -1.573 1.00 0.50 H new ATOM 0 HB2 ARG A 131 13.403 7.544 0.423 1.00 0.54 H new ATOM 0 HB3 ARG A 131 12.962 7.258 -1.249 1.00 0.54 H new ATOM 0 HG2 ARG A 131 12.875 4.794 -0.751 1.00 0.51 H new ATOM 0 HG3 ARG A 131 13.178 5.163 0.936 1.00 0.51 H new ATOM 0 HD2 ARG A 131 10.751 4.940 0.470 1.00 0.62 H new ATOM 0 HD3 ARG A 131 11.156 6.542 1.054 1.00 0.62 H new ATOM 0 HE ARG A 131 11.018 7.367 -1.279 1.00 0.96 H new ATOM 0 HH11 ARG A 131 9.669 4.160 -0.628 1.00 2.18 H new ATOM 0 HH12 ARG A 131 8.567 4.226 -2.008 1.00 2.18 H new ATOM 0 HH21 ARG A 131 9.587 7.454 -3.011 1.00 2.01 H new ATOM 0 HH22 ARG A 131 8.521 6.088 -3.354 1.00 2.01 H new ATOM 2196 N GLU A 132 16.265 8.027 -2.205 1.00 0.58 N ATOM 2197 CA GLU A 132 16.678 9.294 -2.760 1.00 0.66 C ATOM 2198 C GLU A 132 15.544 9.857 -3.591 1.00 0.73 C ATOM 2199 O GLU A 132 15.153 9.275 -4.608 1.00 0.74 O ATOM 2200 CB GLU A 132 17.936 9.160 -3.615 1.00 0.68 C ATOM 2201 CG GLU A 132 19.169 8.720 -2.853 1.00 0.64 C ATOM 2202 CD GLU A 132 20.431 8.930 -3.661 1.00 0.72 C ATOM 2203 OE1 GLU A 132 20.505 8.410 -4.794 1.00 0.90 O ATOM 2204 OE2 GLU A 132 21.338 9.644 -3.185 1.00 1.05 O ATOM 0 H GLU A 132 16.613 7.204 -2.697 1.00 0.58 H new ATOM 0 HA GLU A 132 16.918 9.968 -1.938 1.00 0.66 H new ATOM 0 HB2 GLU A 132 17.743 8.444 -4.413 1.00 0.68 H new ATOM 0 HB3 GLU A 132 18.141 10.119 -4.090 1.00 0.68 H new ATOM 0 HG2 GLU A 132 19.238 9.278 -1.919 1.00 0.64 H new ATOM 0 HG3 GLU A 132 19.077 7.666 -2.589 1.00 0.64 H new ATOM 2211 N LEU A 133 14.992 10.968 -3.143 1.00 0.80 N ATOM 2212 CA LEU A 133 13.828 11.523 -3.808 1.00 0.87 C ATOM 2213 C LEU A 133 14.186 12.669 -4.737 1.00 0.97 C ATOM 2214 O LEU A 133 15.353 12.965 -4.992 1.00 1.02 O ATOM 2215 CB LEU A 133 12.800 12.026 -2.798 1.00 0.92 C ATOM 2216 CG LEU A 133 12.408 11.050 -1.695 1.00 0.87 C ATOM 2217 CD1 LEU A 133 11.230 11.606 -0.918 1.00 0.97 C ATOM 2218 CD2 LEU A 133 12.072 9.683 -2.261 1.00 0.80 C ATOM 0 H LEU A 133 15.323 11.497 -2.336 1.00 0.80 H new ATOM 0 HA LEU A 133 13.405 10.709 -4.397 1.00 0.87 H new ATOM 0 HB2 LEU A 133 13.191 12.930 -2.332 1.00 0.92 H new ATOM 0 HB3 LEU A 133 11.898 12.311 -3.340 1.00 0.92 H new ATOM 0 HG LEU A 133 13.258 10.928 -1.024 1.00 0.87 H new ATOM 0 HD11 LEU A 133 10.951 10.907 -0.130 1.00 0.97 H new ATOM 0 HD12 LEU A 133 11.506 12.562 -0.474 1.00 0.97 H new ATOM 0 HD13 LEU A 133 10.385 11.749 -1.591 1.00 0.97 H new ATOM 0 HD21 LEU A 133 11.797 9.010 -1.449 1.00 0.80 H new ATOM 0 HD22 LEU A 133 11.238 9.772 -2.957 1.00 0.80 H new ATOM 0 HD23 LEU A 133 12.940 9.283 -2.785 1.00 0.80 H new ATOM 2230 N MET A 134 13.136 13.297 -5.224 1.00 1.04 N ATOM 2231 CA MET A 134 13.212 14.482 -6.062 1.00 1.15 C ATOM 2232 C MET A 134 12.555 15.629 -5.315 1.00 1.22 C ATOM 2233 O MET A 134 12.251 16.681 -5.878 1.00 1.29 O ATOM 2234 CB MET A 134 12.483 14.207 -7.380 1.00 1.27 C ATOM 2235 CG MET A 134 11.156 13.480 -7.185 1.00 1.36 C ATOM 2236 SD MET A 134 9.888 14.503 -6.410 1.00 1.80 S ATOM 2237 CE MET A 134 8.714 13.254 -5.902 1.00 2.03 C ATOM 0 H MET A 134 12.179 12.991 -5.045 1.00 1.04 H new ATOM 0 HA MET A 134 14.247 14.740 -6.286 1.00 1.15 H new ATOM 0 HB2 MET A 134 12.302 15.152 -7.893 1.00 1.27 H new ATOM 0 HB3 MET A 134 13.126 13.611 -8.027 1.00 1.27 H new ATOM 0 HG2 MET A 134 10.793 13.135 -8.153 1.00 1.36 H new ATOM 0 HG3 MET A 134 11.322 12.594 -6.573 1.00 1.36 H new ATOM 0 HE1 MET A 134 7.701 13.641 -6.011 1.00 2.03 H new ATOM 0 HE2 MET A 134 8.833 12.368 -6.525 1.00 2.03 H new ATOM 0 HE3 MET A 134 8.891 12.991 -4.859 1.00 2.03 H new ATOM 2247 N GLU A 135 12.365 15.385 -4.025 1.00 1.27 N ATOM 2248 CA GLU A 135 11.555 16.219 -3.151 1.00 1.39 C ATOM 2249 C GLU A 135 11.910 17.692 -3.215 1.00 1.41 C ATOM 2250 O GLU A 135 13.068 18.078 -3.067 1.00 1.45 O ATOM 2251 CB GLU A 135 11.703 15.740 -1.718 1.00 1.48 C ATOM 2252 CG GLU A 135 10.484 15.023 -1.183 1.00 1.58 C ATOM 2253 CD GLU A 135 9.346 15.981 -0.923 1.00 1.83 C ATOM 2254 OE1 GLU A 135 8.688 16.410 -1.888 1.00 2.29 O ATOM 2255 OE2 GLU A 135 9.122 16.319 0.256 1.00 2.04 O ATOM 0 H GLU A 135 12.779 14.584 -3.548 1.00 1.27 H new ATOM 0 HA GLU A 135 10.527 16.124 -3.499 1.00 1.39 H new ATOM 0 HB2 GLU A 135 12.562 15.072 -1.655 1.00 1.48 H new ATOM 0 HB3 GLU A 135 11.918 16.597 -1.079 1.00 1.48 H new ATOM 0 HG2 GLU A 135 10.165 14.263 -1.897 1.00 1.58 H new ATOM 0 HG3 GLU A 135 10.742 14.504 -0.260 1.00 1.58 H new ATOM 2262 N GLU A 136 10.889 18.504 -3.422 1.00 1.46 N ATOM 2263 CA GLU A 136 11.026 19.942 -3.359 1.00 1.52 C ATOM 2264 C GLU A 136 10.808 20.427 -1.927 1.00 1.52 C ATOM 2265 O GLU A 136 11.141 21.560 -1.582 1.00 1.59 O ATOM 2266 CB GLU A 136 10.009 20.587 -4.296 1.00 1.67 C ATOM 2267 CG GLU A 136 8.565 20.381 -3.866 1.00 1.73 C ATOM 2268 CD GLU A 136 7.581 21.048 -4.798 1.00 1.93 C ATOM 2269 OE1 GLU A 136 7.362 22.270 -4.666 1.00 2.12 O ATOM 2270 OE2 GLU A 136 7.024 20.355 -5.674 1.00 1.99 O ATOM 0 H GLU A 136 9.945 18.183 -3.638 1.00 1.46 H new ATOM 0 HA GLU A 136 12.032 20.225 -3.670 1.00 1.52 H new ATOM 0 HB2 GLU A 136 10.212 21.656 -4.357 1.00 1.67 H new ATOM 0 HB3 GLU A 136 10.142 20.180 -5.298 1.00 1.67 H new ATOM 0 HG2 GLU A 136 8.352 19.313 -3.822 1.00 1.73 H new ATOM 0 HG3 GLU A 136 8.430 20.775 -2.859 1.00 1.73 H new ATOM 2277 N LYS A 137 10.235 19.557 -1.100 1.00 1.53 N ATOM 2278 CA LYS A 137 9.932 19.899 0.283 1.00 1.61 C ATOM 2279 C LYS A 137 10.996 19.357 1.231 1.00 1.55 C ATOM 2280 O LYS A 137 11.829 20.109 1.729 1.00 1.63 O ATOM 2281 CB LYS A 137 8.556 19.358 0.669 1.00 1.72 C ATOM 2282 CG LYS A 137 7.420 19.973 -0.129 1.00 1.83 C ATOM 2283 CD LYS A 137 6.095 19.295 0.172 1.00 2.14 C ATOM 2284 CE LYS A 137 4.943 20.020 -0.502 1.00 2.31 C ATOM 2285 NZ LYS A 137 4.688 21.351 0.113 1.00 2.98 N ATOM 0 H LYS A 137 9.971 18.608 -1.366 1.00 1.53 H new ATOM 0 HA LYS A 137 9.926 20.986 0.369 1.00 1.61 H new ATOM 0 HB2 LYS A 137 8.546 18.277 0.527 1.00 1.72 H new ATOM 0 HB3 LYS A 137 8.386 19.542 1.730 1.00 1.72 H new ATOM 0 HG2 LYS A 137 7.346 21.036 0.101 1.00 1.83 H new ATOM 0 HG3 LYS A 137 7.637 19.892 -1.194 1.00 1.83 H new ATOM 0 HD2 LYS A 137 6.127 18.260 -0.169 1.00 2.14 H new ATOM 0 HD3 LYS A 137 5.932 19.270 1.250 1.00 2.14 H new ATOM 0 HE2 LYS A 137 5.164 20.146 -1.562 1.00 2.31 H new ATOM 0 HE3 LYS A 137 4.042 19.411 -0.435 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 3.772 21.716 -0.218 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 4.670 21.257 1.149 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 5.443 22.011 -0.162 1.00 2.98 H new ATOM 2299 N LYS A 138 10.967 18.047 1.470 1.00 1.47 N ATOM 2300 CA LYS A 138 11.923 17.411 2.377 1.00 1.45 C ATOM 2301 C LYS A 138 13.333 17.500 1.830 1.00 1.34 C ATOM 2302 O LYS A 138 14.200 18.166 2.399 1.00 1.43 O ATOM 2303 CB LYS A 138 11.573 15.934 2.583 1.00 1.48 C ATOM 2304 CG LYS A 138 10.219 15.721 3.215 1.00 1.52 C ATOM 2305 CD LYS A 138 9.910 14.246 3.420 1.00 1.58 C ATOM 2306 CE LYS A 138 9.401 13.582 2.149 1.00 1.42 C ATOM 2307 NZ LYS A 138 8.178 14.249 1.619 1.00 1.76 N ATOM 0 H LYS A 138 10.294 17.406 1.050 1.00 1.47 H new ATOM 0 HA LYS A 138 11.868 17.940 3.328 1.00 1.45 H new ATOM 0 HB2 LYS A 138 11.600 15.424 1.620 1.00 1.48 H new ATOM 0 HB3 LYS A 138 12.335 15.472 3.210 1.00 1.48 H new ATOM 0 HG2 LYS A 138 10.182 16.236 4.175 1.00 1.52 H new ATOM 0 HG3 LYS A 138 9.450 16.168 2.584 1.00 1.52 H new ATOM 0 HD2 LYS A 138 10.809 13.732 3.761 1.00 1.58 H new ATOM 0 HD3 LYS A 138 9.164 14.139 4.207 1.00 1.58 H new ATOM 0 HE2 LYS A 138 10.183 13.605 1.390 1.00 1.42 H new ATOM 0 HE3 LYS A 138 9.183 12.533 2.351 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 7.779 13.679 0.847 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 7.475 14.341 2.380 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 8.425 15.193 1.260 1.00 1.76 H new ATOM 2321 N ASP A 169 13.527 16.824 0.709 1.00 1.23 N ATOM 2322 CA ASP A 169 14.826 16.660 0.091 1.00 1.18 C ATOM 2323 C ASP A 169 15.735 15.887 1.020 1.00 1.11 C ATOM 2324 O ASP A 169 16.544 16.449 1.761 1.00 1.30 O ATOM 2325 CB ASP A 169 15.431 18.003 -0.322 1.00 1.35 C ATOM 2326 CG ASP A 169 16.834 17.873 -0.884 1.00 1.44 C ATOM 2327 OD1 ASP A 169 17.001 17.187 -1.915 1.00 1.48 O ATOM 2328 OD2 ASP A 169 17.773 18.461 -0.307 1.00 1.59 O ATOM 0 H ASP A 169 12.772 16.368 0.197 1.00 1.23 H new ATOM 0 HA ASP A 169 14.707 16.087 -0.829 1.00 1.18 H new ATOM 0 HB2 ASP A 169 14.789 18.471 -1.068 1.00 1.35 H new ATOM 0 HB3 ASP A 169 15.452 18.667 0.542 1.00 1.35 H new ATOM 2333 N GLU A 170 15.557 14.583 0.992 1.00 0.96 N ATOM 2334 CA GLU A 170 16.216 13.706 1.929 1.00 0.90 C ATOM 2335 C GLU A 170 16.658 12.420 1.252 1.00 0.78 C ATOM 2336 O GLU A 170 16.171 12.061 0.166 1.00 0.77 O ATOM 2337 CB GLU A 170 15.265 13.390 3.086 1.00 0.98 C ATOM 2338 CG GLU A 170 15.761 13.872 4.437 1.00 1.24 C ATOM 2339 CD GLU A 170 16.806 12.954 5.039 1.00 1.90 C ATOM 2340 OE1 GLU A 170 17.875 12.769 4.420 1.00 2.57 O ATOM 2341 OE2 GLU A 170 16.557 12.411 6.134 1.00 2.27 O ATOM 0 H GLU A 170 14.954 14.106 0.322 1.00 0.96 H new ATOM 0 HA GLU A 170 17.104 14.208 2.312 1.00 0.90 H new ATOM 0 HB2 GLU A 170 14.296 13.845 2.882 1.00 0.98 H new ATOM 0 HB3 GLU A 170 15.108 12.312 3.131 1.00 0.98 H new ATOM 0 HG2 GLU A 170 16.181 14.872 4.329 1.00 1.24 H new ATOM 0 HG3 GLU A 170 14.917 13.953 5.122 1.00 1.24 H new ATOM 2348 N LEU A 171 17.582 11.739 1.912 1.00 0.73 N ATOM 2349 CA LEU A 171 18.050 10.441 1.475 1.00 0.67 C ATOM 2350 C LEU A 171 17.049 9.397 1.907 1.00 0.62 C ATOM 2351 O LEU A 171 17.023 8.297 1.387 1.00 0.57 O ATOM 2352 CB LEU A 171 19.413 10.140 2.095 1.00 0.71 C ATOM 2353 CG LEU A 171 20.454 11.232 1.897 1.00 0.77 C ATOM 2354 CD1 LEU A 171 21.766 10.856 2.566 1.00 0.86 C ATOM 2355 CD2 LEU A 171 20.656 11.489 0.415 1.00 0.74 C ATOM 0 H LEU A 171 18.027 12.075 2.766 1.00 0.73 H new ATOM 0 HA LEU A 171 18.153 10.432 0.390 1.00 0.67 H new ATOM 0 HB2 LEU A 171 19.282 9.971 3.164 1.00 0.71 H new ATOM 0 HB3 LEU A 171 19.794 9.212 1.670 1.00 0.71 H new ATOM 0 HG LEU A 171 20.094 12.148 2.365 1.00 0.77 H new ATOM 0 HD11 LEU A 171 22.495 11.652 2.411 1.00 0.86 H new ATOM 0 HD12 LEU A 171 21.603 10.717 3.635 1.00 0.86 H new ATOM 0 HD13 LEU A 171 22.143 9.929 2.133 1.00 0.86 H new ATOM 0 HD21 LEU A 171 21.402 12.272 0.280 1.00 0.74 H new ATOM 0 HD22 LEU A 171 20.998 10.574 -0.070 1.00 0.74 H new ATOM 0 HD23 LEU A 171 19.713 11.806 -0.031 1.00 0.74 H new ATOM 2367 N ASN A 172 16.225 9.783 2.870 1.00 0.65 N ATOM 2368 CA ASN A 172 15.180 8.926 3.406 1.00 0.63 C ATOM 2369 C ASN A 172 15.707 7.537 3.715 1.00 0.57 C ATOM 2370 O ASN A 172 15.384 6.572 3.019 1.00 0.53 O ATOM 2371 CB ASN A 172 14.001 8.828 2.436 1.00 0.65 C ATOM 2372 CG ASN A 172 13.270 10.140 2.280 1.00 0.75 C ATOM 2373 OD1 ASN A 172 12.468 10.527 3.123 1.00 0.90 O ATOM 2374 ND2 ASN A 172 13.507 10.806 1.170 1.00 0.80 N ATOM 0 H ASN A 172 16.264 10.705 3.304 1.00 0.65 H new ATOM 0 HA ASN A 172 14.836 9.380 4.336 1.00 0.63 H new ATOM 0 HB2 ASN A 172 14.363 8.499 1.462 1.00 0.65 H new ATOM 0 HB3 ASN A 172 13.305 8.068 2.791 1.00 0.65 H new ATOM 0 HD21 ASN A 172 13.015 11.680 0.985 1.00 0.80 H new ATOM 0 HD22 ASN A 172 14.183 10.448 0.495 1.00 0.80 H new ATOM 2381 N TRP A 173 16.498 7.428 4.763 1.00 0.58 N ATOM 2382 CA TRP A 173 17.050 6.156 5.156 1.00 0.55 C ATOM 2383 C TRP A 173 16.045 5.456 6.055 1.00 0.54 C ATOM 2384 O TRP A 173 16.008 5.689 7.264 1.00 0.61 O ATOM 2385 CB TRP A 173 18.385 6.353 5.883 1.00 0.60 C ATOM 2386 CG TRP A 173 19.567 6.418 4.968 1.00 0.63 C ATOM 2387 CD1 TRP A 173 19.976 7.488 4.227 1.00 0.72 C ATOM 2388 CD2 TRP A 173 20.504 5.368 4.709 1.00 0.64 C ATOM 2389 NE1 TRP A 173 21.103 7.165 3.517 1.00 0.78 N ATOM 2390 CE2 TRP A 173 21.450 5.870 3.796 1.00 0.73 C ATOM 2391 CE3 TRP A 173 20.634 4.051 5.159 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 22.509 5.100 3.324 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 21.688 3.289 4.692 1.00 0.73 C ATOM 2394 CH2 TRP A 173 22.613 3.817 3.784 1.00 0.79 C ATOM 0 H TRP A 173 16.771 8.211 5.357 1.00 0.58 H new ATOM 0 HA TRP A 173 17.243 5.544 4.275 1.00 0.55 H new ATOM 0 HB2 TRP A 173 18.338 7.272 6.467 1.00 0.60 H new ATOM 0 HB3 TRP A 173 18.528 5.535 6.589 1.00 0.60 H new ATOM 0 HD1 TRP A 173 19.484 8.449 4.203 1.00 0.72 H new ATOM 0 HE1 TRP A 173 21.603 7.789 2.883 1.00 0.78 H new ATOM 0 HE3 TRP A 173 19.924 3.636 5.859 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 23.223 5.502 2.620 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 21.800 2.270 5.033 1.00 0.73 H new ATOM 0 HH2 TRP A 173 23.427 3.197 3.439 1.00 0.79 H new ATOM 2405 N LEU A 174 15.204 4.632 5.444 1.00 0.49 N ATOM 2406 CA LEU A 174 14.098 4.002 6.139 1.00 0.49 C ATOM 2407 C LEU A 174 14.583 3.193 7.328 1.00 0.53 C ATOM 2408 O LEU A 174 15.442 2.305 7.185 1.00 0.56 O ATOM 2409 CB LEU A 174 13.308 3.090 5.206 1.00 0.48 C ATOM 2410 CG LEU A 174 12.668 3.754 3.988 1.00 0.50 C ATOM 2411 CD1 LEU A 174 11.681 2.787 3.359 1.00 0.52 C ATOM 2412 CD2 LEU A 174 11.984 5.065 4.363 1.00 0.54 C ATOM 0 H LEU A 174 15.272 4.385 4.457 1.00 0.49 H new ATOM 0 HA LEU A 174 13.449 4.803 6.493 1.00 0.49 H new ATOM 0 HB2 LEU A 174 13.974 2.301 4.855 1.00 0.48 H new ATOM 0 HB3 LEU A 174 12.521 2.608 5.785 1.00 0.48 H new ATOM 0 HG LEU A 174 13.448 3.998 3.266 1.00 0.50 H new ATOM 0 HD11 LEU A 174 11.219 3.253 2.489 1.00 0.52 H new ATOM 0 HD12 LEU A 174 12.204 1.882 3.051 1.00 0.52 H new ATOM 0 HD13 LEU A 174 10.910 2.531 4.085 1.00 0.52 H new ATOM 0 HD21 LEU A 174 11.539 5.511 3.473 1.00 0.54 H new ATOM 0 HD22 LEU A 174 11.205 4.871 5.100 1.00 0.54 H new ATOM 0 HD23 LEU A 174 12.719 5.751 4.784 1.00 0.54 H new ATOM 2424 N ASP A 175 13.971 3.488 8.477 1.00 0.61 N ATOM 2425 CA ASP A 175 14.344 2.904 9.766 1.00 0.72 C ATOM 2426 C ASP A 175 13.834 1.478 9.886 1.00 0.68 C ATOM 2427 O ASP A 175 13.967 0.850 10.938 1.00 0.75 O ATOM 2428 CB ASP A 175 13.762 3.733 10.916 1.00 0.93 C ATOM 2429 CG ASP A 175 14.200 5.182 10.885 1.00 1.83 C ATOM 2430 OD1 ASP A 175 15.297 5.486 11.395 1.00 2.37 O ATOM 2431 OD2 ASP A 175 13.441 6.026 10.354 1.00 2.56 O ATOM 0 H ASP A 175 13.194 4.146 8.539 1.00 0.61 H new ATOM 0 HA ASP A 175 15.432 2.902 9.824 1.00 0.72 H new ATOM 0 HB2 ASP A 175 12.674 3.688 10.874 1.00 0.93 H new ATOM 0 HB3 ASP A 175 14.063 3.289 11.865 1.00 0.93 H new ATOM 2436 N HIS A 176 13.215 0.999 8.810 1.00 0.66 N ATOM 2437 CA HIS A 176 12.678 -0.359 8.725 1.00 0.71 C ATOM 2438 C HIS A 176 11.335 -0.510 9.431 1.00 0.83 C ATOM 2439 O HIS A 176 10.567 -1.417 9.118 1.00 1.10 O ATOM 2440 CB HIS A 176 13.679 -1.392 9.238 1.00 0.71 C ATOM 2441 CG HIS A 176 14.576 -1.886 8.159 1.00 0.69 C ATOM 2442 ND1 HIS A 176 14.142 -2.733 7.172 1.00 0.77 N ATOM 2443 CD2 HIS A 176 15.863 -1.609 7.877 1.00 0.67 C ATOM 2444 CE1 HIS A 176 15.121 -2.954 6.325 1.00 0.76 C ATOM 2445 NE2 HIS A 176 16.185 -2.288 6.729 1.00 0.69 N ATOM 0 H HIS A 176 13.070 1.548 7.963 1.00 0.66 H new ATOM 0 HA HIS A 176 12.503 -0.548 7.666 1.00 0.71 H new ATOM 0 HB2 HIS A 176 14.279 -0.951 10.034 1.00 0.71 H new ATOM 0 HB3 HIS A 176 13.140 -2.233 9.674 1.00 0.71 H new ATOM 0 HD2 HIS A 176 16.520 -0.971 8.449 1.00 0.67 H new ATOM 0 HE1 HIS A 176 15.064 -3.577 5.445 1.00 0.76 H new ATOM 0 HE2 HIS A 176 17.094 -2.279 6.266 1.00 0.69 H new ATOM 2454 N GLY A 177 11.028 0.412 10.324 1.00 0.82 N ATOM 2455 CA GLY A 177 9.804 0.317 11.102 1.00 0.96 C ATOM 2456 C GLY A 177 8.818 1.371 10.674 1.00 1.00 C ATOM 2457 O GLY A 177 7.919 1.758 11.422 1.00 1.34 O ATOM 0 H GLY A 177 11.603 1.229 10.529 1.00 0.82 H new ATOM 0 HA2 GLY A 177 9.364 -0.672 10.977 1.00 0.96 H new ATOM 0 HA3 GLY A 177 10.031 0.433 12.162 1.00 0.96 H new ATOM 2461 N ARG A 178 9.001 1.825 9.451 1.00 0.90 N ATOM 2462 CA ARG A 178 8.236 2.925 8.904 1.00 0.99 C ATOM 2463 C ARG A 178 7.284 2.418 7.829 1.00 0.87 C ATOM 2464 O ARG A 178 7.547 1.398 7.191 1.00 0.86 O ATOM 2465 CB ARG A 178 9.207 3.934 8.291 1.00 1.22 C ATOM 2466 CG ARG A 178 8.585 5.263 7.907 1.00 1.27 C ATOM 2467 CD ARG A 178 8.463 6.187 9.107 1.00 1.18 C ATOM 2468 NE ARG A 178 9.764 6.423 9.733 1.00 1.23 N ATOM 2469 CZ ARG A 178 9.958 7.203 10.798 1.00 1.74 C ATOM 2470 NH1 ARG A 178 8.936 7.852 11.345 1.00 2.16 N ATOM 2471 NH2 ARG A 178 11.177 7.338 11.314 1.00 2.18 N ATOM 0 H ARG A 178 9.689 1.438 8.805 1.00 0.90 H new ATOM 0 HA ARG A 178 7.651 3.395 9.695 1.00 0.99 H new ATOM 0 HB2 ARG A 178 10.014 4.118 9.001 1.00 1.22 H new ATOM 0 HB3 ARG A 178 9.658 3.490 7.404 1.00 1.22 H new ATOM 0 HG2 ARG A 178 9.192 5.741 7.138 1.00 1.27 H new ATOM 0 HG3 ARG A 178 7.599 5.093 7.475 1.00 1.27 H new ATOM 0 HD2 ARG A 178 8.030 7.137 8.794 1.00 1.18 H new ATOM 0 HD3 ARG A 178 7.780 5.751 9.836 1.00 1.18 H new ATOM 0 HE ARG A 178 10.578 5.960 9.328 1.00 1.23 H new ATOM 0 HH11 ARG A 178 8.000 7.755 10.951 1.00 2.16 H new ATOM 0 HH12 ARG A 178 9.087 8.448 12.159 1.00 2.16 H new ATOM 0 HH21 ARG A 178 11.966 6.845 10.895 1.00 2.18 H new ATOM 0 HH22 ARG A 178 11.323 7.935 12.128 1.00 2.18 H new ATOM 2485 N THR A 179 6.177 3.113 7.646 1.00 0.91 N ATOM 2486 CA THR A 179 5.331 2.885 6.492 1.00 0.89 C ATOM 2487 C THR A 179 5.675 3.920 5.427 1.00 0.86 C ATOM 2488 O THR A 179 6.399 4.877 5.698 1.00 0.91 O ATOM 2489 CB THR A 179 3.832 2.938 6.849 1.00 1.05 C ATOM 2490 OG1 THR A 179 3.027 2.706 5.684 1.00 1.20 O ATOM 2491 CG2 THR A 179 3.463 4.271 7.477 1.00 1.11 C ATOM 0 H THR A 179 5.844 3.839 8.281 1.00 0.91 H new ATOM 0 HA THR A 179 5.519 1.881 6.112 1.00 0.89 H new ATOM 0 HB THR A 179 3.638 2.150 7.577 1.00 1.05 H new ATOM 0 HG1 THR A 179 2.079 2.741 5.929 1.00 1.20 H new ATOM 0 HG21 THR A 179 2.400 4.278 7.718 1.00 1.11 H new ATOM 0 HG22 THR A 179 4.042 4.416 8.389 1.00 1.11 H new ATOM 0 HG23 THR A 179 3.682 5.076 6.776 1.00 1.11 H new ATOM 2499 N LEU A 180 5.167 3.734 4.226 1.00 0.84 N ATOM 2500 CA LEU A 180 5.602 4.530 3.090 1.00 0.84 C ATOM 2501 C LEU A 180 4.654 5.692 2.836 1.00 0.93 C ATOM 2502 O LEU A 180 5.074 6.768 2.409 1.00 0.97 O ATOM 2503 CB LEU A 180 5.701 3.621 1.873 1.00 0.85 C ATOM 2504 CG LEU A 180 6.437 2.311 2.156 1.00 0.83 C ATOM 2505 CD1 LEU A 180 6.344 1.365 0.976 1.00 1.08 C ATOM 2506 CD2 LEU A 180 7.887 2.586 2.516 1.00 0.90 C ATOM 0 H LEU A 180 4.452 3.039 4.008 1.00 0.84 H new ATOM 0 HA LEU A 180 6.579 4.964 3.301 1.00 0.84 H new ATOM 0 HB2 LEU A 180 4.697 3.395 1.514 1.00 0.85 H new ATOM 0 HB3 LEU A 180 6.214 4.153 1.072 1.00 0.85 H new ATOM 0 HG LEU A 180 5.955 1.827 3.006 1.00 0.83 H new ATOM 0 HD11 LEU A 180 6.877 0.442 1.207 1.00 1.08 H new ATOM 0 HD12 LEU A 180 5.297 1.139 0.773 1.00 1.08 H new ATOM 0 HD13 LEU A 180 6.791 1.832 0.099 1.00 1.08 H new ATOM 0 HD21 LEU A 180 8.398 1.644 2.715 1.00 0.90 H new ATOM 0 HD22 LEU A 180 8.377 3.097 1.687 1.00 0.90 H new ATOM 0 HD23 LEU A 180 7.928 3.215 3.405 1.00 0.90 H new ATOM 2518 N ARG A 181 3.382 5.479 3.123 1.00 1.02 N ATOM 2519 CA ARG A 181 2.372 6.516 2.958 1.00 1.13 C ATOM 2520 C ARG A 181 2.650 7.682 3.905 1.00 1.18 C ATOM 2521 O ARG A 181 2.431 8.844 3.568 1.00 1.36 O ATOM 2522 CB ARG A 181 0.999 5.934 3.254 1.00 1.22 C ATOM 2523 CG ARG A 181 -0.160 6.796 2.790 1.00 1.15 C ATOM 2524 CD ARG A 181 -1.434 6.427 3.529 1.00 0.69 C ATOM 2525 NE ARG A 181 -1.339 5.103 4.143 1.00 1.10 N ATOM 2526 CZ ARG A 181 -1.741 4.827 5.383 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -2.401 5.736 6.087 1.00 2.54 N ATOM 2528 NH2 ARG A 181 -1.498 3.633 5.906 1.00 2.64 N ATOM 0 H ARG A 181 3.020 4.592 3.474 1.00 1.02 H new ATOM 0 HA ARG A 181 2.403 6.882 1.932 1.00 1.13 H new ATOM 0 HB2 ARG A 181 0.922 4.956 2.778 1.00 1.22 H new ATOM 0 HB3 ARG A 181 0.910 5.774 4.328 1.00 1.22 H new ATOM 0 HG2 ARG A 181 0.072 7.848 2.959 1.00 1.15 H new ATOM 0 HG3 ARG A 181 -0.307 6.670 1.717 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -1.637 7.171 4.299 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -2.275 6.447 2.836 1.00 0.69 H new ATOM 0 HE ARG A 181 -0.941 4.345 3.588 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -2.602 6.649 5.680 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -2.708 5.522 7.036 1.00 2.54 H new ATOM 0 HH21 ARG A 181 -1.004 2.928 5.359 1.00 2.64 H new ATOM 0 HH22 ARG A 181 -1.805 3.420 6.855 1.00 2.64 H new ATOM 2542 N GLU A 182 3.169 7.350 5.081 1.00 1.11 N ATOM 2543 CA GLU A 182 3.458 8.332 6.121 1.00 1.18 C ATOM 2544 C GLU A 182 4.687 9.162 5.750 1.00 1.16 C ATOM 2545 O GLU A 182 4.971 10.190 6.358 1.00 1.25 O ATOM 2546 CB GLU A 182 3.683 7.604 7.449 1.00 1.25 C ATOM 2547 CG GLU A 182 3.916 8.512 8.643 1.00 1.34 C ATOM 2548 CD GLU A 182 2.757 9.457 8.898 1.00 1.89 C ATOM 2549 OE1 GLU A 182 1.670 8.984 9.296 1.00 2.30 O ATOM 2550 OE2 GLU A 182 2.927 10.677 8.703 1.00 2.31 O ATOM 0 H GLU A 182 3.402 6.392 5.341 1.00 1.11 H new ATOM 0 HA GLU A 182 2.612 9.012 6.220 1.00 1.18 H new ATOM 0 HB2 GLU A 182 2.817 6.974 7.653 1.00 1.25 H new ATOM 0 HB3 GLU A 182 4.541 6.941 7.342 1.00 1.25 H new ATOM 0 HG2 GLU A 182 4.083 7.902 9.531 1.00 1.34 H new ATOM 0 HG3 GLU A 182 4.824 9.093 8.480 1.00 1.34 H new ATOM 2557 N GLN A 183 5.414 8.715 4.746 1.00 1.07 N ATOM 2558 CA GLN A 183 6.584 9.439 4.283 1.00 1.06 C ATOM 2559 C GLN A 183 6.178 10.486 3.259 1.00 1.13 C ATOM 2560 O GLN A 183 6.894 11.457 3.019 1.00 1.22 O ATOM 2561 CB GLN A 183 7.581 8.476 3.661 1.00 1.00 C ATOM 2562 CG GLN A 183 8.035 7.388 4.607 1.00 1.00 C ATOM 2563 CD GLN A 183 8.921 6.377 3.924 1.00 1.04 C ATOM 2564 OE1 GLN A 183 9.647 6.701 2.985 1.00 1.65 O ATOM 2565 NE2 GLN A 183 8.860 5.140 4.377 1.00 0.81 N ATOM 0 H GLN A 183 5.217 7.855 4.234 1.00 1.07 H new ATOM 0 HA GLN A 183 7.049 9.934 5.136 1.00 1.06 H new ATOM 0 HB2 GLN A 183 7.131 8.017 2.781 1.00 1.00 H new ATOM 0 HB3 GLN A 183 8.451 9.036 3.319 1.00 1.00 H new ATOM 0 HG2 GLN A 183 8.573 7.836 5.442 1.00 1.00 H new ATOM 0 HG3 GLN A 183 7.163 6.883 5.023 1.00 1.00 H new ATOM 0 HE21 GLN A 183 8.245 4.913 5.158 1.00 0.81 H new ATOM 0 HE22 GLN A 183 9.428 4.411 3.946 1.00 0.81 H new ATOM 2574 N GLY A 184 5.017 10.274 2.654 1.00 1.16 N ATOM 2575 CA GLY A 184 4.567 11.142 1.590 1.00 1.28 C ATOM 2576 C GLY A 184 5.274 10.836 0.286 1.00 1.23 C ATOM 2577 O GLY A 184 5.114 11.555 -0.702 1.00 1.38 O ATOM 0 H GLY A 184 4.378 9.513 2.884 1.00 1.16 H new ATOM 0 HA2 GLY A 184 3.491 11.028 1.457 1.00 1.28 H new ATOM 0 HA3 GLY A 184 4.746 12.181 1.867 1.00 1.28 H new ATOM 2581 N VAL A 185 6.073 9.772 0.291 1.00 1.10 N ATOM 2582 CA VAL A 185 6.842 9.385 -0.878 1.00 1.08 C ATOM 2583 C VAL A 185 5.957 8.767 -1.958 1.00 1.02 C ATOM 2584 O VAL A 185 4.883 8.231 -1.671 1.00 1.15 O ATOM 2585 CB VAL A 185 7.953 8.396 -0.495 1.00 1.13 C ATOM 2586 CG1 VAL A 185 8.987 9.075 0.392 1.00 1.31 C ATOM 2587 CG2 VAL A 185 7.363 7.180 0.202 1.00 1.14 C ATOM 0 H VAL A 185 6.202 9.163 1.099 1.00 1.10 H new ATOM 0 HA VAL A 185 7.290 10.293 -1.281 1.00 1.08 H new ATOM 0 HB VAL A 185 8.450 8.062 -1.406 1.00 1.13 H new ATOM 0 HG11 VAL A 185 9.767 8.360 0.654 1.00 1.31 H new ATOM 0 HG12 VAL A 185 9.430 9.915 -0.143 1.00 1.31 H new ATOM 0 HG13 VAL A 185 8.506 9.436 1.301 1.00 1.31 H new ATOM 0 HG21 VAL A 185 8.163 6.489 0.467 1.00 1.14 H new ATOM 0 HG22 VAL A 185 6.842 7.496 1.106 1.00 1.14 H new ATOM 0 HG23 VAL A 185 6.660 6.683 -0.467 1.00 1.14 H new ATOM 2597 N GLU A 186 6.431 8.826 -3.194 1.00 0.93 N ATOM 2598 CA GLU A 186 5.682 8.334 -4.332 1.00 0.92 C ATOM 2599 C GLU A 186 6.249 7.000 -4.796 1.00 0.83 C ATOM 2600 O GLU A 186 6.925 6.298 -4.037 1.00 0.82 O ATOM 2601 CB GLU A 186 5.721 9.361 -5.467 1.00 1.02 C ATOM 2602 CG GLU A 186 4.855 10.574 -5.217 1.00 1.46 C ATOM 2603 CD GLU A 186 3.383 10.221 -5.168 1.00 2.45 C ATOM 2604 OE1 GLU A 186 2.817 9.875 -6.229 1.00 2.97 O ATOM 2605 OE2 GLU A 186 2.786 10.275 -4.073 1.00 3.02 O ATOM 0 H GLU A 186 7.343 9.216 -3.432 1.00 0.93 H new ATOM 0 HA GLU A 186 4.644 8.182 -4.036 1.00 0.92 H new ATOM 0 HB2 GLU A 186 6.751 9.685 -5.617 1.00 1.02 H new ATOM 0 HB3 GLU A 186 5.400 8.881 -6.391 1.00 1.02 H new ATOM 0 HG2 GLU A 186 5.147 11.040 -4.276 1.00 1.46 H new ATOM 0 HG3 GLU A 186 5.025 11.309 -6.003 1.00 1.46 H new ATOM 2612 N GLU A 187 5.961 6.636 -6.026 1.00 0.89 N ATOM 2613 CA GLU A 187 6.405 5.370 -6.555 1.00 0.91 C ATOM 2614 C GLU A 187 7.315 5.589 -7.761 1.00 0.91 C ATOM 2615 O GLU A 187 7.487 4.693 -8.583 1.00 1.14 O ATOM 2616 CB GLU A 187 5.197 4.527 -6.972 1.00 1.05 C ATOM 2617 CG GLU A 187 4.121 4.379 -5.902 1.00 1.11 C ATOM 2618 CD GLU A 187 3.191 5.574 -5.825 1.00 1.36 C ATOM 2619 OE1 GLU A 187 2.430 5.809 -6.778 1.00 1.72 O ATOM 2620 OE2 GLU A 187 3.217 6.286 -4.798 1.00 1.86 O ATOM 0 H GLU A 187 5.419 7.202 -6.679 1.00 0.89 H new ATOM 0 HA GLU A 187 6.963 4.845 -5.780 1.00 0.91 H new ATOM 0 HB2 GLU A 187 4.748 4.974 -7.859 1.00 1.05 H new ATOM 0 HB3 GLU A 187 5.545 3.534 -7.257 1.00 1.05 H new ATOM 0 HG2 GLU A 187 3.535 3.483 -6.106 1.00 1.11 H new ATOM 0 HG3 GLU A 187 4.598 4.234 -4.933 1.00 1.11 H new ATOM 2627 N HIS A 188 7.912 6.775 -7.868 1.00 0.92 N ATOM 2628 CA HIS A 188 8.688 7.105 -9.064 1.00 0.95 C ATOM 2629 C HIS A 188 10.088 7.638 -8.748 1.00 0.92 C ATOM 2630 O HIS A 188 10.874 7.885 -9.659 1.00 1.01 O ATOM 2631 CB HIS A 188 7.926 8.090 -9.968 1.00 1.04 C ATOM 2632 CG HIS A 188 7.405 9.323 -9.285 1.00 1.03 C ATOM 2633 ND1 HIS A 188 6.060 9.602 -9.178 1.00 1.09 N ATOM 2634 CD2 HIS A 188 8.047 10.371 -8.715 1.00 1.08 C ATOM 2635 CE1 HIS A 188 5.897 10.763 -8.579 1.00 1.14 C ATOM 2636 NE2 HIS A 188 7.084 11.252 -8.286 1.00 1.15 N ATOM 0 H HIS A 188 7.876 7.508 -7.160 1.00 0.92 H new ATOM 0 HA HIS A 188 8.825 6.166 -9.601 1.00 0.95 H new ATOM 0 HB2 HIS A 188 8.586 8.397 -10.780 1.00 1.04 H new ATOM 0 HB3 HIS A 188 7.086 7.564 -10.422 1.00 1.04 H new ATOM 0 HD1 HIS A 188 5.306 9.001 -9.512 1.00 1.09 H new ATOM 0 HD2 HIS A 188 9.116 10.491 -8.616 1.00 1.08 H new ATOM 0 HE1 HIS A 188 4.950 11.235 -8.364 1.00 1.14 H new ATOM 2645 N GLU A 189 10.395 7.835 -7.477 1.00 0.89 N ATOM 2646 CA GLU A 189 11.755 8.200 -7.080 1.00 0.92 C ATOM 2647 C GLU A 189 12.621 6.945 -7.020 1.00 0.78 C ATOM 2648 O GLU A 189 12.105 5.853 -6.785 1.00 0.74 O ATOM 2649 CB GLU A 189 11.767 8.893 -5.713 1.00 1.10 C ATOM 2650 CG GLU A 189 10.628 9.877 -5.492 1.00 1.37 C ATOM 2651 CD GLU A 189 9.366 9.197 -4.997 1.00 1.82 C ATOM 2652 OE1 GLU A 189 8.600 8.679 -5.833 1.00 2.34 O ATOM 2653 OE2 GLU A 189 9.144 9.167 -3.764 1.00 2.38 O ATOM 0 H GLU A 189 9.733 7.751 -6.706 1.00 0.89 H new ATOM 0 HA GLU A 189 12.152 8.895 -7.820 1.00 0.92 H new ATOM 0 HB2 GLU A 189 11.728 8.132 -4.934 1.00 1.10 H new ATOM 0 HB3 GLU A 189 12.714 9.421 -5.596 1.00 1.10 H new ATOM 0 HG2 GLU A 189 10.938 10.632 -4.769 1.00 1.37 H new ATOM 0 HG3 GLU A 189 10.415 10.398 -6.425 1.00 1.37 H new ATOM 2660 N THR A 190 13.921 7.081 -7.259 1.00 0.74 N ATOM 2661 CA THR A 190 14.816 5.931 -7.187 1.00 0.66 C ATOM 2662 C THR A 190 15.175 5.600 -5.742 1.00 0.57 C ATOM 2663 O THR A 190 15.767 6.415 -5.030 1.00 0.61 O ATOM 2664 CB THR A 190 16.109 6.157 -7.998 1.00 0.70 C ATOM 2665 OG1 THR A 190 15.787 6.472 -9.360 1.00 0.81 O ATOM 2666 CG2 THR A 190 16.995 4.917 -7.966 1.00 0.66 C ATOM 0 H THR A 190 14.374 7.962 -7.501 1.00 0.74 H new ATOM 0 HA THR A 190 14.277 5.090 -7.623 1.00 0.66 H new ATOM 0 HB THR A 190 16.649 6.988 -7.546 1.00 0.70 H new ATOM 0 HG1 THR A 190 16.613 6.615 -9.867 1.00 0.81 H new ATOM 0 HG21 THR A 190 17.900 5.101 -8.545 1.00 0.66 H new ATOM 0 HG22 THR A 190 17.264 4.689 -6.935 1.00 0.66 H new ATOM 0 HG23 THR A 190 16.455 4.073 -8.396 1.00 0.66 H new ATOM 2674 N LEU A 191 14.826 4.393 -5.320 1.00 0.48 N ATOM 2675 CA LEU A 191 15.090 3.955 -3.959 1.00 0.42 C ATOM 2676 C LEU A 191 16.237 2.959 -3.993 1.00 0.39 C ATOM 2677 O LEU A 191 16.292 2.111 -4.880 1.00 0.38 O ATOM 2678 CB LEU A 191 13.849 3.309 -3.318 1.00 0.41 C ATOM 2679 CG LEU A 191 12.521 4.077 -3.453 1.00 0.51 C ATOM 2680 CD1 LEU A 191 12.736 5.582 -3.431 1.00 1.01 C ATOM 2681 CD2 LEU A 191 11.775 3.657 -4.709 1.00 0.82 C ATOM 0 H LEU A 191 14.358 3.699 -5.903 1.00 0.48 H new ATOM 0 HA LEU A 191 15.351 4.822 -3.352 1.00 0.42 H new ATOM 0 HB2 LEU A 191 13.716 2.320 -3.756 1.00 0.41 H new ATOM 0 HB3 LEU A 191 14.051 3.163 -2.257 1.00 0.41 H new ATOM 0 HG LEU A 191 11.909 3.821 -2.589 1.00 0.51 H new ATOM 0 HD11 LEU A 191 11.776 6.088 -3.529 1.00 1.01 H new ATOM 0 HD12 LEU A 191 13.203 5.869 -2.489 1.00 1.01 H new ATOM 0 HD13 LEU A 191 13.383 5.869 -4.260 1.00 1.01 H new ATOM 0 HD21 LEU A 191 10.841 4.214 -4.781 1.00 0.82 H new ATOM 0 HD22 LEU A 191 12.390 3.866 -5.584 1.00 0.82 H new ATOM 0 HD23 LEU A 191 11.558 2.590 -4.664 1.00 0.82 H new ATOM 2693 N LEU A 192 17.165 3.059 -3.060 1.00 0.39 N ATOM 2694 CA LEU A 192 18.362 2.239 -3.113 1.00 0.41 C ATOM 2695 C LEU A 192 18.418 1.286 -1.925 1.00 0.40 C ATOM 2696 O LEU A 192 18.067 1.655 -0.801 1.00 0.44 O ATOM 2697 CB LEU A 192 19.601 3.140 -3.102 1.00 0.44 C ATOM 2698 CG LEU A 192 19.426 4.501 -3.784 1.00 0.49 C ATOM 2699 CD1 LEU A 192 20.560 5.431 -3.392 1.00 0.56 C ATOM 2700 CD2 LEU A 192 19.365 4.364 -5.299 1.00 0.50 C ATOM 0 H LEU A 192 17.115 3.694 -2.263 1.00 0.39 H new ATOM 0 HA LEU A 192 18.339 1.651 -4.030 1.00 0.41 H new ATOM 0 HB2 LEU A 192 19.900 3.306 -2.067 1.00 0.44 H new ATOM 0 HB3 LEU A 192 20.420 2.610 -3.589 1.00 0.44 H new ATOM 0 HG LEU A 192 18.479 4.923 -3.447 1.00 0.49 H new ATOM 0 HD11 LEU A 192 20.426 6.395 -3.882 1.00 0.56 H new ATOM 0 HD12 LEU A 192 20.559 5.570 -2.311 1.00 0.56 H new ATOM 0 HD13 LEU A 192 21.511 4.996 -3.701 1.00 0.56 H new ATOM 0 HD21 LEU A 192 19.240 5.349 -5.749 1.00 0.50 H new ATOM 0 HD22 LEU A 192 20.289 3.914 -5.661 1.00 0.50 H new ATOM 0 HD23 LEU A 192 18.521 3.731 -5.573 1.00 0.50 H new ATOM 2712 N LEU A 193 18.823 0.055 -2.184 1.00 0.43 N ATOM 2713 CA LEU A 193 19.095 -0.901 -1.126 1.00 0.50 C ATOM 2714 C LEU A 193 20.555 -0.769 -0.703 1.00 0.47 C ATOM 2715 O LEU A 193 21.457 -0.818 -1.539 1.00 0.49 O ATOM 2716 CB LEU A 193 18.773 -2.321 -1.625 1.00 0.68 C ATOM 2717 CG LEU A 193 18.923 -3.459 -0.607 1.00 0.44 C ATOM 2718 CD1 LEU A 193 18.065 -4.643 -1.020 1.00 1.09 C ATOM 2719 CD2 LEU A 193 20.372 -3.902 -0.496 1.00 1.03 C ATOM 0 H LEU A 193 18.972 -0.308 -3.126 1.00 0.43 H new ATOM 0 HA LEU A 193 18.467 -0.702 -0.257 1.00 0.50 H new ATOM 0 HB2 LEU A 193 17.747 -2.328 -1.994 1.00 0.68 H new ATOM 0 HB3 LEU A 193 19.419 -2.538 -2.475 1.00 0.68 H new ATOM 0 HG LEU A 193 18.595 -3.088 0.364 1.00 0.44 H new ATOM 0 HD11 LEU A 193 18.178 -5.446 -0.291 1.00 1.09 H new ATOM 0 HD12 LEU A 193 17.020 -4.337 -1.064 1.00 1.09 H new ATOM 0 HD13 LEU A 193 18.381 -4.997 -2.001 1.00 1.09 H new ATOM 0 HD21 LEU A 193 20.451 -4.709 0.232 1.00 1.03 H new ATOM 0 HD22 LEU A 193 20.720 -4.254 -1.467 1.00 1.03 H new ATOM 0 HD23 LEU A 193 20.986 -3.061 -0.173 1.00 1.03 H new ATOM 2731 N ARG A 194 20.786 -0.586 0.589 1.00 0.46 N ATOM 2732 CA ARG A 194 22.132 -0.370 1.099 1.00 0.46 C ATOM 2733 C ARG A 194 22.450 -1.363 2.197 1.00 0.44 C ATOM 2734 O ARG A 194 21.579 -1.729 2.987 1.00 0.49 O ATOM 2735 CB ARG A 194 22.284 1.050 1.644 1.00 0.53 C ATOM 2736 CG ARG A 194 22.237 2.132 0.580 1.00 0.60 C ATOM 2737 CD ARG A 194 23.457 2.097 -0.323 1.00 0.65 C ATOM 2738 NE ARG A 194 24.701 2.303 0.419 1.00 0.69 N ATOM 2739 CZ ARG A 194 25.818 2.776 -0.130 1.00 0.95 C ATOM 2740 NH1 ARG A 194 25.855 3.058 -1.425 1.00 1.25 N ATOM 2741 NH2 ARG A 194 26.900 2.962 0.613 1.00 1.06 N ATOM 0 H ARG A 194 20.058 -0.583 1.304 1.00 0.46 H new ATOM 0 HA ARG A 194 22.828 -0.511 0.272 1.00 0.46 H new ATOM 0 HB2 ARG A 194 21.493 1.235 2.370 1.00 0.53 H new ATOM 0 HB3 ARG A 194 23.231 1.123 2.179 1.00 0.53 H new ATOM 0 HG2 ARG A 194 21.337 2.009 -0.022 1.00 0.60 H new ATOM 0 HG3 ARG A 194 22.169 3.109 1.059 1.00 0.60 H new ATOM 0 HD2 ARG A 194 23.498 1.137 -0.838 1.00 0.65 H new ATOM 0 HD3 ARG A 194 23.362 2.866 -1.089 1.00 0.65 H new ATOM 0 HE ARG A 194 24.713 2.071 1.412 1.00 0.69 H new ATOM 0 HH11 ARG A 194 25.027 2.913 -2.002 1.00 1.25 H new ATOM 0 HH12 ARG A 194 26.712 3.420 -1.844 1.00 1.25 H new ATOM 0 HH21 ARG A 194 26.879 2.743 1.609 1.00 1.06 H new ATOM 0 HH22 ARG A 194 27.754 3.325 0.189 1.00 1.06 H new ATOM 2755 N ARG A 195 23.696 -1.793 2.248 1.00 0.45 N ATOM 2756 CA ARG A 195 24.126 -2.727 3.269 1.00 0.50 C ATOM 2757 C ARG A 195 24.427 -1.974 4.555 1.00 0.55 C ATOM 2758 O ARG A 195 25.253 -1.061 4.567 1.00 0.64 O ATOM 2759 CB ARG A 195 25.358 -3.497 2.797 1.00 0.59 C ATOM 2760 CG ARG A 195 25.574 -4.798 3.543 1.00 1.02 C ATOM 2761 CD ARG A 195 26.722 -5.594 2.953 1.00 1.07 C ATOM 2762 NE ARG A 195 26.723 -6.974 3.429 1.00 1.49 N ATOM 2763 CZ ARG A 195 27.354 -7.975 2.818 1.00 2.13 C ATOM 2764 NH1 ARG A 195 28.062 -7.752 1.719 1.00 2.34 N ATOM 2765 NH2 ARG A 195 27.258 -9.205 3.301 1.00 2.68 N ATOM 0 H ARG A 195 24.427 -1.511 1.595 1.00 0.45 H new ATOM 0 HA ARG A 195 23.327 -3.444 3.458 1.00 0.50 H new ATOM 0 HB2 ARG A 195 25.260 -3.709 1.732 1.00 0.59 H new ATOM 0 HB3 ARG A 195 26.239 -2.867 2.917 1.00 0.59 H new ATOM 0 HG2 ARG A 195 25.778 -4.587 4.593 1.00 1.02 H new ATOM 0 HG3 ARG A 195 24.662 -5.394 3.509 1.00 1.02 H new ATOM 0 HD2 ARG A 195 26.650 -5.584 1.865 1.00 1.07 H new ATOM 0 HD3 ARG A 195 27.667 -5.118 3.215 1.00 1.07 H new ATOM 0 HE ARG A 195 26.208 -7.185 4.284 1.00 1.49 H new ATOM 0 HH11 ARG A 195 28.126 -6.809 1.336 1.00 2.34 H new ATOM 0 HH12 ARG A 195 28.543 -8.524 1.257 1.00 2.34 H new ATOM 0 HH21 ARG A 195 26.702 -9.382 4.138 1.00 2.68 H new ATOM 0 HH22 ARG A 195 27.740 -9.975 2.836 1.00 2.68 H new ATOM 2779 N LYS A 196 23.738 -2.341 5.624 1.00 0.60 N ATOM 2780 CA LYS A 196 23.905 -1.668 6.900 1.00 0.69 C ATOM 2781 C LYS A 196 25.107 -2.237 7.635 1.00 0.76 C ATOM 2782 O LYS A 196 25.942 -1.499 8.156 1.00 0.88 O ATOM 2783 CB LYS A 196 22.652 -1.822 7.768 1.00 0.75 C ATOM 2784 CG LYS A 196 22.657 -0.922 8.993 1.00 0.88 C ATOM 2785 CD LYS A 196 21.509 -1.239 9.938 1.00 1.28 C ATOM 2786 CE LYS A 196 21.375 -0.183 11.027 1.00 1.65 C ATOM 2787 NZ LYS A 196 22.631 -0.006 11.805 1.00 2.15 N ATOM 0 H LYS A 196 23.058 -3.101 5.632 1.00 0.60 H new ATOM 0 HA LYS A 196 24.065 -0.607 6.706 1.00 0.69 H new ATOM 0 HB2 LYS A 196 21.771 -1.600 7.166 1.00 0.75 H new ATOM 0 HB3 LYS A 196 22.565 -2.860 8.088 1.00 0.75 H new ATOM 0 HG2 LYS A 196 23.603 -1.035 9.522 1.00 0.88 H new ATOM 0 HG3 LYS A 196 22.590 0.119 8.678 1.00 0.88 H new ATOM 0 HD2 LYS A 196 20.579 -1.301 9.374 1.00 1.28 H new ATOM 0 HD3 LYS A 196 21.671 -2.215 10.394 1.00 1.28 H new ATOM 0 HE2 LYS A 196 21.095 0.768 10.574 1.00 1.65 H new ATOM 0 HE3 LYS A 196 20.568 -0.464 11.704 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 22.444 0.593 12.635 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 22.979 -0.935 12.119 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 23.350 0.448 11.206 1.00 2.15 H new ATOM 2801 N PHE A 197 25.194 -3.559 7.666 1.00 0.77 N ATOM 2802 CA PHE A 197 26.290 -4.224 8.348 1.00 0.89 C ATOM 2803 C PHE A 197 27.287 -4.761 7.341 1.00 0.96 C ATOM 2804 O PHE A 197 26.909 -5.282 6.293 1.00 0.92 O ATOM 2805 CB PHE A 197 25.793 -5.370 9.223 1.00 0.95 C ATOM 2806 CG PHE A 197 24.639 -5.009 10.112 1.00 0.94 C ATOM 2807 CD1 PHE A 197 24.792 -4.044 11.089 1.00 1.14 C ATOM 2808 CD2 PHE A 197 23.409 -5.630 9.973 1.00 0.92 C ATOM 2809 CE1 PHE A 197 23.744 -3.701 11.918 1.00 1.19 C ATOM 2810 CE2 PHE A 197 22.354 -5.292 10.799 1.00 0.95 C ATOM 2811 CZ PHE A 197 22.485 -4.358 11.739 1.00 1.03 C ATOM 0 H PHE A 197 24.521 -4.188 7.228 1.00 0.77 H new ATOM 0 HA PHE A 197 26.772 -3.485 8.988 1.00 0.89 H new ATOM 0 HB2 PHE A 197 25.497 -6.200 8.582 1.00 0.95 H new ATOM 0 HB3 PHE A 197 26.617 -5.724 9.842 1.00 0.95 H new ATOM 0 HD1 PHE A 197 25.746 -3.551 11.205 1.00 1.14 H new ATOM 0 HD2 PHE A 197 23.273 -6.385 9.213 1.00 0.92 H new ATOM 0 HE1 PHE A 197 23.871 -2.952 12.686 1.00 1.19 H new ATOM 0 HE2 PHE A 197 21.406 -5.795 10.680 1.00 0.95 H new ATOM 0 HZ PHE A 197 21.644 -4.097 12.364 1.00 1.03 H new ATOM 2821 N PHE A 198 28.554 -4.656 7.674 1.00 1.16 N ATOM 2822 CA PHE A 198 29.613 -5.106 6.787 1.00 1.33 C ATOM 2823 C PHE A 198 30.408 -6.210 7.461 1.00 1.58 C ATOM 2824 O PHE A 198 31.626 -6.125 7.612 1.00 2.05 O ATOM 2825 CB PHE A 198 30.526 -3.941 6.395 1.00 1.51 C ATOM 2826 CG PHE A 198 29.815 -2.838 5.660 1.00 1.40 C ATOM 2827 CD1 PHE A 198 29.591 -2.927 4.295 1.00 1.61 C ATOM 2828 CD2 PHE A 198 29.373 -1.712 6.336 1.00 1.53 C ATOM 2829 CE1 PHE A 198 28.936 -1.914 3.619 1.00 1.95 C ATOM 2830 CE2 PHE A 198 28.719 -0.695 5.665 1.00 1.78 C ATOM 2831 CZ PHE A 198 28.499 -0.804 4.297 1.00 2.00 C ATOM 0 H PHE A 198 28.881 -4.262 8.556 1.00 1.16 H new ATOM 0 HA PHE A 198 29.166 -5.499 5.874 1.00 1.33 H new ATOM 0 HB2 PHE A 198 30.983 -3.530 7.295 1.00 1.51 H new ATOM 0 HB3 PHE A 198 31.335 -4.319 5.771 1.00 1.51 H new ATOM 0 HD1 PHE A 198 29.932 -3.797 3.753 1.00 1.61 H new ATOM 0 HD2 PHE A 198 29.541 -1.628 7.399 1.00 1.53 H new ATOM 0 HE1 PHE A 198 28.768 -1.997 2.555 1.00 1.95 H new ATOM 0 HE2 PHE A 198 28.381 0.179 6.201 1.00 1.78 H new ATOM 0 HZ PHE A 198 27.984 -0.016 3.768 1.00 2.00 H new ATOM 2841 N TYR A 199 29.693 -7.240 7.880 1.00 1.48 N ATOM 2842 CA TYR A 199 30.298 -8.372 8.565 1.00 1.79 C ATOM 2843 C TYR A 199 30.586 -9.500 7.580 1.00 2.06 C ATOM 2844 O TYR A 199 31.449 -10.337 7.827 1.00 2.27 O ATOM 2845 CB TYR A 199 29.380 -8.862 9.691 1.00 2.08 C ATOM 2846 CG TYR A 199 28.051 -9.414 9.215 1.00 2.04 C ATOM 2847 CD1 TYR A 199 27.125 -8.596 8.584 1.00 2.05 C ATOM 2848 CD2 TYR A 199 27.725 -10.753 9.390 1.00 2.35 C ATOM 2849 CE1 TYR A 199 25.912 -9.095 8.146 1.00 2.47 C ATOM 2850 CE2 TYR A 199 26.517 -11.257 8.957 1.00 2.78 C ATOM 2851 CZ TYR A 199 25.613 -10.427 8.344 1.00 2.89 C ATOM 2852 OH TYR A 199 24.410 -10.929 7.901 1.00 3.53 O ATOM 0 H TYR A 199 28.683 -7.316 7.757 1.00 1.48 H new ATOM 0 HA TYR A 199 31.243 -8.050 9.003 1.00 1.79 H new ATOM 0 HB2 TYR A 199 29.900 -9.635 10.257 1.00 2.08 H new ATOM 0 HB3 TYR A 199 29.193 -8.036 10.377 1.00 2.08 H new ATOM 0 HD1 TYR A 199 27.355 -7.552 8.432 1.00 2.05 H new ATOM 0 HD2 TYR A 199 28.431 -11.411 9.874 1.00 2.35 H new ATOM 0 HE1 TYR A 199 25.204 -8.446 7.652 1.00 2.47 H new ATOM 0 HE2 TYR A 199 26.283 -12.302 9.100 1.00 2.78 H new ATOM 0 HH TYR A 199 24.438 -11.033 6.927 1.00 3.53 H new ATOM 2862 N SER A 200 29.841 -9.510 6.471 1.00 2.43 N ATOM 2863 CA SER A 200 30.036 -10.482 5.394 1.00 3.08 C ATOM 2864 C SER A 200 29.843 -11.923 5.870 1.00 3.06 C ATOM 2865 O SER A 200 30.468 -12.846 5.345 1.00 3.33 O ATOM 2866 CB SER A 200 31.426 -10.311 4.790 1.00 3.56 C ATOM 2867 OG SER A 200 31.628 -8.983 4.331 1.00 4.12 O ATOM 0 H SER A 200 29.087 -8.845 6.296 1.00 2.43 H new ATOM 0 HA SER A 200 29.277 -10.289 4.636 1.00 3.08 H new ATOM 0 HB2 SER A 200 32.182 -10.560 5.535 1.00 3.56 H new ATOM 0 HB3 SER A 200 31.553 -11.008 3.962 1.00 3.56 H new ATOM 0 HG SER A 200 32.527 -8.902 3.950 1.00 4.12 H new ATOM 2873 N ASP A 201 28.928 -12.107 6.820 1.00 2.98 N ATOM 2874 CA ASP A 201 28.707 -13.402 7.466 1.00 3.19 C ATOM 2875 C ASP A 201 30.037 -13.999 7.911 1.00 3.05 C ATOM 2876 O ASP A 201 30.436 -15.084 7.489 1.00 3.25 O ATOM 2877 CB ASP A 201 27.952 -14.366 6.545 1.00 3.87 C ATOM 2878 CG ASP A 201 27.593 -15.668 7.238 1.00 4.29 C ATOM 2879 OD1 ASP A 201 26.752 -15.640 8.162 1.00 4.89 O ATOM 2880 OD2 ASP A 201 28.144 -16.723 6.859 1.00 4.31 O ATOM 0 H ASP A 201 28.319 -11.365 7.164 1.00 2.98 H new ATOM 0 HA ASP A 201 28.084 -13.242 8.346 1.00 3.19 H new ATOM 0 HB2 ASP A 201 27.041 -13.885 6.188 1.00 3.87 H new ATOM 0 HB3 ASP A 201 28.564 -14.581 5.669 1.00 3.87 H new ATOM 2885 N GLN A 202 30.737 -13.250 8.735 1.00 3.02 N ATOM 2886 CA GLN A 202 32.021 -13.671 9.251 1.00 3.45 C ATOM 2887 C GLN A 202 32.019 -13.554 10.766 1.00 3.85 C ATOM 2888 O GLN A 202 31.659 -14.542 11.437 1.00 4.18 O ATOM 2889 CB GLN A 202 33.127 -12.810 8.634 1.00 3.65 C ATOM 2890 CG GLN A 202 34.538 -13.245 8.984 1.00 4.42 C ATOM 2891 CD GLN A 202 35.579 -12.410 8.267 1.00 5.07 C ATOM 2892 OE1 GLN A 202 36.032 -11.385 8.772 1.00 5.73 O ATOM 2893 NE2 GLN A 202 35.949 -12.830 7.068 1.00 5.30 N ATOM 2894 OXT GLN A 202 32.337 -12.462 11.282 1.00 4.27 O ATOM 0 H GLN A 202 30.433 -12.334 9.065 1.00 3.02 H new ATOM 0 HA GLN A 202 32.208 -14.712 8.985 1.00 3.45 H new ATOM 0 HB2 GLN A 202 33.016 -12.822 7.550 1.00 3.65 H new ATOM 0 HB3 GLN A 202 32.989 -11.778 8.957 1.00 3.65 H new ATOM 0 HG2 GLN A 202 34.686 -13.165 10.061 1.00 4.42 H new ATOM 0 HG3 GLN A 202 34.670 -14.295 8.721 1.00 4.42 H new ATOM 0 HE21 GLN A 202 35.551 -13.686 6.682 1.00 5.30 H new ATOM 0 HE22 GLN A 202 36.633 -12.298 6.530 1.00 5.30 H new TER 2903 GLN A 202