USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1135 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 107 TYR OH : rot 110:sc= 0.664 USER MOD Set 1.2: A 125 LYS NZ :NH3+ -138:sc= 0.747 (180deg=-0.0388) USER MOD Set 2.1: A 74 GLN : amide:sc= 0.756 K(o=1.2,f=-8.1!) USER MOD Set 2.2: A 75 LYS NZ :NH3+ -156:sc= 0.488 (180deg=0) USER MOD Single : A 1 MET CE :methyl -139:sc= -0.405 (180deg=-1.58) USER MOD Single : A 1 MET N :NH3+ -177:sc= 0.881 (180deg=0.863) USER MOD Single : A 9 THR OG1 : rot 120:sc= -0.103 USER MOD Single : A 20 LYS NZ :NH3+ 167:sc= 0.832 (180deg=0.59) USER MOD Single : A 23 GLN : amide:sc= 0.046 X(o=0.046,f=-0.057) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= 0.232 K(o=0.23,f=-7!) USER MOD Single : A 28 ASN : amide:sc= -0.326 X(o=-0.33,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -166:sc=-0.00772 (180deg=-0.163) USER MOD Single : A 31 THR OG1 : rot 46:sc= -0.582 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -109:sc= 0.387 (180deg=-0.608) USER MOD Single : A 37 LYS NZ :NH3+ -163:sc= 0.27 (180deg=-0.101) USER MOD Single : A 39 LYS NZ :NH3+ -161:sc= 0.636 (180deg=0.279) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 159:sc= 1.38 (180deg=0.962) USER MOD Single : A 49 LYS NZ :NH3+ 166:sc= -0.0406 (180deg=-0.244) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 67 LYS NZ :NH3+ -124:sc=0.000904 (180deg=0) USER MOD Single : A 72 TYR OH : rot -100:sc= 0.108 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -133:sc= 0.919 (180deg=-0.303) USER MOD Single : A 100 LYS NZ :NH3+ -171:sc= -0.0012 (180deg=-0.0892) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 143:sc= 0.896 (180deg=-0.521) USER MOD Single : A 104 TYR OH : rot 180:sc= -0.209 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -20:sc= -0.203 USER MOD Single : A 111 ASN : amide:sc= -3.04! K(o=-3!,f=-0.047) USER MOD Single : A 116 LYS NZ :NH3+ -165:sc= 0.319 (180deg=0.199) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -116:sc= 0.904 (180deg=-0.219) USER MOD Single : A 120 LYS NZ :NH3+ -127:sc= 0.00122 (180deg=-0.277) USER MOD Single : A 126 SER OG : rot 5:sc= 0.344 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -3.36! K(o=-3.4!,f=-0.92) USER MOD Single : A 132 HIS : no HD1:sc= -0.136 X(o=-0.14,f=-0.45) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HE2:sc= -0.0024 K(o=-0.0024,f=-3.8!) USER MOD Single : A 135 HIS : no HD1:sc= -0.512 K(o=-0.51,f=0) USER MOD Single : A 136 HIS : no HE2:sc= -0.0251 K(o=-0.025,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.005 -2.283 16.344 1.00 51.51 N ATOM 2 CA MET A 1 3.464 -2.468 16.514 1.00 34.14 C ATOM 3 C MET A 1 4.237 -2.118 15.225 1.00 51.45 C ATOM 4 O MET A 1 5.455 -2.270 15.188 1.00 51.22 O ATOM 5 CB MET A 1 3.772 -3.926 16.963 1.00 62.03 C ATOM 6 CG MET A 1 3.379 -5.020 15.954 1.00 1.40 C ATOM 7 SD MET A 1 3.861 -6.679 16.480 1.00 14.34 S ATOM 8 CE MET A 1 5.649 -6.526 16.600 1.00 3.33 C ATOM 0 H1 MET A 1 1.523 -2.478 17.245 1.00 51.51 H new ATOM 0 H2 MET A 1 1.811 -1.304 16.053 1.00 51.51 H new ATOM 0 H3 MET A 1 1.655 -2.937 15.615 1.00 51.51 H new ATOM 0 HA MET A 1 3.801 -1.781 17.291 1.00 34.14 H new ATOM 0 HB2 MET A 1 4.840 -4.009 17.166 1.00 62.03 H new ATOM 0 HB3 MET A 1 3.253 -4.117 17.902 1.00 62.03 H new ATOM 0 HG2 MET A 1 2.300 -4.993 15.801 1.00 1.40 H new ATOM 0 HG3 MET A 1 3.843 -4.802 14.992 1.00 1.40 H new ATOM 0 HE1 MET A 1 6.119 -7.424 16.199 1.00 3.33 H new ATOM 0 HE2 MET A 1 5.979 -5.658 16.029 1.00 3.33 H new ATOM 0 HE3 MET A 1 5.934 -6.403 17.645 1.00 3.33 H new ATOM 20 N GLY A 2 3.522 -1.644 14.184 1.00 65.42 N ATOM 21 CA GLY A 2 4.127 -1.314 12.884 1.00 65.25 C ATOM 22 C GLY A 2 3.060 -0.992 11.848 1.00 72.25 C ATOM 23 O GLY A 2 1.890 -0.841 12.208 1.00 25.02 O ATOM 0 H GLY A 2 2.516 -1.481 14.223 1.00 65.42 H new ATOM 0 HA2 GLY A 2 4.797 -0.462 12.997 1.00 65.25 H new ATOM 0 HA3 GLY A 2 4.733 -2.152 12.538 1.00 65.25 H new ATOM 27 N VAL A 3 3.443 -0.880 10.560 1.00 34.23 N ATOM 28 CA VAL A 3 2.509 -0.489 9.469 1.00 52.20 C ATOM 29 C VAL A 3 2.819 -1.268 8.164 1.00 23.01 C ATOM 30 O VAL A 3 3.978 -1.587 7.881 1.00 20.10 O ATOM 31 CB VAL A 3 2.567 1.081 9.213 1.00 61.11 C ATOM 32 CG1 VAL A 3 1.776 1.511 7.957 1.00 22.30 C ATOM 33 CG2 VAL A 3 2.059 1.859 10.453 1.00 12.13 C ATOM 0 H VAL A 3 4.396 -1.055 10.242 1.00 34.23 H new ATOM 0 HA VAL A 3 1.498 -0.748 9.784 1.00 52.20 H new ATOM 0 HB VAL A 3 3.614 1.327 9.036 1.00 61.11 H new ATOM 0 HG11 VAL A 3 1.851 2.591 7.832 1.00 22.30 H new ATOM 0 HG12 VAL A 3 2.189 1.015 7.079 1.00 22.30 H new ATOM 0 HG13 VAL A 3 0.729 1.231 8.073 1.00 22.30 H new ATOM 0 HG21 VAL A 3 2.108 2.930 10.256 1.00 12.13 H new ATOM 0 HG22 VAL A 3 1.028 1.575 10.663 1.00 12.13 H new ATOM 0 HG23 VAL A 3 2.684 1.620 11.314 1.00 12.13 H new ATOM 43 N VAL A 4 1.757 -1.594 7.388 1.00 71.04 N ATOM 44 CA VAL A 4 1.865 -2.180 6.036 1.00 72.20 C ATOM 45 C VAL A 4 1.038 -1.326 5.063 1.00 54.51 C ATOM 46 O VAL A 4 -0.191 -1.278 5.167 1.00 10.42 O ATOM 47 CB VAL A 4 1.350 -3.670 5.989 1.00 75.04 C ATOM 48 CG1 VAL A 4 1.422 -4.256 4.556 1.00 43.40 C ATOM 49 CG2 VAL A 4 2.126 -4.555 6.983 1.00 54.13 C ATOM 0 H VAL A 4 0.793 -1.455 7.689 1.00 71.04 H new ATOM 0 HA VAL A 4 2.918 -2.189 5.753 1.00 72.20 H new ATOM 0 HB VAL A 4 0.302 -3.661 6.287 1.00 75.04 H new ATOM 0 HG11 VAL A 4 1.059 -5.284 4.565 1.00 43.40 H new ATOM 0 HG12 VAL A 4 0.803 -3.658 3.887 1.00 43.40 H new ATOM 0 HG13 VAL A 4 2.455 -4.239 4.207 1.00 43.40 H new ATOM 0 HG21 VAL A 4 1.751 -5.577 6.930 1.00 54.13 H new ATOM 0 HG22 VAL A 4 3.186 -4.544 6.729 1.00 54.13 H new ATOM 0 HG23 VAL A 4 1.991 -4.171 7.994 1.00 54.13 H new ATOM 59 N ILE A 5 1.719 -0.654 4.133 1.00 73.20 N ATOM 60 CA ILE A 5 1.085 0.158 3.087 1.00 61.14 C ATOM 61 C ILE A 5 0.920 -0.684 1.801 1.00 20.03 C ATOM 62 O ILE A 5 1.897 -0.961 1.125 1.00 22.54 O ATOM 63 CB ILE A 5 1.960 1.440 2.793 1.00 5.25 C ATOM 64 CG1 ILE A 5 2.186 2.266 4.103 1.00 61.32 C ATOM 65 CG2 ILE A 5 1.328 2.311 1.678 1.00 55.25 C ATOM 66 CD1 ILE A 5 3.096 3.469 3.950 1.00 52.05 C ATOM 0 H ILE A 5 2.738 -0.657 4.082 1.00 73.20 H new ATOM 0 HA ILE A 5 0.101 0.478 3.429 1.00 61.14 H new ATOM 0 HB ILE A 5 2.933 1.109 2.431 1.00 5.25 H new ATOM 0 HG12 ILE A 5 1.218 2.605 4.473 1.00 61.32 H new ATOM 0 HG13 ILE A 5 2.604 1.607 4.863 1.00 61.32 H new ATOM 0 HG21 ILE A 5 1.955 3.185 1.500 1.00 55.25 H new ATOM 0 HG22 ILE A 5 1.250 1.727 0.761 1.00 55.25 H new ATOM 0 HG23 ILE A 5 0.334 2.634 1.988 1.00 55.25 H new ATOM 0 HD11 ILE A 5 3.192 3.977 4.910 1.00 52.05 H new ATOM 0 HD12 ILE A 5 4.079 3.141 3.613 1.00 52.05 H new ATOM 0 HD13 ILE A 5 2.672 4.155 3.217 1.00 52.05 H new ATOM 78 N LEU A 6 -0.313 -1.085 1.475 1.00 44.15 N ATOM 79 CA LEU A 6 -0.644 -1.791 0.225 1.00 51.25 C ATOM 80 C LEU A 6 -1.164 -0.767 -0.801 1.00 14.12 C ATOM 81 O LEU A 6 -2.298 -0.290 -0.688 1.00 33.14 O ATOM 82 CB LEU A 6 -1.726 -2.876 0.502 1.00 43.25 C ATOM 83 CG LEU A 6 -1.417 -3.892 1.646 1.00 75.32 C ATOM 84 CD1 LEU A 6 -2.666 -4.704 2.025 1.00 23.21 C ATOM 85 CD2 LEU A 6 -0.257 -4.823 1.268 1.00 63.44 C ATOM 0 H LEU A 6 -1.122 -0.928 2.077 1.00 44.15 H new ATOM 0 HA LEU A 6 0.244 -2.283 -0.171 1.00 51.25 H new ATOM 0 HB2 LEU A 6 -2.663 -2.371 0.738 1.00 43.25 H new ATOM 0 HB3 LEU A 6 -1.889 -3.437 -0.418 1.00 43.25 H new ATOM 0 HG LEU A 6 -1.113 -3.315 2.519 1.00 75.32 H new ATOM 0 HD11 LEU A 6 -2.417 -5.402 2.824 1.00 23.21 H new ATOM 0 HD12 LEU A 6 -3.450 -4.028 2.365 1.00 23.21 H new ATOM 0 HD13 LEU A 6 -3.017 -5.259 1.155 1.00 23.21 H new ATOM 0 HD21 LEU A 6 -0.067 -5.518 2.086 1.00 63.44 H new ATOM 0 HD22 LEU A 6 -0.517 -5.382 0.369 1.00 63.44 H new ATOM 0 HD23 LEU A 6 0.638 -4.231 1.080 1.00 63.44 H new ATOM 97 N VAL A 7 -0.330 -0.406 -1.784 1.00 30.10 N ATOM 98 CA VAL A 7 -0.688 0.569 -2.829 1.00 23.35 C ATOM 99 C VAL A 7 -1.264 -0.172 -4.058 1.00 62.43 C ATOM 100 O VAL A 7 -0.509 -0.797 -4.803 1.00 64.31 O ATOM 101 CB VAL A 7 0.553 1.454 -3.246 1.00 74.45 C ATOM 102 CG1 VAL A 7 0.166 2.544 -4.276 1.00 10.41 C ATOM 103 CG2 VAL A 7 1.225 2.085 -2.006 1.00 35.32 C ATOM 0 H VAL A 7 0.614 -0.781 -1.880 1.00 30.10 H new ATOM 0 HA VAL A 7 -1.446 1.240 -2.425 1.00 23.35 H new ATOM 0 HB VAL A 7 1.273 0.792 -3.727 1.00 74.45 H new ATOM 0 HG11 VAL A 7 1.048 3.129 -4.535 1.00 10.41 H new ATOM 0 HG12 VAL A 7 -0.232 2.071 -5.174 1.00 10.41 H new ATOM 0 HG13 VAL A 7 -0.591 3.200 -3.845 1.00 10.41 H new ATOM 0 HG21 VAL A 7 2.076 2.689 -2.321 1.00 35.32 H new ATOM 0 HG22 VAL A 7 0.506 2.716 -1.484 1.00 35.32 H new ATOM 0 HG23 VAL A 7 1.568 1.296 -1.337 1.00 35.32 H new ATOM 113 N LEU A 8 -2.599 -0.079 -4.257 1.00 74.13 N ATOM 114 CA LEU A 8 -3.317 -0.726 -5.379 1.00 5.13 C ATOM 115 C LEU A 8 -3.290 0.220 -6.591 1.00 12.24 C ATOM 116 O LEU A 8 -4.049 1.186 -6.639 1.00 65.11 O ATOM 117 CB LEU A 8 -4.801 -1.050 -4.992 1.00 11.14 C ATOM 118 CG LEU A 8 -5.049 -2.274 -4.049 1.00 13.03 C ATOM 119 CD1 LEU A 8 -4.377 -2.098 -2.672 1.00 44.21 C ATOM 120 CD2 LEU A 8 -6.567 -2.561 -3.908 1.00 74.41 C ATOM 0 H LEU A 8 -3.213 0.451 -3.639 1.00 74.13 H new ATOM 0 HA LEU A 8 -2.822 -1.667 -5.620 1.00 5.13 H new ATOM 0 HB2 LEU A 8 -5.225 -0.166 -4.515 1.00 11.14 H new ATOM 0 HB3 LEU A 8 -5.361 -1.215 -5.913 1.00 11.14 H new ATOM 0 HG LEU A 8 -4.580 -3.141 -4.514 1.00 13.03 H new ATOM 0 HD11 LEU A 8 -4.578 -2.973 -2.054 1.00 44.21 H new ATOM 0 HD12 LEU A 8 -3.301 -1.987 -2.804 1.00 44.21 H new ATOM 0 HD13 LEU A 8 -4.776 -1.209 -2.183 1.00 44.21 H new ATOM 0 HD21 LEU A 8 -6.716 -3.416 -3.248 1.00 74.41 H new ATOM 0 HD22 LEU A 8 -7.065 -1.687 -3.488 1.00 74.41 H new ATOM 0 HD23 LEU A 8 -6.988 -2.782 -4.889 1.00 74.41 H new ATOM 132 N THR A 9 -2.436 -0.078 -7.574 1.00 63.24 N ATOM 133 CA THR A 9 -2.218 0.787 -8.736 1.00 31.33 C ATOM 134 C THR A 9 -2.860 0.167 -9.983 1.00 21.44 C ATOM 135 O THR A 9 -2.745 -1.043 -10.219 1.00 23.54 O ATOM 136 CB THR A 9 -0.684 0.990 -8.984 1.00 2.33 C ATOM 137 OG1 THR A 9 -0.020 -0.288 -9.015 1.00 60.33 O ATOM 138 CG2 THR A 9 -0.027 1.874 -7.908 1.00 62.14 C ATOM 0 H THR A 9 -1.874 -0.929 -7.586 1.00 63.24 H new ATOM 0 HA THR A 9 -2.678 1.755 -8.537 1.00 31.33 H new ATOM 0 HB THR A 9 -0.579 1.498 -9.943 1.00 2.33 H new ATOM 0 HG1 THR A 9 0.412 -0.411 -9.886 1.00 60.33 H new ATOM 0 HG21 THR A 9 1.035 1.983 -8.126 1.00 62.14 H new ATOM 0 HG22 THR A 9 -0.500 2.856 -7.905 1.00 62.14 H new ATOM 0 HG23 THR A 9 -0.151 1.409 -6.930 1.00 62.14 H new ATOM 146 N GLY A 10 -3.514 1.018 -10.786 1.00 44.33 N ATOM 147 CA GLY A 10 -4.063 0.634 -12.082 1.00 34.44 C ATOM 148 C GLY A 10 -3.096 0.971 -13.214 1.00 12.41 C ATOM 149 O GLY A 10 -3.522 1.215 -14.349 1.00 54.35 O ATOM 0 H GLY A 10 -3.675 1.997 -10.548 1.00 44.33 H new ATOM 0 HA2 GLY A 10 -4.275 -0.435 -12.088 1.00 34.44 H new ATOM 0 HA3 GLY A 10 -5.011 1.148 -12.245 1.00 34.44 H new ATOM 153 N ASP A 11 -1.792 1.000 -12.884 1.00 15.12 N ATOM 154 CA ASP A 11 -0.712 1.264 -13.834 1.00 72.20 C ATOM 155 C ASP A 11 0.625 0.858 -13.189 1.00 30.11 C ATOM 156 O ASP A 11 0.867 1.162 -12.012 1.00 54.42 O ATOM 157 CB ASP A 11 -0.678 2.754 -14.257 1.00 62.53 C ATOM 158 CG ASP A 11 0.370 3.031 -15.349 1.00 13.12 C ATOM 159 OD1 ASP A 11 0.071 2.808 -16.544 1.00 41.34 O ATOM 160 OD2 ASP A 11 1.508 3.428 -15.023 1.00 52.03 O ATOM 0 H ASP A 11 -1.461 0.837 -11.933 1.00 15.12 H new ATOM 0 HA ASP A 11 -0.885 0.677 -14.736 1.00 72.20 H new ATOM 0 HB2 ASP A 11 -1.663 3.048 -14.620 1.00 62.53 H new ATOM 0 HB3 ASP A 11 -0.462 3.371 -13.385 1.00 62.53 H new ATOM 165 N GLU A 12 1.477 0.192 -13.982 1.00 43.15 N ATOM 166 CA GLU A 12 2.757 -0.371 -13.526 1.00 10.15 C ATOM 167 C GLU A 12 3.787 0.734 -13.236 1.00 22.23 C ATOM 168 O GLU A 12 4.467 0.711 -12.200 1.00 71.14 O ATOM 169 CB GLU A 12 3.299 -1.321 -14.617 1.00 21.11 C ATOM 170 CG GLU A 12 4.597 -2.067 -14.247 1.00 44.43 C ATOM 171 CD GLU A 12 5.194 -2.825 -15.441 1.00 43.05 C ATOM 172 OE1 GLU A 12 4.666 -3.900 -15.805 1.00 34.20 O ATOM 173 OE2 GLU A 12 6.171 -2.332 -16.046 1.00 41.33 O ATOM 0 H GLU A 12 1.294 0.027 -14.972 1.00 43.15 H new ATOM 0 HA GLU A 12 2.589 -0.916 -12.597 1.00 10.15 H new ATOM 0 HB2 GLU A 12 2.530 -2.057 -14.852 1.00 21.11 H new ATOM 0 HB3 GLU A 12 3.476 -0.744 -15.525 1.00 21.11 H new ATOM 0 HG2 GLU A 12 5.329 -1.353 -13.870 1.00 44.43 H new ATOM 0 HG3 GLU A 12 4.392 -2.770 -13.439 1.00 44.43 H new ATOM 180 N ARG A 13 3.887 1.702 -14.164 1.00 50.43 N ATOM 181 CA ARG A 13 4.895 2.771 -14.093 1.00 42.01 C ATOM 182 C ARG A 13 4.629 3.713 -12.912 1.00 25.23 C ATOM 183 O ARG A 13 5.577 4.194 -12.310 1.00 30.31 O ATOM 184 CB ARG A 13 4.981 3.562 -15.424 1.00 23.23 C ATOM 185 CG ARG A 13 5.577 2.765 -16.607 1.00 20.34 C ATOM 186 CD ARG A 13 7.019 2.275 -16.346 1.00 52.14 C ATOM 187 NE ARG A 13 7.579 1.547 -17.500 1.00 31.31 N ATOM 188 CZ ARG A 13 8.829 1.066 -17.584 1.00 65.11 C ATOM 189 NH1 ARG A 13 9.699 1.215 -16.588 1.00 22.30 N ATOM 190 NH2 ARG A 13 9.211 0.444 -18.687 1.00 44.53 N ATOM 0 H ARG A 13 3.276 1.764 -14.978 1.00 50.43 H new ATOM 0 HA ARG A 13 5.861 2.293 -13.929 1.00 42.01 H new ATOM 0 HB2 ARG A 13 3.981 3.899 -15.697 1.00 23.23 H new ATOM 0 HB3 ARG A 13 5.585 4.455 -15.263 1.00 23.23 H new ATOM 0 HG2 ARG A 13 4.940 1.905 -16.815 1.00 20.34 H new ATOM 0 HG3 ARG A 13 5.569 3.391 -17.499 1.00 20.34 H new ATOM 0 HD2 ARG A 13 7.655 3.130 -16.115 1.00 52.14 H new ATOM 0 HD3 ARG A 13 7.027 1.626 -15.471 1.00 52.14 H new ATOM 0 HE ARG A 13 6.965 1.397 -18.301 1.00 31.31 H new ATOM 0 HH11 ARG A 13 9.421 1.704 -15.737 1.00 22.30 H new ATOM 0 HH12 ARG A 13 10.644 0.840 -16.676 1.00 22.30 H new ATOM 0 HH21 ARG A 13 8.558 0.334 -19.463 1.00 44.53 H new ATOM 0 HH22 ARG A 13 10.159 0.074 -18.762 1.00 44.53 H new ATOM 204 N ILE A 14 3.344 3.949 -12.573 1.00 64.13 N ATOM 205 CA ILE A 14 2.980 4.758 -11.393 1.00 62.12 C ATOM 206 C ILE A 14 3.534 4.093 -10.114 1.00 1.14 C ATOM 207 O ILE A 14 4.165 4.759 -9.291 1.00 72.21 O ATOM 208 CB ILE A 14 1.426 4.985 -11.261 1.00 72.24 C ATOM 209 CG1 ILE A 14 0.878 5.816 -12.470 1.00 33.43 C ATOM 210 CG2 ILE A 14 1.083 5.680 -9.918 1.00 2.14 C ATOM 211 CD1 ILE A 14 -0.622 6.087 -12.431 1.00 15.24 C ATOM 0 H ILE A 14 2.545 3.592 -13.098 1.00 64.13 H new ATOM 0 HA ILE A 14 3.429 5.742 -11.526 1.00 62.12 H new ATOM 0 HB ILE A 14 0.941 4.009 -11.273 1.00 72.24 H new ATOM 0 HG12 ILE A 14 1.405 6.770 -12.506 1.00 33.43 H new ATOM 0 HG13 ILE A 14 1.114 5.287 -13.393 1.00 33.43 H new ATOM 0 HG21 ILE A 14 0.005 5.826 -9.849 1.00 2.14 H new ATOM 0 HG22 ILE A 14 1.418 5.056 -9.089 1.00 2.14 H new ATOM 0 HG23 ILE A 14 1.584 6.647 -9.870 1.00 2.14 H new ATOM 0 HD11 ILE A 14 -0.910 6.668 -13.307 1.00 15.24 H new ATOM 0 HD12 ILE A 14 -1.163 5.141 -12.429 1.00 15.24 H new ATOM 0 HD13 ILE A 14 -0.867 6.647 -11.528 1.00 15.24 H new ATOM 223 N ALA A 15 3.324 2.766 -9.996 1.00 23.44 N ATOM 224 CA ALA A 15 3.857 1.952 -8.880 1.00 0.23 C ATOM 225 C ALA A 15 5.401 2.051 -8.782 1.00 54.33 C ATOM 226 O ALA A 15 5.967 2.076 -7.686 1.00 31.34 O ATOM 227 CB ALA A 15 3.420 0.489 -9.046 1.00 3.42 C ATOM 0 H ALA A 15 2.781 2.227 -10.670 1.00 23.44 H new ATOM 0 HA ALA A 15 3.448 2.347 -7.950 1.00 0.23 H new ATOM 0 HB1 ALA A 15 3.815 -0.105 -8.222 1.00 3.42 H new ATOM 0 HB2 ALA A 15 2.331 0.432 -9.045 1.00 3.42 H new ATOM 0 HB3 ALA A 15 3.803 0.100 -9.990 1.00 3.42 H new ATOM 233 N GLU A 16 6.052 2.121 -9.953 1.00 72.33 N ATOM 234 CA GLU A 16 7.510 2.264 -10.070 1.00 3.41 C ATOM 235 C GLU A 16 7.971 3.662 -9.595 1.00 75.01 C ATOM 236 O GLU A 16 8.982 3.781 -8.892 1.00 61.22 O ATOM 237 CB GLU A 16 7.925 2.021 -11.541 1.00 35.44 C ATOM 238 CG GLU A 16 9.423 2.210 -11.812 1.00 0.11 C ATOM 239 CD GLU A 16 9.807 1.978 -13.277 1.00 2.23 C ATOM 240 OE1 GLU A 16 9.858 0.809 -13.707 1.00 14.45 O ATOM 241 OE2 GLU A 16 10.084 2.959 -14.002 1.00 33.22 O ATOM 0 H GLU A 16 5.576 2.079 -10.854 1.00 72.33 H new ATOM 0 HA GLU A 16 7.994 1.526 -9.430 1.00 3.41 H new ATOM 0 HB2 GLU A 16 7.641 1.007 -11.824 1.00 35.44 H new ATOM 0 HB3 GLU A 16 7.363 2.700 -12.182 1.00 35.44 H new ATOM 0 HG2 GLU A 16 9.713 3.220 -11.523 1.00 0.11 H new ATOM 0 HG3 GLU A 16 9.989 1.524 -11.182 1.00 0.11 H new ATOM 248 N GLU A 17 7.210 4.705 -9.964 1.00 33.11 N ATOM 249 CA GLU A 17 7.551 6.105 -9.627 1.00 42.45 C ATOM 250 C GLU A 17 7.386 6.368 -8.120 1.00 12.15 C ATOM 251 O GLU A 17 8.128 7.160 -7.526 1.00 75.24 O ATOM 252 CB GLU A 17 6.682 7.109 -10.433 1.00 15.35 C ATOM 253 CG GLU A 17 6.791 6.996 -11.967 1.00 42.44 C ATOM 254 CD GLU A 17 8.235 6.862 -12.490 1.00 64.31 C ATOM 255 OE1 GLU A 17 9.019 7.833 -12.371 1.00 22.40 O ATOM 256 OE2 GLU A 17 8.602 5.790 -13.026 1.00 42.52 O ATOM 0 H GLU A 17 6.347 4.608 -10.500 1.00 33.11 H new ATOM 0 HA GLU A 17 8.596 6.255 -9.898 1.00 42.45 H new ATOM 0 HB2 GLU A 17 5.639 6.970 -10.149 1.00 15.35 H new ATOM 0 HB3 GLU A 17 6.960 8.121 -10.140 1.00 15.35 H new ATOM 0 HG2 GLU A 17 6.215 6.132 -12.298 1.00 42.44 H new ATOM 0 HG3 GLU A 17 6.333 7.876 -12.418 1.00 42.44 H new ATOM 263 N LEU A 18 6.398 5.683 -7.527 1.00 24.33 N ATOM 264 CA LEU A 18 6.119 5.743 -6.089 1.00 72.10 C ATOM 265 C LEU A 18 7.211 4.997 -5.299 1.00 31.34 C ATOM 266 O LEU A 18 7.557 5.400 -4.191 1.00 42.43 O ATOM 267 CB LEU A 18 4.718 5.147 -5.798 1.00 72.24 C ATOM 268 CG LEU A 18 3.504 5.906 -6.420 1.00 54.00 C ATOM 269 CD1 LEU A 18 2.175 5.177 -6.114 1.00 2.41 C ATOM 270 CD2 LEU A 18 3.468 7.382 -5.961 1.00 71.21 C ATOM 0 H LEU A 18 5.766 5.067 -8.038 1.00 24.33 H new ATOM 0 HA LEU A 18 6.124 6.785 -5.768 1.00 72.10 H new ATOM 0 HB2 LEU A 18 4.701 4.119 -6.160 1.00 72.24 H new ATOM 0 HB3 LEU A 18 4.580 5.107 -4.717 1.00 72.24 H new ATOM 0 HG LEU A 18 3.631 5.910 -7.503 1.00 54.00 H new ATOM 0 HD11 LEU A 18 1.347 5.728 -6.559 1.00 2.41 H new ATOM 0 HD12 LEU A 18 2.207 4.171 -6.532 1.00 2.41 H new ATOM 0 HD13 LEU A 18 2.033 5.118 -5.035 1.00 2.41 H new ATOM 0 HD21 LEU A 18 2.611 7.882 -6.412 1.00 71.21 H new ATOM 0 HD22 LEU A 18 3.383 7.423 -4.875 1.00 71.21 H new ATOM 0 HD23 LEU A 18 4.385 7.882 -6.272 1.00 71.21 H new ATOM 282 N ARG A 19 7.746 3.913 -5.901 1.00 52.22 N ATOM 283 CA ARG A 19 8.891 3.148 -5.348 1.00 40.01 C ATOM 284 C ARG A 19 10.115 4.059 -5.185 1.00 51.01 C ATOM 285 O ARG A 19 10.771 4.062 -4.140 1.00 4.31 O ATOM 286 CB ARG A 19 9.234 1.945 -6.271 1.00 20.11 C ATOM 287 CG ARG A 19 10.523 1.185 -5.895 1.00 13.41 C ATOM 288 CD ARG A 19 10.742 -0.073 -6.752 1.00 4.25 C ATOM 289 NE ARG A 19 10.956 0.234 -8.178 1.00 63.24 N ATOM 290 CZ ARG A 19 10.893 -0.654 -9.184 1.00 40.52 C ATOM 291 NH1 ARG A 19 10.609 -1.940 -8.961 1.00 0.54 N ATOM 292 NH2 ARG A 19 11.162 -0.257 -10.416 1.00 50.12 N ATOM 0 H ARG A 19 7.398 3.541 -6.785 1.00 52.22 H new ATOM 0 HA ARG A 19 8.610 2.765 -4.367 1.00 40.01 H new ATOM 0 HB2 ARG A 19 8.399 1.245 -6.256 1.00 20.11 H new ATOM 0 HB3 ARG A 19 9.328 2.307 -7.295 1.00 20.11 H new ATOM 0 HG2 ARG A 19 11.379 1.851 -6.009 1.00 13.41 H new ATOM 0 HG3 ARG A 19 10.478 0.900 -4.844 1.00 13.41 H new ATOM 0 HD2 ARG A 19 11.603 -0.621 -6.370 1.00 4.25 H new ATOM 0 HD3 ARG A 19 9.877 -0.729 -6.653 1.00 4.25 H new ATOM 0 HE ARG A 19 11.170 1.201 -8.421 1.00 63.24 H new ATOM 0 HH11 ARG A 19 10.434 -2.266 -8.011 1.00 0.54 H new ATOM 0 HH12 ARG A 19 10.567 -2.596 -9.741 1.00 0.54 H new ATOM 0 HH21 ARG A 19 11.414 0.715 -10.595 1.00 50.12 H new ATOM 0 HH22 ARG A 19 11.117 -0.923 -11.188 1.00 50.12 H new ATOM 306 N LYS A 20 10.377 4.837 -6.248 1.00 12.13 N ATOM 307 CA LYS A 20 11.478 5.816 -6.303 1.00 74.22 C ATOM 308 C LYS A 20 11.292 6.910 -5.238 1.00 44.34 C ATOM 309 O LYS A 20 12.271 7.419 -4.671 1.00 11.23 O ATOM 310 CB LYS A 20 11.536 6.447 -7.725 1.00 3.00 C ATOM 311 CG LYS A 20 11.800 5.427 -8.854 1.00 72.35 C ATOM 312 CD LYS A 20 11.601 6.018 -10.270 1.00 74.54 C ATOM 313 CE LYS A 20 11.829 4.968 -11.374 1.00 34.34 C ATOM 314 NZ LYS A 20 11.513 5.495 -12.730 1.00 10.13 N ATOM 0 H LYS A 20 9.824 4.804 -7.104 1.00 12.13 H new ATOM 0 HA LYS A 20 12.418 5.304 -6.095 1.00 74.22 H new ATOM 0 HB2 LYS A 20 10.594 6.958 -7.924 1.00 3.00 H new ATOM 0 HB3 LYS A 20 12.319 7.205 -7.743 1.00 3.00 H new ATOM 0 HG2 LYS A 20 12.819 5.052 -8.764 1.00 72.35 H new ATOM 0 HG3 LYS A 20 11.134 4.574 -8.727 1.00 72.35 H new ATOM 0 HD2 LYS A 20 10.592 6.420 -10.356 1.00 74.54 H new ATOM 0 HD3 LYS A 20 12.289 6.851 -10.415 1.00 74.54 H new ATOM 0 HE2 LYS A 20 12.867 4.637 -11.348 1.00 34.34 H new ATOM 0 HE3 LYS A 20 11.210 4.093 -11.173 1.00 34.34 H new ATOM 0 HZ1 LYS A 20 11.884 4.843 -13.451 1.00 10.13 H new ATOM 0 HZ2 LYS A 20 10.482 5.580 -12.838 1.00 10.13 H new ATOM 0 HZ3 LYS A 20 11.952 6.430 -12.850 1.00 10.13 H new ATOM 328 N GLU A 21 10.023 7.245 -4.969 1.00 20.11 N ATOM 329 CA GLU A 21 9.650 8.298 -4.017 1.00 31.42 C ATOM 330 C GLU A 21 9.921 7.866 -2.561 1.00 23.43 C ATOM 331 O GLU A 21 10.383 8.675 -1.737 1.00 4.51 O ATOM 332 CB GLU A 21 8.157 8.670 -4.220 1.00 12.14 C ATOM 333 CG GLU A 21 7.707 9.931 -3.465 1.00 62.10 C ATOM 334 CD GLU A 21 8.578 11.161 -3.794 1.00 71.23 C ATOM 335 OE1 GLU A 21 8.622 11.568 -4.975 1.00 34.13 O ATOM 336 OE2 GLU A 21 9.213 11.731 -2.883 1.00 53.22 O ATOM 0 H GLU A 21 9.223 6.790 -5.408 1.00 20.11 H new ATOM 0 HA GLU A 21 10.267 9.176 -4.208 1.00 31.42 H new ATOM 0 HB2 GLU A 21 7.973 8.814 -5.285 1.00 12.14 H new ATOM 0 HB3 GLU A 21 7.540 7.831 -3.900 1.00 12.14 H new ATOM 0 HG2 GLU A 21 6.668 10.148 -3.715 1.00 62.10 H new ATOM 0 HG3 GLU A 21 7.744 9.741 -2.392 1.00 62.10 H new ATOM 343 N VAL A 22 9.646 6.579 -2.268 1.00 12.00 N ATOM 344 CA VAL A 22 9.888 5.980 -0.941 1.00 33.13 C ATOM 345 C VAL A 22 11.381 6.061 -0.569 1.00 61.25 C ATOM 346 O VAL A 22 11.723 6.274 0.590 1.00 2.23 O ATOM 347 CB VAL A 22 9.408 4.477 -0.888 1.00 64.11 C ATOM 348 CG1 VAL A 22 9.716 3.820 0.476 1.00 14.55 C ATOM 349 CG2 VAL A 22 7.907 4.364 -1.208 1.00 23.14 C ATOM 0 H VAL A 22 9.250 5.926 -2.945 1.00 12.00 H new ATOM 0 HA VAL A 22 9.307 6.552 -0.218 1.00 33.13 H new ATOM 0 HB VAL A 22 9.969 3.938 -1.651 1.00 64.11 H new ATOM 0 HG11 VAL A 22 9.369 2.787 0.469 1.00 14.55 H new ATOM 0 HG12 VAL A 22 10.791 3.841 0.655 1.00 14.55 H new ATOM 0 HG13 VAL A 22 9.206 4.369 1.268 1.00 14.55 H new ATOM 0 HG21 VAL A 22 7.603 3.318 -1.164 1.00 23.14 H new ATOM 0 HG22 VAL A 22 7.335 4.938 -0.479 1.00 23.14 H new ATOM 0 HG23 VAL A 22 7.718 4.755 -2.208 1.00 23.14 H new ATOM 359 N GLN A 23 12.260 5.943 -1.584 1.00 10.34 N ATOM 360 CA GLN A 23 13.728 5.906 -1.383 1.00 65.10 C ATOM 361 C GLN A 23 14.264 7.238 -0.822 1.00 34.42 C ATOM 362 O GLN A 23 15.237 7.253 -0.061 1.00 43.35 O ATOM 363 CB GLN A 23 14.451 5.569 -2.719 1.00 14.21 C ATOM 364 CG GLN A 23 13.902 4.319 -3.439 1.00 11.40 C ATOM 365 CD GLN A 23 13.914 3.036 -2.590 1.00 43.23 C ATOM 366 OE1 GLN A 23 14.807 2.823 -1.765 1.00 11.34 O ATOM 367 NE2 GLN A 23 12.902 2.189 -2.772 1.00 11.33 N ATOM 0 H GLN A 23 11.978 5.871 -2.562 1.00 10.34 H new ATOM 0 HA GLN A 23 13.935 5.125 -0.651 1.00 65.10 H new ATOM 0 HB2 GLN A 23 14.370 6.425 -3.389 1.00 14.21 H new ATOM 0 HB3 GLN A 23 15.512 5.422 -2.518 1.00 14.21 H new ATOM 0 HG2 GLN A 23 12.879 4.519 -3.758 1.00 11.40 H new ATOM 0 HG3 GLN A 23 14.489 4.148 -4.341 1.00 11.40 H new ATOM 0 HE21 GLN A 23 12.181 2.397 -3.463 1.00 11.33 H new ATOM 0 HE22 GLN A 23 12.848 1.333 -2.220 1.00 11.33 H new ATOM 376 N LYS A 24 13.615 8.351 -1.212 1.00 71.13 N ATOM 377 CA LYS A 24 14.044 9.713 -0.826 1.00 12.30 C ATOM 378 C LYS A 24 13.475 10.119 0.540 1.00 42.01 C ATOM 379 O LYS A 24 14.097 10.907 1.271 1.00 73.04 O ATOM 380 CB LYS A 24 13.623 10.735 -1.918 1.00 4.23 C ATOM 381 CG LYS A 24 14.197 10.431 -3.317 1.00 12.03 C ATOM 382 CD LYS A 24 15.739 10.275 -3.316 1.00 42.54 C ATOM 383 CE LYS A 24 16.299 9.961 -4.709 1.00 34.22 C ATOM 384 NZ LYS A 24 17.754 9.648 -4.678 1.00 23.32 N ATOM 0 H LYS A 24 12.782 8.335 -1.801 1.00 71.13 H new ATOM 0 HA LYS A 24 15.131 9.711 -0.740 1.00 12.30 H new ATOM 0 HB2 LYS A 24 12.535 10.757 -1.980 1.00 4.23 H new ATOM 0 HB3 LYS A 24 13.945 11.731 -1.613 1.00 4.23 H new ATOM 0 HG2 LYS A 24 13.745 9.516 -3.699 1.00 12.03 H new ATOM 0 HG3 LYS A 24 13.919 11.233 -4.000 1.00 12.03 H new ATOM 0 HD2 LYS A 24 16.193 11.193 -2.944 1.00 42.54 H new ATOM 0 HD3 LYS A 24 16.020 9.478 -2.627 1.00 42.54 H new ATOM 0 HE2 LYS A 24 15.757 9.116 -5.133 1.00 34.22 H new ATOM 0 HE3 LYS A 24 16.127 10.813 -5.367 1.00 34.22 H new ATOM 0 HZ1 LYS A 24 18.086 9.443 -5.642 1.00 23.32 H new ATOM 0 HZ2 LYS A 24 18.276 10.463 -4.298 1.00 23.32 H new ATOM 0 HZ3 LYS A 24 17.918 8.819 -4.072 1.00 23.32 H new ATOM 398 N HIS A 25 12.285 9.589 0.864 1.00 31.42 N ATOM 399 CA HIS A 25 11.641 9.821 2.165 1.00 20.32 C ATOM 400 C HIS A 25 12.359 8.992 3.248 1.00 43.35 C ATOM 401 O HIS A 25 12.878 9.529 4.235 1.00 63.53 O ATOM 402 CB HIS A 25 10.135 9.442 2.094 1.00 32.41 C ATOM 403 CG HIS A 25 9.323 9.837 3.310 1.00 13.44 C ATOM 404 ND1 HIS A 25 8.550 10.968 3.306 1.00 71.52 N ATOM 405 CD2 HIS A 25 9.182 9.224 4.515 1.00 53.35 C ATOM 406 CE1 HIS A 25 7.966 11.018 4.480 1.00 75.23 C ATOM 407 NE2 HIS A 25 8.311 9.985 5.248 1.00 1.45 N ATOM 0 H HIS A 25 11.746 8.992 0.236 1.00 31.42 H new ATOM 0 HA HIS A 25 11.714 10.878 2.422 1.00 20.32 H new ATOM 0 HB2 HIS A 25 9.697 9.913 1.214 1.00 32.41 H new ATOM 0 HB3 HIS A 25 10.052 8.364 1.954 1.00 32.41 H new ATOM 0 HD2 HIS A 25 9.664 8.312 4.833 1.00 53.35 H new ATOM 0 HE1 HIS A 25 7.288 11.801 4.787 1.00 75.23 H new ATOM 0 HE2 HIS A 25 7.989 9.798 6.197 1.00 1.45 H new ATOM 415 N ASP A 26 12.412 7.679 3.016 1.00 41.30 N ATOM 416 CA ASP A 26 13.013 6.710 3.938 1.00 63.14 C ATOM 417 C ASP A 26 13.489 5.472 3.141 1.00 62.33 C ATOM 418 O ASP A 26 12.672 4.610 2.787 1.00 35.21 O ATOM 419 CB ASP A 26 11.991 6.318 5.048 1.00 72.12 C ATOM 420 CG ASP A 26 12.607 5.460 6.175 1.00 3.44 C ATOM 421 OD1 ASP A 26 12.764 4.244 5.985 1.00 51.55 O ATOM 422 OD2 ASP A 26 12.935 5.994 7.259 1.00 62.13 O ATOM 0 H ASP A 26 12.034 7.252 2.171 1.00 41.30 H new ATOM 0 HA ASP A 26 13.877 7.156 4.430 1.00 63.14 H new ATOM 0 HB2 ASP A 26 11.571 7.226 5.481 1.00 72.12 H new ATOM 0 HB3 ASP A 26 11.166 5.770 4.594 1.00 72.12 H new ATOM 427 N PRO A 27 14.829 5.367 2.826 1.00 33.31 N ATOM 428 CA PRO A 27 15.395 4.224 2.055 1.00 63.54 C ATOM 429 C PRO A 27 15.370 2.883 2.823 1.00 22.45 C ATOM 430 O PRO A 27 15.666 1.834 2.242 1.00 40.53 O ATOM 431 CB PRO A 27 16.847 4.682 1.768 1.00 4.32 C ATOM 432 CG PRO A 27 17.175 5.623 2.886 1.00 35.25 C ATOM 433 CD PRO A 27 15.891 6.362 3.167 1.00 63.43 C ATOM 0 HA PRO A 27 14.810 4.013 1.159 1.00 63.54 H new ATOM 0 HB2 PRO A 27 17.533 3.835 1.749 1.00 4.32 H new ATOM 0 HB3 PRO A 27 16.923 5.176 0.799 1.00 4.32 H new ATOM 0 HG2 PRO A 27 17.520 5.083 3.768 1.00 35.25 H new ATOM 0 HG3 PRO A 27 17.972 6.311 2.602 1.00 35.25 H new ATOM 0 HD2 PRO A 27 15.828 6.674 4.210 1.00 63.43 H new ATOM 0 HD3 PRO A 27 15.806 7.263 2.559 1.00 63.43 H new ATOM 441 N ASN A 28 15.021 2.932 4.124 1.00 74.42 N ATOM 442 CA ASN A 28 14.960 1.732 4.986 1.00 32.11 C ATOM 443 C ASN A 28 13.642 0.978 4.762 1.00 65.54 C ATOM 444 O ASN A 28 13.537 -0.201 5.101 1.00 75.45 O ATOM 445 CB ASN A 28 15.122 2.107 6.482 1.00 43.41 C ATOM 446 CG ASN A 28 16.248 3.111 6.734 1.00 65.05 C ATOM 447 OD1 ASN A 28 17.417 2.740 6.857 1.00 40.13 O ATOM 448 ND2 ASN A 28 15.897 4.390 6.821 1.00 41.11 N ATOM 0 H ASN A 28 14.775 3.797 4.605 1.00 74.42 H new ATOM 0 HA ASN A 28 15.789 1.079 4.712 1.00 32.11 H new ATOM 0 HB2 ASN A 28 14.184 2.524 6.849 1.00 43.41 H new ATOM 0 HB3 ASN A 28 15.316 1.202 7.058 1.00 43.41 H new ATOM 0 HD21 ASN A 28 16.606 5.103 6.995 1.00 41.11 H new ATOM 0 HD22 ASN A 28 14.919 4.659 6.714 1.00 41.11 H new ATOM 455 N VAL A 29 12.634 1.678 4.216 1.00 24.12 N ATOM 456 CA VAL A 29 11.381 1.053 3.770 1.00 55.12 C ATOM 457 C VAL A 29 11.600 0.475 2.355 1.00 2.51 C ATOM 458 O VAL A 29 11.812 1.234 1.402 1.00 65.04 O ATOM 459 CB VAL A 29 10.180 2.083 3.754 1.00 1.21 C ATOM 460 CG1 VAL A 29 8.884 1.447 3.184 1.00 35.44 C ATOM 461 CG2 VAL A 29 9.937 2.680 5.159 1.00 11.50 C ATOM 0 H VAL A 29 12.665 2.687 4.073 1.00 24.12 H new ATOM 0 HA VAL A 29 11.116 0.262 4.472 1.00 55.12 H new ATOM 0 HB VAL A 29 10.462 2.898 3.087 1.00 1.21 H new ATOM 0 HG11 VAL A 29 8.083 2.186 3.190 1.00 35.44 H new ATOM 0 HG12 VAL A 29 9.062 1.113 2.162 1.00 35.44 H new ATOM 0 HG13 VAL A 29 8.596 0.595 3.799 1.00 35.44 H new ATOM 0 HG21 VAL A 29 9.106 3.384 5.116 1.00 11.50 H new ATOM 0 HG22 VAL A 29 9.698 1.879 5.858 1.00 11.50 H new ATOM 0 HG23 VAL A 29 10.835 3.199 5.494 1.00 11.50 H new ATOM 471 N LYS A 30 11.599 -0.866 2.242 1.00 3.03 N ATOM 472 CA LYS A 30 11.635 -1.564 0.942 1.00 73.30 C ATOM 473 C LYS A 30 10.227 -1.720 0.363 1.00 14.55 C ATOM 474 O LYS A 30 9.214 -1.672 1.085 1.00 54.33 O ATOM 475 CB LYS A 30 12.358 -2.939 1.020 1.00 21.25 C ATOM 476 CG LYS A 30 13.869 -2.866 0.714 1.00 71.22 C ATOM 477 CD LYS A 30 14.482 -4.250 0.434 1.00 10.31 C ATOM 478 CE LYS A 30 14.643 -5.113 1.698 1.00 20.44 C ATOM 479 NZ LYS A 30 15.641 -4.525 2.627 1.00 12.03 N ATOM 0 H LYS A 30 11.573 -1.494 3.045 1.00 3.03 H new ATOM 0 HA LYS A 30 12.220 -0.938 0.268 1.00 73.30 H new ATOM 0 HB2 LYS A 30 12.218 -3.356 2.017 1.00 21.25 H new ATOM 0 HB3 LYS A 30 11.887 -3.627 0.318 1.00 21.25 H new ATOM 0 HG2 LYS A 30 14.031 -2.219 -0.149 1.00 71.22 H new ATOM 0 HG3 LYS A 30 14.385 -2.408 1.557 1.00 71.22 H new ATOM 0 HD2 LYS A 30 13.853 -4.780 -0.281 1.00 10.31 H new ATOM 0 HD3 LYS A 30 15.457 -4.119 -0.035 1.00 10.31 H new ATOM 0 HE2 LYS A 30 13.682 -5.205 2.204 1.00 20.44 H new ATOM 0 HE3 LYS A 30 14.953 -6.120 1.417 1.00 20.44 H new ATOM 0 HZ1 LYS A 30 15.905 -5.230 3.345 1.00 12.03 H new ATOM 0 HZ2 LYS A 30 16.487 -4.241 2.093 1.00 12.03 H new ATOM 0 HZ3 LYS A 30 15.231 -3.692 3.095 1.00 12.03 H new ATOM 493 N THR A 31 10.193 -1.924 -0.962 1.00 1.31 N ATOM 494 CA THR A 31 8.966 -1.953 -1.751 1.00 41.31 C ATOM 495 C THR A 31 8.774 -3.335 -2.414 1.00 61.23 C ATOM 496 O THR A 31 9.636 -3.781 -3.178 1.00 73.51 O ATOM 497 CB THR A 31 9.027 -0.831 -2.833 1.00 14.21 C ATOM 498 OG1 THR A 31 10.230 -0.972 -3.604 1.00 35.42 O ATOM 499 CG2 THR A 31 8.993 0.582 -2.205 1.00 23.33 C ATOM 0 H THR A 31 11.034 -2.075 -1.519 1.00 1.31 H new ATOM 0 HA THR A 31 8.114 -1.778 -1.095 1.00 41.31 H new ATOM 0 HB THR A 31 8.149 -0.940 -3.469 1.00 14.21 H new ATOM 0 HG1 THR A 31 10.350 -1.912 -3.855 1.00 35.42 H new ATOM 0 HG21 THR A 31 9.037 1.332 -2.994 1.00 23.33 H new ATOM 0 HG22 THR A 31 8.070 0.706 -1.638 1.00 23.33 H new ATOM 0 HG23 THR A 31 9.847 0.705 -1.539 1.00 23.33 H new ATOM 507 N VAL A 32 7.641 -3.996 -2.116 1.00 22.21 N ATOM 508 CA VAL A 32 7.326 -5.356 -2.612 1.00 42.34 C ATOM 509 C VAL A 32 6.288 -5.272 -3.754 1.00 31.41 C ATOM 510 O VAL A 32 5.153 -4.890 -3.501 1.00 54.31 O ATOM 511 CB VAL A 32 6.749 -6.257 -1.458 1.00 75.34 C ATOM 512 CG1 VAL A 32 6.550 -7.723 -1.916 1.00 54.43 C ATOM 513 CG2 VAL A 32 7.638 -6.177 -0.210 1.00 24.51 C ATOM 0 H VAL A 32 6.911 -3.603 -1.521 1.00 22.21 H new ATOM 0 HA VAL A 32 8.249 -5.803 -2.980 1.00 42.34 H new ATOM 0 HB VAL A 32 5.764 -5.869 -1.198 1.00 75.34 H new ATOM 0 HG11 VAL A 32 6.150 -8.311 -1.090 1.00 54.43 H new ATOM 0 HG12 VAL A 32 5.852 -7.751 -2.753 1.00 54.43 H new ATOM 0 HG13 VAL A 32 7.508 -8.140 -2.228 1.00 54.43 H new ATOM 0 HG21 VAL A 32 7.220 -6.807 0.575 1.00 24.51 H new ATOM 0 HG22 VAL A 32 8.642 -6.521 -0.456 1.00 24.51 H new ATOM 0 HG23 VAL A 32 7.683 -5.145 0.139 1.00 24.51 H new ATOM 523 N PRO A 33 6.650 -5.602 -5.025 1.00 55.43 N ATOM 524 CA PRO A 33 5.686 -5.613 -6.148 1.00 3.13 C ATOM 525 C PRO A 33 4.839 -6.907 -6.193 1.00 71.01 C ATOM 526 O PRO A 33 5.058 -7.844 -5.408 1.00 74.44 O ATOM 527 CB PRO A 33 6.604 -5.469 -7.382 1.00 42.41 C ATOM 528 CG PRO A 33 7.890 -6.131 -6.982 1.00 33.13 C ATOM 529 CD PRO A 33 8.016 -5.977 -5.472 1.00 1.15 C ATOM 0 HA PRO A 33 4.937 -4.824 -6.074 1.00 3.13 H new ATOM 0 HB2 PRO A 33 6.168 -5.949 -8.258 1.00 42.41 H new ATOM 0 HB3 PRO A 33 6.761 -4.421 -7.638 1.00 42.41 H new ATOM 0 HG2 PRO A 33 7.886 -7.184 -7.264 1.00 33.13 H new ATOM 0 HG3 PRO A 33 8.737 -5.668 -7.489 1.00 33.13 H new ATOM 0 HD2 PRO A 33 8.347 -6.904 -5.004 1.00 1.15 H new ATOM 0 HD3 PRO A 33 8.745 -5.210 -5.210 1.00 1.15 H new ATOM 537 N THR A 34 3.892 -6.951 -7.148 1.00 3.32 N ATOM 538 CA THR A 34 2.890 -8.029 -7.265 1.00 21.03 C ATOM 539 C THR A 34 3.526 -9.395 -7.589 1.00 13.33 C ATOM 540 O THR A 34 3.005 -10.440 -7.186 1.00 33.01 O ATOM 541 CB THR A 34 1.841 -7.673 -8.363 1.00 32.10 C ATOM 542 OG1 THR A 34 2.500 -7.506 -9.636 1.00 34.52 O ATOM 543 CG2 THR A 34 1.079 -6.390 -8.026 1.00 23.42 C ATOM 0 H THR A 34 3.799 -6.233 -7.867 1.00 3.32 H new ATOM 0 HA THR A 34 2.403 -8.113 -6.294 1.00 21.03 H new ATOM 0 HB THR A 34 1.127 -8.495 -8.411 1.00 32.10 H new ATOM 0 HG1 THR A 34 1.836 -7.284 -10.322 1.00 34.52 H new ATOM 0 HG21 THR A 34 0.358 -6.177 -8.815 1.00 23.42 H new ATOM 0 HG22 THR A 34 0.554 -6.517 -7.079 1.00 23.42 H new ATOM 0 HG23 THR A 34 1.782 -5.561 -7.943 1.00 23.42 H new ATOM 551 N LYS A 35 4.660 -9.373 -8.320 1.00 13.14 N ATOM 552 CA LYS A 35 5.388 -10.600 -8.713 1.00 14.33 C ATOM 553 C LYS A 35 6.156 -11.235 -7.527 1.00 31.42 C ATOM 554 O LYS A 35 6.720 -12.327 -7.661 1.00 61.42 O ATOM 555 CB LYS A 35 6.306 -10.324 -9.956 1.00 2.55 C ATOM 556 CG LYS A 35 7.212 -9.057 -9.896 1.00 53.33 C ATOM 557 CD LYS A 35 8.400 -9.148 -8.912 1.00 74.53 C ATOM 558 CE LYS A 35 9.385 -10.287 -9.217 1.00 31.53 C ATOM 559 NZ LYS A 35 10.486 -10.336 -8.215 1.00 22.34 N ATOM 0 H LYS A 35 5.095 -8.512 -8.653 1.00 13.14 H new ATOM 0 HA LYS A 35 4.651 -11.345 -9.013 1.00 14.33 H new ATOM 0 HB2 LYS A 35 6.947 -11.193 -10.104 1.00 2.55 H new ATOM 0 HB3 LYS A 35 5.669 -10.244 -10.837 1.00 2.55 H new ATOM 0 HG2 LYS A 35 7.602 -8.860 -10.895 1.00 53.33 H new ATOM 0 HG3 LYS A 35 6.596 -8.201 -9.620 1.00 53.33 H new ATOM 0 HD2 LYS A 35 8.941 -8.202 -8.925 1.00 74.53 H new ATOM 0 HD3 LYS A 35 8.011 -9.279 -7.902 1.00 74.53 H new ATOM 0 HE2 LYS A 35 8.853 -11.238 -9.222 1.00 31.53 H new ATOM 0 HE3 LYS A 35 9.804 -10.151 -10.214 1.00 31.53 H new ATOM 0 HZ1 LYS A 35 11.373 -10.022 -8.658 1.00 22.34 H new ATOM 0 HZ2 LYS A 35 10.257 -9.710 -7.417 1.00 22.34 H new ATOM 0 HZ3 LYS A 35 10.598 -11.311 -7.869 1.00 22.34 H new ATOM 573 N ASP A 36 6.174 -10.543 -6.374 1.00 0.23 N ATOM 574 CA ASP A 36 6.668 -11.103 -5.100 1.00 25.03 C ATOM 575 C ASP A 36 5.478 -11.382 -4.160 1.00 60.14 C ATOM 576 O ASP A 36 5.619 -11.271 -2.945 1.00 62.13 O ATOM 577 CB ASP A 36 7.696 -10.140 -4.437 1.00 61.12 C ATOM 578 CG ASP A 36 9.031 -10.074 -5.188 1.00 42.20 C ATOM 579 OD1 ASP A 36 9.741 -11.097 -5.258 1.00 31.31 O ATOM 580 OD2 ASP A 36 9.384 -9.007 -5.721 1.00 62.44 O ATOM 0 H ASP A 36 5.847 -9.580 -6.297 1.00 0.23 H new ATOM 0 HA ASP A 36 7.182 -12.044 -5.299 1.00 25.03 H new ATOM 0 HB2 ASP A 36 7.266 -9.140 -4.384 1.00 61.12 H new ATOM 0 HB3 ASP A 36 7.878 -10.463 -3.412 1.00 61.12 H new ATOM 585 N LYS A 37 4.332 -11.804 -4.753 1.00 42.33 N ATOM 586 CA LYS A 37 3.076 -12.149 -4.031 1.00 22.33 C ATOM 587 C LYS A 37 3.318 -13.135 -2.860 1.00 61.30 C ATOM 588 O LYS A 37 2.841 -12.908 -1.735 1.00 45.35 O ATOM 589 CB LYS A 37 2.034 -12.723 -5.055 1.00 53.13 C ATOM 590 CG LYS A 37 0.973 -13.696 -4.479 1.00 22.52 C ATOM 591 CD LYS A 37 -0.044 -13.071 -3.473 1.00 23.42 C ATOM 592 CE LYS A 37 -0.429 -14.066 -2.347 1.00 70.23 C ATOM 593 NZ LYS A 37 -0.687 -15.447 -2.852 1.00 61.33 N ATOM 0 H LYS A 37 4.252 -11.917 -5.764 1.00 42.33 H new ATOM 0 HA LYS A 37 2.679 -11.239 -3.580 1.00 22.33 H new ATOM 0 HB2 LYS A 37 1.514 -11.886 -5.521 1.00 53.13 H new ATOM 0 HB3 LYS A 37 2.579 -13.239 -5.845 1.00 53.13 H new ATOM 0 HG2 LYS A 37 0.415 -14.129 -5.309 1.00 22.52 H new ATOM 0 HG3 LYS A 37 1.491 -14.516 -3.981 1.00 22.52 H new ATOM 0 HD2 LYS A 37 0.387 -12.172 -3.032 1.00 23.42 H new ATOM 0 HD3 LYS A 37 -0.942 -12.763 -4.009 1.00 23.42 H new ATOM 0 HE2 LYS A 37 0.372 -14.099 -1.609 1.00 70.23 H new ATOM 0 HE3 LYS A 37 -1.319 -13.700 -1.835 1.00 70.23 H new ATOM 0 HZ1 LYS A 37 -1.208 -15.988 -2.133 1.00 61.33 H new ATOM 0 HZ2 LYS A 37 -1.251 -15.398 -3.724 1.00 61.33 H new ATOM 0 HZ3 LYS A 37 0.218 -15.918 -3.052 1.00 61.33 H new ATOM 607 N GLU A 38 4.071 -14.207 -3.128 1.00 72.25 N ATOM 608 CA GLU A 38 4.360 -15.257 -2.130 1.00 74.20 C ATOM 609 C GLU A 38 5.223 -14.688 -1.008 1.00 31.00 C ATOM 610 O GLU A 38 5.079 -15.033 0.164 1.00 52.34 O ATOM 611 CB GLU A 38 5.095 -16.437 -2.807 1.00 11.52 C ATOM 612 CG GLU A 38 4.319 -17.091 -3.964 1.00 41.52 C ATOM 613 CD GLU A 38 2.929 -17.613 -3.553 1.00 54.24 C ATOM 614 OE1 GLU A 38 2.842 -18.717 -2.972 1.00 43.51 O ATOM 615 OE2 GLU A 38 1.912 -16.915 -3.794 1.00 3.12 O ATOM 0 H GLU A 38 4.499 -14.376 -4.038 1.00 72.25 H new ATOM 0 HA GLU A 38 3.420 -15.614 -1.710 1.00 74.20 H new ATOM 0 HB2 GLU A 38 6.055 -16.083 -3.184 1.00 11.52 H new ATOM 0 HB3 GLU A 38 5.308 -17.196 -2.054 1.00 11.52 H new ATOM 0 HG2 GLU A 38 4.203 -16.365 -4.769 1.00 41.52 H new ATOM 0 HG3 GLU A 38 4.906 -17.918 -4.363 1.00 41.52 H new ATOM 622 N LYS A 39 6.085 -13.765 -1.418 1.00 33.52 N ATOM 623 CA LYS A 39 7.152 -13.212 -0.612 1.00 12.35 C ATOM 624 C LYS A 39 6.639 -12.072 0.301 1.00 32.11 C ATOM 625 O LYS A 39 7.282 -11.768 1.305 1.00 64.54 O ATOM 626 CB LYS A 39 8.263 -12.738 -1.593 1.00 30.25 C ATOM 627 CG LYS A 39 9.663 -12.646 -0.982 1.00 64.44 C ATOM 628 CD LYS A 39 10.761 -12.445 -2.061 1.00 24.42 C ATOM 629 CE LYS A 39 12.156 -12.246 -1.455 1.00 42.14 C ATOM 630 NZ LYS A 39 12.270 -10.968 -0.708 1.00 51.10 N ATOM 0 H LYS A 39 6.053 -13.370 -2.358 1.00 33.52 H new ATOM 0 HA LYS A 39 7.556 -13.962 0.068 1.00 12.35 H new ATOM 0 HB2 LYS A 39 8.296 -13.423 -2.440 1.00 30.25 H new ATOM 0 HB3 LYS A 39 7.988 -11.759 -1.985 1.00 30.25 H new ATOM 0 HG2 LYS A 39 9.695 -11.817 -0.274 1.00 64.44 H new ATOM 0 HG3 LYS A 39 9.872 -13.555 -0.418 1.00 64.44 H new ATOM 0 HD2 LYS A 39 10.777 -13.311 -2.723 1.00 24.42 H new ATOM 0 HD3 LYS A 39 10.509 -11.580 -2.674 1.00 24.42 H new ATOM 0 HE2 LYS A 39 12.381 -13.076 -0.786 1.00 42.14 H new ATOM 0 HE3 LYS A 39 12.901 -12.267 -2.250 1.00 42.14 H new ATOM 0 HZ1 LYS A 39 13.274 -10.720 -0.596 1.00 51.10 H new ATOM 0 HZ2 LYS A 39 11.783 -10.214 -1.234 1.00 51.10 H new ATOM 0 HZ3 LYS A 39 11.833 -11.074 0.230 1.00 51.10 H new ATOM 644 N VAL A 40 5.449 -11.498 -0.038 1.00 45.10 N ATOM 645 CA VAL A 40 4.837 -10.356 0.699 1.00 21.55 C ATOM 646 C VAL A 40 4.717 -10.655 2.212 1.00 52.20 C ATOM 647 O VAL A 40 5.136 -9.846 3.039 1.00 61.32 O ATOM 648 CB VAL A 40 3.399 -9.984 0.149 1.00 55.12 C ATOM 649 CG1 VAL A 40 2.774 -8.805 0.937 1.00 10.41 C ATOM 650 CG2 VAL A 40 3.418 -9.668 -1.361 1.00 1.01 C ATOM 0 H VAL A 40 4.889 -11.815 -0.829 1.00 45.10 H new ATOM 0 HA VAL A 40 5.507 -9.511 0.540 1.00 21.55 H new ATOM 0 HB VAL A 40 2.775 -10.866 0.297 1.00 55.12 H new ATOM 0 HG11 VAL A 40 1.788 -8.578 0.531 1.00 10.41 H new ATOM 0 HG12 VAL A 40 2.680 -9.079 1.988 1.00 10.41 H new ATOM 0 HG13 VAL A 40 3.414 -7.927 0.847 1.00 10.41 H new ATOM 0 HG21 VAL A 40 2.410 -9.419 -1.693 1.00 1.01 H new ATOM 0 HG22 VAL A 40 4.081 -8.823 -1.548 1.00 1.01 H new ATOM 0 HG23 VAL A 40 3.776 -10.539 -1.910 1.00 1.01 H new ATOM 660 N LYS A 41 4.153 -11.836 2.534 1.00 20.33 N ATOM 661 CA LYS A 41 3.902 -12.290 3.919 1.00 55.43 C ATOM 662 C LYS A 41 5.190 -12.293 4.773 1.00 74.53 C ATOM 663 O LYS A 41 5.185 -11.849 5.936 1.00 11.31 O ATOM 664 CB LYS A 41 3.265 -13.707 3.872 1.00 62.31 C ATOM 665 CG LYS A 41 3.032 -14.348 5.251 1.00 20.43 C ATOM 666 CD LYS A 41 2.338 -15.730 5.186 1.00 51.31 C ATOM 667 CE LYS A 41 2.138 -16.324 6.592 1.00 30.51 C ATOM 668 NZ LYS A 41 1.393 -17.607 6.572 1.00 61.04 N ATOM 0 H LYS A 41 3.854 -12.512 1.831 1.00 20.33 H new ATOM 0 HA LYS A 41 3.217 -11.590 4.397 1.00 55.43 H new ATOM 0 HB2 LYS A 41 2.311 -13.645 3.348 1.00 62.31 H new ATOM 0 HB3 LYS A 41 3.909 -14.362 3.285 1.00 62.31 H new ATOM 0 HG2 LYS A 41 3.991 -14.456 5.758 1.00 20.43 H new ATOM 0 HG3 LYS A 41 2.425 -13.675 5.857 1.00 20.43 H new ATOM 0 HD2 LYS A 41 1.372 -15.631 4.690 1.00 51.31 H new ATOM 0 HD3 LYS A 41 2.937 -16.412 4.583 1.00 51.31 H new ATOM 0 HE2 LYS A 41 3.111 -16.481 7.057 1.00 30.51 H new ATOM 0 HE3 LYS A 41 1.601 -15.606 7.212 1.00 30.51 H new ATOM 0 HZ1 LYS A 41 1.287 -17.962 7.544 1.00 61.04 H new ATOM 0 HZ2 LYS A 41 0.453 -17.456 6.154 1.00 61.04 H new ATOM 0 HZ3 LYS A 41 1.916 -18.304 6.004 1.00 61.04 H new ATOM 682 N GLU A 42 6.284 -12.784 4.168 1.00 50.23 N ATOM 683 CA GLU A 42 7.613 -12.805 4.792 1.00 42.01 C ATOM 684 C GLU A 42 8.131 -11.374 5.030 1.00 24.33 C ATOM 685 O GLU A 42 8.560 -11.054 6.136 1.00 41.32 O ATOM 686 CB GLU A 42 8.608 -13.612 3.910 1.00 52.01 C ATOM 687 CG GLU A 42 8.447 -15.139 4.005 1.00 21.54 C ATOM 688 CD GLU A 42 8.753 -15.694 5.413 1.00 43.54 C ATOM 689 OE1 GLU A 42 9.851 -15.405 5.953 1.00 74.44 O ATOM 690 OE2 GLU A 42 7.919 -16.434 5.975 1.00 61.42 O ATOM 0 H GLU A 42 6.269 -13.179 3.228 1.00 50.23 H new ATOM 0 HA GLU A 42 7.531 -13.296 5.762 1.00 42.01 H new ATOM 0 HB2 GLU A 42 8.481 -13.309 2.871 1.00 52.01 H new ATOM 0 HB3 GLU A 42 9.626 -13.348 4.197 1.00 52.01 H new ATOM 0 HG2 GLU A 42 7.428 -15.409 3.728 1.00 21.54 H new ATOM 0 HG3 GLU A 42 9.110 -15.614 3.282 1.00 21.54 H new ATOM 697 N GLU A 43 8.049 -10.523 3.995 1.00 31.22 N ATOM 698 CA GLU A 43 8.549 -9.131 4.050 1.00 44.14 C ATOM 699 C GLU A 43 7.814 -8.306 5.147 1.00 11.14 C ATOM 700 O GLU A 43 8.424 -7.475 5.837 1.00 74.01 O ATOM 701 CB GLU A 43 8.377 -8.444 2.671 1.00 14.31 C ATOM 702 CG GLU A 43 9.053 -9.150 1.476 1.00 40.11 C ATOM 703 CD GLU A 43 10.583 -9.239 1.581 1.00 40.22 C ATOM 704 OE1 GLU A 43 11.270 -8.221 1.332 1.00 51.22 O ATOM 705 OE2 GLU A 43 11.112 -10.332 1.885 1.00 34.41 O ATOM 0 H GLU A 43 7.636 -10.775 3.097 1.00 31.22 H new ATOM 0 HA GLU A 43 9.608 -9.168 4.305 1.00 44.14 H new ATOM 0 HB2 GLU A 43 7.311 -8.357 2.461 1.00 14.31 H new ATOM 0 HB3 GLU A 43 8.772 -7.430 2.740 1.00 14.31 H new ATOM 0 HG2 GLU A 43 8.647 -10.158 1.387 1.00 40.11 H new ATOM 0 HG3 GLU A 43 8.793 -8.619 0.560 1.00 40.11 H new ATOM 712 N ILE A 44 6.501 -8.580 5.290 1.00 71.51 N ATOM 713 CA ILE A 44 5.614 -7.954 6.302 1.00 43.32 C ATOM 714 C ILE A 44 6.082 -8.323 7.719 1.00 10.01 C ATOM 715 O ILE A 44 6.120 -7.469 8.605 1.00 30.43 O ATOM 716 CB ILE A 44 4.104 -8.399 6.086 1.00 55.20 C ATOM 717 CG1 ILE A 44 3.502 -7.705 4.820 1.00 64.41 C ATOM 718 CG2 ILE A 44 3.210 -8.152 7.334 1.00 3.35 C ATOM 719 CD1 ILE A 44 2.051 -8.056 4.550 1.00 62.02 C ATOM 0 H ILE A 44 6.016 -9.253 4.697 1.00 71.51 H new ATOM 0 HA ILE A 44 5.669 -6.872 6.183 1.00 43.32 H new ATOM 0 HB ILE A 44 4.116 -9.477 5.928 1.00 55.20 H new ATOM 0 HG12 ILE A 44 3.587 -6.625 4.936 1.00 64.41 H new ATOM 0 HG13 ILE A 44 4.099 -7.980 3.950 1.00 64.41 H new ATOM 0 HG21 ILE A 44 2.191 -8.477 7.122 1.00 3.35 H new ATOM 0 HG22 ILE A 44 3.602 -8.717 8.180 1.00 3.35 H new ATOM 0 HG23 ILE A 44 3.209 -7.089 7.576 1.00 3.35 H new ATOM 0 HD11 ILE A 44 1.711 -7.534 3.656 1.00 62.02 H new ATOM 0 HD12 ILE A 44 1.959 -9.132 4.399 1.00 62.02 H new ATOM 0 HD13 ILE A 44 1.440 -7.755 5.401 1.00 62.02 H new ATOM 731 N GLU A 45 6.445 -9.605 7.896 1.00 21.02 N ATOM 732 CA GLU A 45 6.931 -10.159 9.175 1.00 72.45 C ATOM 733 C GLU A 45 8.196 -9.419 9.662 1.00 54.35 C ATOM 734 O GLU A 45 8.346 -9.139 10.865 1.00 64.45 O ATOM 735 CB GLU A 45 7.238 -11.665 8.993 1.00 13.12 C ATOM 736 CG GLU A 45 7.727 -12.390 10.261 1.00 53.32 C ATOM 737 CD GLU A 45 8.307 -13.778 9.962 1.00 12.42 C ATOM 738 OE1 GLU A 45 7.540 -14.761 9.863 1.00 72.14 O ATOM 739 OE2 GLU A 45 9.540 -13.883 9.802 1.00 62.24 O ATOM 0 H GLU A 45 6.409 -10.296 7.146 1.00 21.02 H new ATOM 0 HA GLU A 45 6.155 -10.025 9.929 1.00 72.45 H new ATOM 0 HB2 GLU A 45 6.337 -12.163 8.633 1.00 13.12 H new ATOM 0 HB3 GLU A 45 7.995 -11.774 8.216 1.00 13.12 H new ATOM 0 HG2 GLU A 45 8.486 -11.782 10.753 1.00 53.32 H new ATOM 0 HG3 GLU A 45 6.897 -12.490 10.960 1.00 53.32 H new ATOM 746 N LYS A 46 9.088 -9.084 8.710 1.00 0.12 N ATOM 747 CA LYS A 46 10.389 -8.445 9.015 1.00 32.34 C ATOM 748 C LYS A 46 10.148 -6.986 9.470 1.00 35.30 C ATOM 749 O LYS A 46 10.679 -6.541 10.498 1.00 54.44 O ATOM 750 CB LYS A 46 11.346 -8.488 7.776 1.00 73.43 C ATOM 751 CG LYS A 46 11.328 -9.802 6.947 1.00 55.33 C ATOM 752 CD LYS A 46 11.460 -11.105 7.779 1.00 5.23 C ATOM 753 CE LYS A 46 11.478 -12.368 6.889 1.00 42.42 C ATOM 754 NZ LYS A 46 11.496 -13.635 7.673 1.00 20.33 N ATOM 0 H LYS A 46 8.932 -9.246 7.715 1.00 0.12 H new ATOM 0 HA LYS A 46 10.873 -8.999 9.819 1.00 32.34 H new ATOM 0 HB2 LYS A 46 11.089 -7.661 7.114 1.00 73.43 H new ATOM 0 HB3 LYS A 46 12.365 -8.314 8.123 1.00 73.43 H new ATOM 0 HG2 LYS A 46 10.398 -9.843 6.380 1.00 55.33 H new ATOM 0 HG3 LYS A 46 12.141 -9.768 6.222 1.00 55.33 H new ATOM 0 HD2 LYS A 46 12.376 -11.066 8.369 1.00 5.23 H new ATOM 0 HD3 LYS A 46 10.630 -11.170 8.482 1.00 5.23 H new ATOM 0 HE2 LYS A 46 10.602 -12.361 6.241 1.00 42.42 H new ATOM 0 HE3 LYS A 46 12.354 -12.336 6.241 1.00 42.42 H new ATOM 0 HZ1 LYS A 46 11.156 -14.417 7.077 1.00 20.33 H new ATOM 0 HZ2 LYS A 46 12.467 -13.836 7.986 1.00 20.33 H new ATOM 0 HZ3 LYS A 46 10.878 -13.538 8.504 1.00 20.33 H new ATOM 768 N ALA A 47 9.295 -6.281 8.697 1.00 24.11 N ATOM 769 CA ALA A 47 8.905 -4.876 8.957 1.00 62.42 C ATOM 770 C ALA A 47 8.067 -4.741 10.248 1.00 1.21 C ATOM 771 O ALA A 47 8.114 -3.703 10.914 1.00 44.52 O ATOM 772 CB ALA A 47 8.133 -4.313 7.752 1.00 51.54 C ATOM 0 H ALA A 47 8.852 -6.674 7.866 1.00 24.11 H new ATOM 0 HA ALA A 47 9.818 -4.298 9.101 1.00 62.42 H new ATOM 0 HB1 ALA A 47 7.850 -3.279 7.952 1.00 51.54 H new ATOM 0 HB2 ALA A 47 8.765 -4.351 6.865 1.00 51.54 H new ATOM 0 HB3 ALA A 47 7.236 -4.909 7.584 1.00 51.54 H new ATOM 778 N ARG A 48 7.301 -5.806 10.567 1.00 43.11 N ATOM 779 CA ARG A 48 6.473 -5.901 11.792 1.00 51.22 C ATOM 780 C ARG A 48 7.353 -5.756 13.041 1.00 53.12 C ATOM 781 O ARG A 48 7.063 -4.955 13.939 1.00 34.30 O ATOM 782 CB ARG A 48 5.727 -7.275 11.823 1.00 41.22 C ATOM 783 CG ARG A 48 4.937 -7.566 13.123 1.00 4.15 C ATOM 784 CD ARG A 48 4.285 -8.962 13.158 1.00 12.02 C ATOM 785 NE ARG A 48 3.594 -9.204 14.445 1.00 24.35 N ATOM 786 CZ ARG A 48 2.953 -10.333 14.799 1.00 4.22 C ATOM 787 NH1 ARG A 48 2.881 -11.372 13.972 1.00 71.50 N ATOM 788 NH2 ARG A 48 2.385 -10.410 15.996 1.00 0.13 N ATOM 0 H ARG A 48 7.238 -6.634 9.975 1.00 43.11 H new ATOM 0 HA ARG A 48 5.739 -5.095 11.784 1.00 51.22 H new ATOM 0 HB2 ARG A 48 5.037 -7.315 10.980 1.00 41.22 H new ATOM 0 HB3 ARG A 48 6.457 -8.070 11.675 1.00 41.22 H new ATOM 0 HG2 ARG A 48 5.610 -7.469 13.975 1.00 4.15 H new ATOM 0 HG3 ARG A 48 4.161 -6.810 13.242 1.00 4.15 H new ATOM 0 HD2 ARG A 48 3.573 -9.053 12.338 1.00 12.02 H new ATOM 0 HD3 ARG A 48 5.048 -9.725 13.004 1.00 12.02 H new ATOM 0 HE ARG A 48 3.605 -8.445 15.126 1.00 24.35 H new ATOM 0 HH11 ARG A 48 3.316 -11.322 13.051 1.00 71.50 H new ATOM 0 HH12 ARG A 48 2.391 -12.219 14.259 1.00 71.50 H new ATOM 0 HH21 ARG A 48 2.437 -9.618 16.637 1.00 0.13 H new ATOM 0 HH22 ARG A 48 1.896 -11.261 16.275 1.00 0.13 H new ATOM 802 N LYS A 49 8.439 -6.539 13.052 1.00 71.52 N ATOM 803 CA LYS A 49 9.395 -6.603 14.168 1.00 43.15 C ATOM 804 C LYS A 49 10.125 -5.259 14.353 1.00 22.42 C ATOM 805 O LYS A 49 10.335 -4.796 15.482 1.00 34.30 O ATOM 806 CB LYS A 49 10.411 -7.740 13.896 1.00 2.22 C ATOM 807 CG LYS A 49 11.416 -7.987 15.034 1.00 20.25 C ATOM 808 CD LYS A 49 12.401 -9.128 14.718 1.00 32.53 C ATOM 809 CE LYS A 49 13.343 -9.421 15.893 1.00 10.11 C ATOM 810 NZ LYS A 49 12.601 -9.817 17.121 1.00 54.45 N ATOM 0 H LYS A 49 8.683 -7.155 12.276 1.00 71.52 H new ATOM 0 HA LYS A 49 8.852 -6.809 15.090 1.00 43.15 H new ATOM 0 HB2 LYS A 49 9.862 -8.663 13.707 1.00 2.22 H new ATOM 0 HB3 LYS A 49 10.963 -7.506 12.986 1.00 2.22 H new ATOM 0 HG2 LYS A 49 11.976 -7.071 15.224 1.00 20.25 H new ATOM 0 HG3 LYS A 49 10.872 -8.224 15.949 1.00 20.25 H new ATOM 0 HD2 LYS A 49 11.842 -10.030 14.469 1.00 32.53 H new ATOM 0 HD3 LYS A 49 12.990 -8.865 13.839 1.00 32.53 H new ATOM 0 HE2 LYS A 49 14.033 -10.218 15.614 1.00 10.11 H new ATOM 0 HE3 LYS A 49 13.945 -8.537 16.103 1.00 10.11 H new ATOM 0 HZ1 LYS A 49 13.263 -10.230 17.809 1.00 54.45 H new ATOM 0 HZ2 LYS A 49 12.147 -8.979 17.538 1.00 54.45 H new ATOM 0 HZ3 LYS A 49 11.874 -10.519 16.876 1.00 54.45 H new ATOM 824 N GLN A 50 10.490 -4.646 13.220 1.00 62.13 N ATOM 825 CA GLN A 50 11.228 -3.371 13.179 1.00 14.52 C ATOM 826 C GLN A 50 10.290 -2.166 13.367 1.00 42.12 C ATOM 827 O GLN A 50 10.759 -1.037 13.557 1.00 70.34 O ATOM 828 CB GLN A 50 11.974 -3.277 11.834 1.00 63.12 C ATOM 829 CG GLN A 50 13.011 -4.403 11.626 1.00 34.25 C ATOM 830 CD GLN A 50 13.561 -4.461 10.202 1.00 61.25 C ATOM 831 OE1 GLN A 50 13.622 -3.447 9.510 1.00 33.10 O ATOM 832 NE2 GLN A 50 13.975 -5.640 9.765 1.00 33.12 N ATOM 0 H GLN A 50 10.281 -5.022 12.295 1.00 62.13 H new ATOM 0 HA GLN A 50 11.942 -3.347 14.003 1.00 14.52 H new ATOM 0 HB2 GLN A 50 11.248 -3.308 11.022 1.00 63.12 H new ATOM 0 HB3 GLN A 50 12.479 -2.313 11.774 1.00 63.12 H new ATOM 0 HG2 GLN A 50 13.838 -4.260 12.322 1.00 34.25 H new ATOM 0 HG3 GLN A 50 12.551 -5.361 11.870 1.00 34.25 H new ATOM 0 HE21 GLN A 50 13.908 -6.460 10.368 1.00 33.12 H new ATOM 0 HE22 GLN A 50 14.361 -5.729 8.825 1.00 33.12 H new ATOM 841 N GLY A 51 8.967 -2.419 13.275 1.00 73.31 N ATOM 842 CA GLY A 51 7.943 -1.401 13.513 1.00 24.11 C ATOM 843 C GLY A 51 7.800 -0.374 12.399 1.00 43.54 C ATOM 844 O GLY A 51 7.135 0.654 12.577 1.00 1.33 O ATOM 0 H GLY A 51 8.588 -3.335 13.034 1.00 73.31 H new ATOM 0 HA2 GLY A 51 6.983 -1.897 13.658 1.00 24.11 H new ATOM 0 HA3 GLY A 51 8.176 -0.880 14.442 1.00 24.11 H new ATOM 848 N ARG A 52 8.401 -0.665 11.246 1.00 32.15 N ATOM 849 CA ARG A 52 8.431 0.255 10.103 1.00 41.10 C ATOM 850 C ARG A 52 7.251 -0.009 9.155 1.00 54.53 C ATOM 851 O ARG A 52 6.717 -1.128 9.125 1.00 55.01 O ATOM 852 CB ARG A 52 9.784 0.120 9.345 1.00 61.12 C ATOM 853 CG ARG A 52 10.978 0.713 10.115 1.00 4.31 C ATOM 854 CD ARG A 52 12.295 0.694 9.315 1.00 55.44 C ATOM 855 NE ARG A 52 13.326 1.520 9.967 1.00 52.24 N ATOM 856 CZ ARG A 52 13.574 2.815 9.697 1.00 62.34 C ATOM 857 NH1 ARG A 52 12.875 3.465 8.774 1.00 24.41 N ATOM 858 NH2 ARG A 52 14.522 3.441 10.354 1.00 34.43 N ATOM 0 H ARG A 52 8.883 -1.547 11.075 1.00 32.15 H new ATOM 0 HA ARG A 52 8.338 1.274 10.477 1.00 41.10 H new ATOM 0 HB2 ARG A 52 9.977 -0.934 9.146 1.00 61.12 H new ATOM 0 HB3 ARG A 52 9.702 0.617 8.378 1.00 61.12 H new ATOM 0 HG2 ARG A 52 10.746 1.741 10.394 1.00 4.31 H new ATOM 0 HG3 ARG A 52 11.116 0.155 11.041 1.00 4.31 H new ATOM 0 HD2 ARG A 52 12.652 -0.332 9.222 1.00 55.44 H new ATOM 0 HD3 ARG A 52 12.115 1.062 8.305 1.00 55.44 H new ATOM 0 HE ARG A 52 13.900 1.073 10.683 1.00 52.24 H new ATOM 0 HH11 ARG A 52 12.139 2.983 8.259 1.00 24.41 H new ATOM 0 HH12 ARG A 52 13.074 4.446 8.580 1.00 24.41 H new ATOM 0 HH21 ARG A 52 15.064 2.946 11.062 1.00 34.43 H new ATOM 0 HH22 ARG A 52 14.717 4.422 10.156 1.00 34.43 H new ATOM 872 N PRO A 53 6.804 1.039 8.386 1.00 52.12 N ATOM 873 CA PRO A 53 5.904 0.841 7.238 1.00 43.14 C ATOM 874 C PRO A 53 6.625 0.069 6.119 1.00 60.23 C ATOM 875 O PRO A 53 7.841 0.205 5.945 1.00 25.04 O ATOM 876 CB PRO A 53 5.546 2.287 6.801 1.00 13.13 C ATOM 877 CG PRO A 53 6.692 3.118 7.285 1.00 10.01 C ATOM 878 CD PRO A 53 7.115 2.485 8.589 1.00 43.12 C ATOM 0 HA PRO A 53 5.018 0.252 7.477 1.00 43.14 H new ATOM 0 HB2 PRO A 53 5.433 2.358 5.719 1.00 13.13 H new ATOM 0 HB3 PRO A 53 4.604 2.614 7.242 1.00 13.13 H new ATOM 0 HG2 PRO A 53 7.510 3.120 6.564 1.00 10.01 H new ATOM 0 HG3 PRO A 53 6.393 4.156 7.430 1.00 10.01 H new ATOM 0 HD2 PRO A 53 8.175 2.644 8.788 1.00 43.12 H new ATOM 0 HD3 PRO A 53 6.566 2.900 9.434 1.00 43.12 H new ATOM 886 N ILE A 54 5.881 -0.769 5.403 1.00 53.24 N ATOM 887 CA ILE A 54 6.387 -1.484 4.225 1.00 23.25 C ATOM 888 C ILE A 54 5.427 -1.235 3.060 1.00 12.42 C ATOM 889 O ILE A 54 4.226 -1.482 3.183 1.00 12.22 O ATOM 890 CB ILE A 54 6.556 -3.027 4.494 1.00 54.13 C ATOM 891 CG1 ILE A 54 6.973 -3.780 3.189 1.00 34.42 C ATOM 892 CG2 ILE A 54 5.283 -3.656 5.123 1.00 74.52 C ATOM 893 CD1 ILE A 54 7.093 -5.277 3.339 1.00 53.03 C ATOM 0 H ILE A 54 4.906 -0.975 5.620 1.00 53.24 H new ATOM 0 HA ILE A 54 7.380 -1.106 3.982 1.00 23.25 H new ATOM 0 HB ILE A 54 7.358 -3.140 5.223 1.00 54.13 H new ATOM 0 HG12 ILE A 54 6.241 -3.563 2.411 1.00 34.42 H new ATOM 0 HG13 ILE A 54 7.929 -3.384 2.847 1.00 34.42 H new ATOM 0 HG21 ILE A 54 5.448 -4.720 5.290 1.00 74.52 H new ATOM 0 HG22 ILE A 54 5.068 -3.168 6.074 1.00 74.52 H new ATOM 0 HG23 ILE A 54 4.439 -3.521 4.447 1.00 74.52 H new ATOM 0 HD11 ILE A 54 7.386 -5.716 2.385 1.00 53.03 H new ATOM 0 HD12 ILE A 54 7.847 -5.508 4.092 1.00 53.03 H new ATOM 0 HD13 ILE A 54 6.133 -5.690 3.649 1.00 53.03 H new ATOM 905 N VAL A 55 5.953 -0.743 1.929 1.00 30.11 N ATOM 906 CA VAL A 55 5.112 -0.380 0.789 1.00 5.21 C ATOM 907 C VAL A 55 5.064 -1.562 -0.195 1.00 32.54 C ATOM 908 O VAL A 55 6.002 -1.799 -0.946 1.00 12.14 O ATOM 909 CB VAL A 55 5.651 0.926 0.090 1.00 61.24 C ATOM 910 CG1 VAL A 55 4.758 1.326 -1.103 1.00 2.34 C ATOM 911 CG2 VAL A 55 5.774 2.090 1.107 1.00 63.44 C ATOM 0 H VAL A 55 6.951 -0.590 1.784 1.00 30.11 H new ATOM 0 HA VAL A 55 4.101 -0.166 1.135 1.00 5.21 H new ATOM 0 HB VAL A 55 6.647 0.711 -0.296 1.00 61.24 H new ATOM 0 HG11 VAL A 55 5.153 2.230 -1.566 1.00 2.34 H new ATOM 0 HG12 VAL A 55 4.746 0.519 -1.835 1.00 2.34 H new ATOM 0 HG13 VAL A 55 3.743 1.512 -0.751 1.00 2.34 H new ATOM 0 HG21 VAL A 55 6.148 2.979 0.599 1.00 63.44 H new ATOM 0 HG22 VAL A 55 4.795 2.302 1.537 1.00 63.44 H new ATOM 0 HG23 VAL A 55 6.466 1.808 1.901 1.00 63.44 H new ATOM 921 N VAL A 56 3.952 -2.296 -0.159 1.00 74.13 N ATOM 922 CA VAL A 56 3.674 -3.406 -1.067 1.00 63.21 C ATOM 923 C VAL A 56 2.798 -2.892 -2.215 1.00 73.24 C ATOM 924 O VAL A 56 1.628 -2.562 -2.001 1.00 50.31 O ATOM 925 CB VAL A 56 2.936 -4.582 -0.319 1.00 0.25 C ATOM 926 CG1 VAL A 56 2.671 -5.780 -1.267 1.00 54.15 C ATOM 927 CG2 VAL A 56 3.721 -5.020 0.946 1.00 14.32 C ATOM 0 H VAL A 56 3.205 -2.131 0.516 1.00 74.13 H new ATOM 0 HA VAL A 56 4.617 -3.794 -1.452 1.00 63.21 H new ATOM 0 HB VAL A 56 1.966 -4.208 0.008 1.00 0.25 H new ATOM 0 HG11 VAL A 56 2.161 -6.572 -0.719 1.00 54.15 H new ATOM 0 HG12 VAL A 56 2.046 -5.455 -2.099 1.00 54.15 H new ATOM 0 HG13 VAL A 56 3.619 -6.157 -1.651 1.00 54.15 H new ATOM 0 HG21 VAL A 56 3.189 -5.832 1.441 1.00 14.32 H new ATOM 0 HG22 VAL A 56 4.715 -5.361 0.657 1.00 14.32 H new ATOM 0 HG23 VAL A 56 3.811 -4.175 1.629 1.00 14.32 H new ATOM 937 N PHE A 57 3.375 -2.804 -3.416 1.00 45.34 N ATOM 938 CA PHE A 57 2.634 -2.439 -4.622 1.00 61.34 C ATOM 939 C PHE A 57 1.799 -3.633 -5.095 1.00 10.12 C ATOM 940 O PHE A 57 2.326 -4.641 -5.576 1.00 13.45 O ATOM 941 CB PHE A 57 3.604 -1.949 -5.720 1.00 62.13 C ATOM 942 CG PHE A 57 4.302 -0.652 -5.328 1.00 50.21 C ATOM 943 CD1 PHE A 57 3.564 0.526 -5.209 1.00 42.55 C ATOM 944 CD2 PHE A 57 5.664 -0.608 -5.046 1.00 40.20 C ATOM 945 CE1 PHE A 57 4.164 1.704 -4.827 1.00 14.12 C ATOM 946 CE2 PHE A 57 6.264 0.577 -4.671 1.00 71.43 C ATOM 947 CZ PHE A 57 5.515 1.731 -4.556 1.00 54.14 C ATOM 0 H PHE A 57 4.366 -2.983 -3.578 1.00 45.34 H new ATOM 0 HA PHE A 57 1.954 -1.618 -4.398 1.00 61.34 H new ATOM 0 HB2 PHE A 57 4.351 -2.719 -5.913 1.00 62.13 H new ATOM 0 HB3 PHE A 57 3.054 -1.798 -6.649 1.00 62.13 H new ATOM 0 HD1 PHE A 57 2.505 0.513 -5.420 1.00 42.55 H new ATOM 0 HD2 PHE A 57 6.256 -1.508 -5.121 1.00 40.20 H new ATOM 0 HE1 PHE A 57 3.577 2.606 -4.740 1.00 14.12 H new ATOM 0 HE2 PHE A 57 7.324 0.602 -4.467 1.00 71.43 H new ATOM 0 HZ PHE A 57 5.987 2.654 -4.254 1.00 54.14 H new ATOM 957 N VAL A 58 0.496 -3.490 -4.888 1.00 10.31 N ATOM 958 CA VAL A 58 -0.538 -4.407 -5.360 1.00 4.32 C ATOM 959 C VAL A 58 -1.171 -3.781 -6.622 1.00 34.32 C ATOM 960 O VAL A 58 -1.159 -2.562 -6.776 1.00 41.44 O ATOM 961 CB VAL A 58 -1.613 -4.633 -4.225 1.00 23.32 C ATOM 962 CG1 VAL A 58 -2.745 -5.568 -4.689 1.00 33.24 C ATOM 963 CG2 VAL A 58 -0.947 -5.174 -2.930 1.00 14.23 C ATOM 0 H VAL A 58 0.114 -2.701 -4.366 1.00 10.31 H new ATOM 0 HA VAL A 58 -0.119 -5.383 -5.606 1.00 4.32 H new ATOM 0 HB VAL A 58 -2.059 -3.664 -4.003 1.00 23.32 H new ATOM 0 HG11 VAL A 58 -3.464 -5.698 -3.880 1.00 33.24 H new ATOM 0 HG12 VAL A 58 -3.246 -5.132 -5.553 1.00 33.24 H new ATOM 0 HG13 VAL A 58 -2.327 -6.537 -4.963 1.00 33.24 H new ATOM 0 HG21 VAL A 58 -1.708 -5.321 -2.164 1.00 14.23 H new ATOM 0 HG22 VAL A 58 -0.457 -6.124 -3.142 1.00 14.23 H new ATOM 0 HG23 VAL A 58 -0.208 -4.456 -2.574 1.00 14.23 H new ATOM 973 N ARG A 59 -1.666 -4.602 -7.549 1.00 64.42 N ATOM 974 CA ARG A 59 -2.255 -4.108 -8.810 1.00 62.24 C ATOM 975 C ARG A 59 -3.787 -3.990 -8.639 1.00 21.40 C ATOM 976 O ARG A 59 -4.346 -4.578 -7.707 1.00 32.43 O ATOM 977 CB ARG A 59 -1.842 -5.061 -9.973 1.00 24.23 C ATOM 978 CG ARG A 59 -1.869 -4.433 -11.381 1.00 54.13 C ATOM 979 CD ARG A 59 -1.327 -5.388 -12.470 1.00 25.42 C ATOM 980 NE ARG A 59 -1.435 -4.812 -13.825 1.00 33.41 N ATOM 981 CZ ARG A 59 -1.414 -5.507 -14.981 1.00 75.23 C ATOM 982 NH1 ARG A 59 -1.291 -6.835 -14.976 1.00 12.02 N ATOM 983 NH2 ARG A 59 -1.512 -4.855 -16.138 1.00 70.32 N ATOM 0 H ARG A 59 -1.674 -5.618 -7.456 1.00 64.42 H new ATOM 0 HA ARG A 59 -1.881 -3.115 -9.060 1.00 62.24 H new ATOM 0 HB2 ARG A 59 -0.836 -5.431 -9.777 1.00 24.23 H new ATOM 0 HB3 ARG A 59 -2.506 -5.925 -9.966 1.00 24.23 H new ATOM 0 HG2 ARG A 59 -2.892 -4.149 -11.628 1.00 54.13 H new ATOM 0 HG3 ARG A 59 -1.276 -3.518 -11.378 1.00 54.13 H new ATOM 0 HD2 ARG A 59 -0.283 -5.621 -12.259 1.00 25.42 H new ATOM 0 HD3 ARG A 59 -1.877 -6.328 -12.432 1.00 25.42 H new ATOM 0 HE ARG A 59 -1.534 -3.799 -13.893 1.00 33.41 H new ATOM 0 HH11 ARG A 59 -1.212 -7.336 -14.091 1.00 12.02 H new ATOM 0 HH12 ARG A 59 -1.276 -7.349 -15.857 1.00 12.02 H new ATOM 0 HH21 ARG A 59 -1.602 -3.839 -16.145 1.00 70.32 H new ATOM 0 HH22 ARG A 59 -1.497 -5.372 -17.017 1.00 70.32 H new ATOM 997 N GLY A 60 -4.452 -3.236 -9.544 1.00 12.21 N ATOM 998 CA GLY A 60 -5.900 -2.980 -9.460 1.00 65.25 C ATOM 999 C GLY A 60 -6.758 -4.240 -9.585 1.00 53.40 C ATOM 1000 O GLY A 60 -7.842 -4.322 -8.999 1.00 64.32 O ATOM 0 H GLY A 60 -4.001 -2.793 -10.345 1.00 12.21 H new ATOM 0 HA2 GLY A 60 -6.119 -2.495 -8.509 1.00 65.25 H new ATOM 0 HA3 GLY A 60 -6.182 -2.280 -10.247 1.00 65.25 H new ATOM 1004 N GLY A 61 -6.246 -5.235 -10.335 1.00 62.54 N ATOM 1005 CA GLY A 61 -6.923 -6.526 -10.505 1.00 72.40 C ATOM 1006 C GLY A 61 -6.442 -7.590 -9.517 1.00 12.22 C ATOM 1007 O GLY A 61 -6.709 -8.784 -9.696 1.00 23.25 O ATOM 0 H GLY A 61 -5.359 -5.164 -10.834 1.00 62.54 H new ATOM 0 HA2 GLY A 61 -7.997 -6.385 -10.384 1.00 72.40 H new ATOM 0 HA3 GLY A 61 -6.761 -6.883 -11.522 1.00 72.40 H new ATOM 1011 N ASP A 62 -5.715 -7.148 -8.477 1.00 74.44 N ATOM 1012 CA ASP A 62 -5.250 -8.003 -7.367 1.00 3.13 C ATOM 1013 C ASP A 62 -5.970 -7.587 -6.070 1.00 12.13 C ATOM 1014 O ASP A 62 -5.436 -7.776 -4.969 1.00 24.31 O ATOM 1015 CB ASP A 62 -3.704 -7.876 -7.194 1.00 20.21 C ATOM 1016 CG ASP A 62 -2.875 -8.565 -8.291 1.00 52.03 C ATOM 1017 OD1 ASP A 62 -3.052 -8.245 -9.483 1.00 41.31 O ATOM 1018 OD2 ASP A 62 -2.024 -9.425 -7.965 1.00 34.41 O ATOM 0 H ASP A 62 -5.429 -6.174 -8.381 1.00 74.44 H new ATOM 0 HA ASP A 62 -5.483 -9.044 -7.592 1.00 3.13 H new ATOM 0 HB2 ASP A 62 -3.441 -6.819 -7.169 1.00 20.21 H new ATOM 0 HB3 ASP A 62 -3.425 -8.297 -6.228 1.00 20.21 H new ATOM 1023 N ASP A 63 -7.203 -7.059 -6.229 1.00 13.31 N ATOM 1024 CA ASP A 63 -8.027 -6.516 -5.126 1.00 54.31 C ATOM 1025 C ASP A 63 -8.248 -7.542 -3.993 1.00 11.33 C ATOM 1026 O ASP A 63 -8.225 -7.196 -2.800 1.00 4.20 O ATOM 1027 CB ASP A 63 -9.397 -6.053 -5.680 1.00 63.33 C ATOM 1028 CG ASP A 63 -10.298 -5.431 -4.596 1.00 61.03 C ATOM 1029 OD1 ASP A 63 -10.095 -4.242 -4.266 1.00 50.25 O ATOM 1030 OD2 ASP A 63 -11.188 -6.126 -4.040 1.00 63.41 O ATOM 0 H ASP A 63 -7.660 -6.997 -7.139 1.00 13.31 H new ATOM 0 HA ASP A 63 -7.484 -5.672 -4.700 1.00 54.31 H new ATOM 0 HB2 ASP A 63 -9.235 -5.324 -6.474 1.00 63.33 H new ATOM 0 HB3 ASP A 63 -9.910 -6.904 -6.128 1.00 63.33 H new ATOM 1035 N GLU A 64 -8.470 -8.798 -4.399 1.00 41.33 N ATOM 1036 CA GLU A 64 -8.705 -9.925 -3.481 1.00 32.50 C ATOM 1037 C GLU A 64 -7.466 -10.190 -2.625 1.00 33.14 C ATOM 1038 O GLU A 64 -7.561 -10.281 -1.400 1.00 63.40 O ATOM 1039 CB GLU A 64 -9.147 -11.191 -4.271 1.00 44.22 C ATOM 1040 CG GLU A 64 -10.614 -11.162 -4.767 1.00 11.12 C ATOM 1041 CD GLU A 64 -10.973 -9.921 -5.614 1.00 13.11 C ATOM 1042 OE1 GLU A 64 -10.361 -9.725 -6.691 1.00 21.14 O ATOM 1043 OE2 GLU A 64 -11.849 -9.125 -5.194 1.00 44.33 O ATOM 0 H GLU A 64 -8.492 -9.066 -5.383 1.00 41.33 H new ATOM 0 HA GLU A 64 -9.518 -9.663 -2.804 1.00 32.50 H new ATOM 0 HB2 GLU A 64 -8.489 -11.315 -5.131 1.00 44.22 H new ATOM 0 HB3 GLU A 64 -9.009 -12.066 -3.636 1.00 44.22 H new ATOM 0 HG2 GLU A 64 -10.803 -12.058 -5.358 1.00 11.12 H new ATOM 0 HG3 GLU A 64 -11.278 -11.203 -3.904 1.00 11.12 H new ATOM 1050 N ARG A 65 -6.299 -10.241 -3.288 1.00 50.01 N ATOM 1051 CA ARG A 65 -5.002 -10.433 -2.619 1.00 21.31 C ATOM 1052 C ARG A 65 -4.707 -9.261 -1.668 1.00 55.21 C ATOM 1053 O ARG A 65 -4.164 -9.461 -0.592 1.00 2.03 O ATOM 1054 CB ARG A 65 -3.878 -10.586 -3.673 1.00 72.44 C ATOM 1055 CG ARG A 65 -4.070 -11.800 -4.607 1.00 72.12 C ATOM 1056 CD ARG A 65 -2.985 -11.913 -5.691 1.00 63.32 C ATOM 1057 NE ARG A 65 -3.175 -13.115 -6.529 1.00 23.14 N ATOM 1058 CZ ARG A 65 -2.753 -13.252 -7.798 1.00 14.31 C ATOM 1059 NH1 ARG A 65 -2.104 -12.270 -8.411 1.00 43.54 N ATOM 1060 NH2 ARG A 65 -2.991 -14.380 -8.454 1.00 53.05 N ATOM 0 H ARG A 65 -6.228 -10.150 -4.302 1.00 50.01 H new ATOM 0 HA ARG A 65 -5.044 -11.346 -2.025 1.00 21.31 H new ATOM 0 HB2 ARG A 65 -3.830 -9.679 -4.275 1.00 72.44 H new ATOM 0 HB3 ARG A 65 -2.921 -10.680 -3.160 1.00 72.44 H new ATOM 0 HG2 ARG A 65 -4.073 -12.712 -4.010 1.00 72.12 H new ATOM 0 HG3 ARG A 65 -5.046 -11.730 -5.086 1.00 72.12 H new ATOM 0 HD2 ARG A 65 -3.005 -11.023 -6.320 1.00 63.32 H new ATOM 0 HD3 ARG A 65 -2.002 -11.949 -5.221 1.00 63.32 H new ATOM 0 HE ARG A 65 -3.666 -13.905 -6.111 1.00 23.14 H new ATOM 0 HH11 ARG A 65 -1.919 -11.396 -7.919 1.00 43.54 H new ATOM 0 HH12 ARG A 65 -1.790 -12.389 -9.374 1.00 43.54 H new ATOM 0 HH21 ARG A 65 -3.493 -15.140 -7.996 1.00 53.05 H new ATOM 0 HH22 ARG A 65 -2.672 -14.487 -9.417 1.00 53.05 H new ATOM 1074 N ALA A 66 -5.114 -8.053 -2.079 1.00 53.30 N ATOM 1075 CA ALA A 66 -4.913 -6.821 -1.301 1.00 22.43 C ATOM 1076 C ALA A 66 -5.636 -6.886 0.054 1.00 20.12 C ATOM 1077 O ALA A 66 -5.020 -6.678 1.089 1.00 12.54 O ATOM 1078 CB ALA A 66 -5.408 -5.610 -2.095 1.00 50.04 C ATOM 0 H ALA A 66 -5.595 -7.901 -2.966 1.00 53.30 H new ATOM 0 HA ALA A 66 -3.845 -6.719 -1.110 1.00 22.43 H new ATOM 0 HB1 ALA A 66 -5.254 -4.704 -1.510 1.00 50.04 H new ATOM 0 HB2 ALA A 66 -4.853 -5.536 -3.030 1.00 50.04 H new ATOM 0 HB3 ALA A 66 -6.470 -5.726 -2.312 1.00 50.04 H new ATOM 1084 N LYS A 67 -6.940 -7.217 0.017 1.00 61.34 N ATOM 1085 CA LYS A 67 -7.808 -7.211 1.215 1.00 73.00 C ATOM 1086 C LYS A 67 -7.505 -8.397 2.153 1.00 44.54 C ATOM 1087 O LYS A 67 -7.757 -8.308 3.362 1.00 71.20 O ATOM 1088 CB LYS A 67 -9.307 -7.164 0.810 1.00 51.32 C ATOM 1089 CG LYS A 67 -9.804 -8.350 -0.040 1.00 13.31 C ATOM 1090 CD LYS A 67 -11.218 -8.118 -0.631 1.00 33.32 C ATOM 1091 CE LYS A 67 -11.703 -9.318 -1.461 1.00 53.01 C ATOM 1092 NZ LYS A 67 -13.047 -9.097 -2.050 1.00 5.42 N ATOM 0 H LYS A 67 -7.422 -7.495 -0.838 1.00 61.34 H new ATOM 0 HA LYS A 67 -7.586 -6.305 1.779 1.00 73.00 H new ATOM 0 HB2 LYS A 67 -9.909 -7.113 1.717 1.00 51.32 H new ATOM 0 HB3 LYS A 67 -9.487 -6.243 0.256 1.00 51.32 H new ATOM 0 HG2 LYS A 67 -9.100 -8.528 -0.853 1.00 13.31 H new ATOM 0 HG3 LYS A 67 -9.816 -9.251 0.574 1.00 13.31 H new ATOM 0 HD2 LYS A 67 -11.922 -7.930 0.179 1.00 33.32 H new ATOM 0 HD3 LYS A 67 -11.207 -7.226 -1.257 1.00 33.32 H new ATOM 0 HE2 LYS A 67 -10.988 -9.516 -2.260 1.00 53.01 H new ATOM 0 HE3 LYS A 67 -11.729 -10.206 -0.829 1.00 53.01 H new ATOM 0 HZ1 LYS A 67 -13.686 -9.863 -1.754 1.00 5.42 H new ATOM 0 HZ2 LYS A 67 -13.424 -8.185 -1.722 1.00 5.42 H new ATOM 0 HZ3 LYS A 67 -12.974 -9.088 -3.087 1.00 5.42 H new ATOM 1106 N ASP A 68 -6.992 -9.505 1.590 1.00 42.42 N ATOM 1107 CA ASP A 68 -6.572 -10.685 2.386 1.00 1.43 C ATOM 1108 C ASP A 68 -5.249 -10.415 3.116 1.00 42.42 C ATOM 1109 O ASP A 68 -5.132 -10.677 4.319 1.00 34.44 O ATOM 1110 CB ASP A 68 -6.447 -11.953 1.497 1.00 52.05 C ATOM 1111 CG ASP A 68 -7.798 -12.440 0.929 1.00 64.34 C ATOM 1112 OD1 ASP A 68 -8.818 -12.408 1.657 1.00 34.14 O ATOM 1113 OD2 ASP A 68 -7.847 -12.864 -0.244 1.00 24.52 O ATOM 0 H ASP A 68 -6.856 -9.614 0.585 1.00 42.42 H new ATOM 0 HA ASP A 68 -7.347 -10.867 3.130 1.00 1.43 H new ATOM 0 HB2 ASP A 68 -5.769 -11.743 0.670 1.00 52.05 H new ATOM 0 HB3 ASP A 68 -5.997 -12.755 2.082 1.00 52.05 H new ATOM 1118 N ILE A 69 -4.258 -9.893 2.377 1.00 5.13 N ATOM 1119 CA ILE A 69 -2.953 -9.475 2.933 1.00 2.32 C ATOM 1120 C ILE A 69 -3.155 -8.330 3.956 1.00 65.13 C ATOM 1121 O ILE A 69 -2.415 -8.214 4.938 1.00 74.04 O ATOM 1122 CB ILE A 69 -1.968 -9.063 1.769 1.00 61.13 C ATOM 1123 CG1 ILE A 69 -1.596 -10.316 0.900 1.00 14.00 C ATOM 1124 CG2 ILE A 69 -0.696 -8.365 2.293 1.00 40.34 C ATOM 1125 CD1 ILE A 69 -0.786 -10.002 -0.350 1.00 65.44 C ATOM 0 H ILE A 69 -4.336 -9.746 1.371 1.00 5.13 H new ATOM 0 HA ILE A 69 -2.498 -10.313 3.461 1.00 2.32 H new ATOM 0 HB ILE A 69 -2.491 -8.339 1.145 1.00 61.13 H new ATOM 0 HG12 ILE A 69 -1.031 -11.015 1.517 1.00 14.00 H new ATOM 0 HG13 ILE A 69 -2.515 -10.822 0.604 1.00 14.00 H new ATOM 0 HG21 ILE A 69 -0.053 -8.103 1.453 1.00 40.34 H new ATOM 0 HG22 ILE A 69 -0.974 -7.460 2.834 1.00 40.34 H new ATOM 0 HG23 ILE A 69 -0.161 -9.038 2.963 1.00 40.34 H new ATOM 0 HD11 ILE A 69 -0.575 -10.926 -0.888 1.00 65.44 H new ATOM 0 HD12 ILE A 69 -1.354 -9.330 -0.993 1.00 65.44 H new ATOM 0 HD13 ILE A 69 0.152 -9.525 -0.065 1.00 65.44 H new ATOM 1137 N ALA A 70 -4.193 -7.515 3.710 1.00 73.13 N ATOM 1138 CA ALA A 70 -4.628 -6.445 4.617 1.00 34.43 C ATOM 1139 C ALA A 70 -5.178 -7.011 5.936 1.00 71.15 C ATOM 1140 O ALA A 70 -4.821 -6.536 7.013 1.00 5.24 O ATOM 1141 CB ALA A 70 -5.684 -5.581 3.920 1.00 63.10 C ATOM 0 H ALA A 70 -4.760 -7.583 2.865 1.00 73.13 H new ATOM 0 HA ALA A 70 -3.762 -5.831 4.864 1.00 34.43 H new ATOM 0 HB1 ALA A 70 -6.007 -4.787 4.593 1.00 63.10 H new ATOM 0 HB2 ALA A 70 -5.257 -5.141 3.019 1.00 63.10 H new ATOM 0 HB3 ALA A 70 -6.541 -6.199 3.651 1.00 63.10 H new ATOM 1147 N GLU A 71 -6.057 -8.032 5.837 1.00 44.55 N ATOM 1148 CA GLU A 71 -6.630 -8.722 7.015 1.00 22.52 C ATOM 1149 C GLU A 71 -5.518 -9.394 7.825 1.00 22.11 C ATOM 1150 O GLU A 71 -5.516 -9.343 9.060 1.00 42.40 O ATOM 1151 CB GLU A 71 -7.692 -9.763 6.569 1.00 75.10 C ATOM 1152 CG GLU A 71 -8.442 -10.446 7.732 1.00 63.44 C ATOM 1153 CD GLU A 71 -9.429 -11.527 7.267 1.00 4.31 C ATOM 1154 OE1 GLU A 71 -9.023 -12.705 7.147 1.00 42.41 O ATOM 1155 OE2 GLU A 71 -10.612 -11.205 7.017 1.00 32.32 O ATOM 0 H GLU A 71 -6.388 -8.400 4.945 1.00 44.55 H new ATOM 0 HA GLU A 71 -7.122 -7.985 7.650 1.00 22.52 H new ATOM 0 HB2 GLU A 71 -8.419 -9.269 5.924 1.00 75.10 H new ATOM 0 HB3 GLU A 71 -7.202 -10.530 5.969 1.00 75.10 H new ATOM 0 HG2 GLU A 71 -7.716 -10.894 8.410 1.00 63.44 H new ATOM 0 HG3 GLU A 71 -8.984 -9.690 8.300 1.00 63.44 H new ATOM 1162 N TYR A 72 -4.552 -9.964 7.090 1.00 62.42 N ATOM 1163 CA TYR A 72 -3.382 -10.631 7.662 1.00 71.11 C ATOM 1164 C TYR A 72 -2.563 -9.636 8.499 1.00 62.15 C ATOM 1165 O TYR A 72 -2.335 -9.862 9.688 1.00 62.11 O ATOM 1166 CB TYR A 72 -2.505 -11.255 6.543 1.00 33.30 C ATOM 1167 CG TYR A 72 -1.220 -11.898 7.078 1.00 43.41 C ATOM 1168 CD1 TYR A 72 -1.275 -13.096 7.789 1.00 2.24 C ATOM 1169 CD2 TYR A 72 0.034 -11.293 6.908 1.00 73.22 C ATOM 1170 CE1 TYR A 72 -0.143 -13.663 8.315 1.00 33.30 C ATOM 1171 CE2 TYR A 72 1.173 -11.868 7.431 1.00 45.33 C ATOM 1172 CZ TYR A 72 1.071 -13.054 8.133 1.00 12.14 C ATOM 1173 OH TYR A 72 2.190 -13.629 8.670 1.00 24.25 O ATOM 0 H TYR A 72 -4.565 -9.973 6.070 1.00 62.42 H new ATOM 0 HA TYR A 72 -3.724 -11.436 8.313 1.00 71.11 H new ATOM 0 HB2 TYR A 72 -3.087 -12.007 6.010 1.00 33.30 H new ATOM 0 HB3 TYR A 72 -2.244 -10.482 5.820 1.00 33.30 H new ATOM 0 HD1 TYR A 72 -2.227 -13.587 7.928 1.00 2.24 H new ATOM 0 HD2 TYR A 72 0.108 -10.365 6.361 1.00 73.22 H new ATOM 0 HE1 TYR A 72 -0.208 -14.587 8.871 1.00 33.30 H new ATOM 0 HE2 TYR A 72 2.135 -11.396 7.293 1.00 45.33 H new ATOM 0 HH TYR A 72 2.421 -13.175 9.507 1.00 24.25 H new ATOM 1183 N ALA A 73 -2.178 -8.517 7.860 1.00 44.45 N ATOM 1184 CA ALA A 73 -1.334 -7.477 8.475 1.00 54.34 C ATOM 1185 C ALA A 73 -2.040 -6.811 9.674 1.00 51.34 C ATOM 1186 O ALA A 73 -1.394 -6.438 10.656 1.00 42.35 O ATOM 1187 CB ALA A 73 -0.941 -6.443 7.418 1.00 3.13 C ATOM 0 H ALA A 73 -2.445 -8.308 6.898 1.00 44.45 H new ATOM 0 HA ALA A 73 -0.430 -7.947 8.862 1.00 54.34 H new ATOM 0 HB1 ALA A 73 -0.317 -5.675 7.875 1.00 3.13 H new ATOM 0 HB2 ALA A 73 -0.386 -6.933 6.618 1.00 3.13 H new ATOM 0 HB3 ALA A 73 -1.840 -5.983 7.007 1.00 3.13 H new ATOM 1193 N GLN A 74 -3.374 -6.691 9.588 1.00 41.44 N ATOM 1194 CA GLN A 74 -4.210 -6.171 10.687 1.00 0.33 C ATOM 1195 C GLN A 74 -4.190 -7.136 11.894 1.00 73.41 C ATOM 1196 O GLN A 74 -4.160 -6.693 13.048 1.00 32.05 O ATOM 1197 CB GLN A 74 -5.651 -5.920 10.176 1.00 70.04 C ATOM 1198 CG GLN A 74 -6.660 -5.478 11.246 1.00 30.33 C ATOM 1199 CD GLN A 74 -7.991 -5.016 10.661 1.00 74.34 C ATOM 1200 OE1 GLN A 74 -8.889 -5.822 10.424 1.00 54.42 O ATOM 1201 NE2 GLN A 74 -8.126 -3.724 10.419 1.00 13.33 N ATOM 0 H GLN A 74 -3.905 -6.951 8.757 1.00 41.44 H new ATOM 0 HA GLN A 74 -3.801 -5.220 11.030 1.00 0.33 H new ATOM 0 HB2 GLN A 74 -5.615 -5.158 9.398 1.00 70.04 H new ATOM 0 HB3 GLN A 74 -6.018 -6.835 9.710 1.00 70.04 H new ATOM 0 HG2 GLN A 74 -6.839 -6.306 11.931 1.00 30.33 H new ATOM 0 HG3 GLN A 74 -6.227 -4.667 11.832 1.00 30.33 H new ATOM 0 HE21 GLN A 74 -7.360 -3.083 10.628 1.00 13.33 H new ATOM 0 HE22 GLN A 74 -8.996 -3.367 10.023 1.00 13.33 H new ATOM 1210 N LYS A 75 -4.174 -8.453 11.613 1.00 64.42 N ATOM 1211 CA LYS A 75 -4.024 -9.497 12.657 1.00 2.23 C ATOM 1212 C LYS A 75 -2.579 -9.515 13.216 1.00 2.01 C ATOM 1213 O LYS A 75 -2.372 -9.948 14.351 1.00 10.42 O ATOM 1214 CB LYS A 75 -4.442 -10.906 12.120 1.00 62.52 C ATOM 1215 CG LYS A 75 -5.921 -11.358 12.353 1.00 3.43 C ATOM 1216 CD LYS A 75 -7.004 -10.635 11.500 1.00 1.43 C ATOM 1217 CE LYS A 75 -7.400 -9.237 12.017 1.00 51.14 C ATOM 1218 NZ LYS A 75 -8.418 -8.588 11.146 1.00 24.54 N ATOM 0 H LYS A 75 -4.263 -8.825 10.668 1.00 64.42 H new ATOM 0 HA LYS A 75 -4.698 -9.248 13.476 1.00 2.23 H new ATOM 0 HB2 LYS A 75 -4.249 -10.928 11.048 1.00 62.52 H new ATOM 0 HB3 LYS A 75 -3.788 -11.648 12.577 1.00 62.52 H new ATOM 0 HG2 LYS A 75 -5.987 -12.428 12.155 1.00 3.43 H new ATOM 0 HG3 LYS A 75 -6.162 -11.213 13.406 1.00 3.43 H new ATOM 0 HD2 LYS A 75 -6.639 -10.540 10.477 1.00 1.43 H new ATOM 0 HD3 LYS A 75 -7.896 -11.260 11.463 1.00 1.43 H new ATOM 0 HE2 LYS A 75 -7.792 -9.323 13.031 1.00 51.14 H new ATOM 0 HE3 LYS A 75 -6.513 -8.606 12.071 1.00 51.14 H new ATOM 0 HZ1 LYS A 75 -8.365 -7.556 11.260 1.00 24.54 H new ATOM 0 HZ2 LYS A 75 -8.235 -8.837 10.153 1.00 24.54 H new ATOM 0 HZ3 LYS A 75 -9.367 -8.918 11.416 1.00 24.54 H new ATOM 1232 N GLU A 76 -1.591 -9.030 12.424 1.00 24.03 N ATOM 1233 CA GLU A 76 -0.188 -8.867 12.884 1.00 54.02 C ATOM 1234 C GLU A 76 -0.031 -7.617 13.780 1.00 14.22 C ATOM 1235 O GLU A 76 1.078 -7.320 14.250 1.00 54.35 O ATOM 1236 CB GLU A 76 0.774 -8.766 11.664 1.00 31.30 C ATOM 1237 CG GLU A 76 0.710 -9.933 10.663 1.00 61.24 C ATOM 1238 CD GLU A 76 1.073 -11.298 11.266 1.00 31.34 C ATOM 1239 OE1 GLU A 76 0.189 -11.962 11.846 1.00 35.11 O ATOM 1240 OE2 GLU A 76 2.246 -11.721 11.158 1.00 12.35 O ATOM 0 H GLU A 76 -1.741 -8.743 11.457 1.00 24.03 H new ATOM 0 HA GLU A 76 0.071 -9.746 13.475 1.00 54.02 H new ATOM 0 HB2 GLU A 76 0.557 -7.841 11.130 1.00 31.30 H new ATOM 0 HB3 GLU A 76 1.795 -8.687 12.036 1.00 31.30 H new ATOM 0 HG2 GLU A 76 -0.297 -9.987 10.249 1.00 61.24 H new ATOM 0 HG3 GLU A 76 1.385 -9.723 9.833 1.00 61.24 H new ATOM 1247 N GLY A 77 -1.151 -6.892 13.996 1.00 63.41 N ATOM 1248 CA GLY A 77 -1.171 -5.682 14.813 1.00 14.35 C ATOM 1249 C GLY A 77 -0.486 -4.518 14.125 1.00 71.42 C ATOM 1250 O GLY A 77 0.217 -3.730 14.762 1.00 74.14 O ATOM 0 H GLY A 77 -2.060 -7.138 13.604 1.00 63.41 H new ATOM 0 HA2 GLY A 77 -2.203 -5.413 15.037 1.00 14.35 H new ATOM 0 HA3 GLY A 77 -0.679 -5.880 15.765 1.00 14.35 H new ATOM 1254 N LEU A 78 -0.670 -4.438 12.798 1.00 3.52 N ATOM 1255 CA LEU A 78 -0.050 -3.414 11.942 1.00 54.12 C ATOM 1256 C LEU A 78 -1.156 -2.556 11.317 1.00 1.20 C ATOM 1257 O LEU A 78 -2.183 -3.103 10.892 1.00 23.11 O ATOM 1258 CB LEU A 78 0.804 -4.106 10.835 1.00 71.10 C ATOM 1259 CG LEU A 78 1.834 -5.170 11.338 1.00 54.14 C ATOM 1260 CD1 LEU A 78 2.526 -5.896 10.173 1.00 65.24 C ATOM 1261 CD2 LEU A 78 2.868 -4.555 12.290 1.00 64.23 C ATOM 0 H LEU A 78 -1.261 -5.091 12.283 1.00 3.52 H new ATOM 0 HA LEU A 78 0.606 -2.775 12.533 1.00 54.12 H new ATOM 0 HB2 LEU A 78 0.128 -4.588 10.128 1.00 71.10 H new ATOM 0 HB3 LEU A 78 1.345 -3.336 10.285 1.00 71.10 H new ATOM 0 HG LEU A 78 1.266 -5.913 11.898 1.00 54.14 H new ATOM 0 HD11 LEU A 78 3.233 -6.626 10.568 1.00 65.24 H new ATOM 0 HD12 LEU A 78 1.778 -6.407 9.567 1.00 65.24 H new ATOM 0 HD13 LEU A 78 3.059 -5.171 9.558 1.00 65.24 H new ATOM 0 HD21 LEU A 78 3.565 -5.326 12.617 1.00 64.23 H new ATOM 0 HD22 LEU A 78 3.415 -3.767 11.773 1.00 64.23 H new ATOM 0 HD23 LEU A 78 2.359 -4.134 13.157 1.00 64.23 H new ATOM 1273 N ARG A 79 -0.957 -1.219 11.287 1.00 74.03 N ATOM 1274 CA ARG A 79 -1.875 -0.305 10.580 1.00 34.42 C ATOM 1275 C ARG A 79 -1.780 -0.560 9.079 1.00 73.13 C ATOM 1276 O ARG A 79 -0.705 -0.416 8.496 1.00 4.23 O ATOM 1277 CB ARG A 79 -1.557 1.194 10.869 1.00 22.52 C ATOM 1278 CG ARG A 79 -1.868 1.670 12.297 1.00 52.22 C ATOM 1279 CD ARG A 79 -3.328 1.400 12.697 1.00 2.22 C ATOM 1280 NE ARG A 79 -4.291 1.857 11.665 1.00 34.24 N ATOM 1281 CZ ARG A 79 -5.533 1.366 11.478 1.00 14.12 C ATOM 1282 NH1 ARG A 79 -6.014 0.400 12.256 1.00 35.43 N ATOM 1283 NH2 ARG A 79 -6.288 1.845 10.501 1.00 5.41 N ATOM 0 H ARG A 79 -0.172 -0.753 11.743 1.00 74.03 H new ATOM 0 HA ARG A 79 -2.883 -0.503 10.943 1.00 34.42 H new ATOM 0 HB2 ARG A 79 -0.500 1.369 10.668 1.00 22.52 H new ATOM 0 HB3 ARG A 79 -2.121 1.809 10.168 1.00 22.52 H new ATOM 0 HG2 ARG A 79 -1.202 1.167 12.998 1.00 52.22 H new ATOM 0 HG3 ARG A 79 -1.664 2.738 12.374 1.00 52.22 H new ATOM 0 HD2 ARG A 79 -3.463 0.332 12.869 1.00 2.22 H new ATOM 0 HD3 ARG A 79 -3.543 1.904 13.639 1.00 2.22 H new ATOM 0 HE ARG A 79 -3.988 2.607 11.044 1.00 34.24 H new ATOM 0 HH11 ARG A 79 -5.441 0.019 13.009 1.00 35.43 H new ATOM 0 HH12 ARG A 79 -6.956 0.041 12.100 1.00 35.43 H new ATOM 0 HH21 ARG A 79 -5.929 2.582 9.894 1.00 5.41 H new ATOM 0 HH22 ARG A 79 -7.228 1.477 10.356 1.00 5.41 H new ATOM 1297 N VAL A 80 -2.891 -0.953 8.466 1.00 24.15 N ATOM 1298 CA VAL A 80 -2.932 -1.243 7.032 1.00 75.53 C ATOM 1299 C VAL A 80 -3.426 -0.013 6.276 1.00 33.20 C ATOM 1300 O VAL A 80 -4.534 0.466 6.508 1.00 52.21 O ATOM 1301 CB VAL A 80 -3.842 -2.469 6.715 1.00 62.31 C ATOM 1302 CG1 VAL A 80 -3.824 -2.791 5.201 1.00 63.10 C ATOM 1303 CG2 VAL A 80 -3.434 -3.683 7.577 1.00 42.02 C ATOM 0 H VAL A 80 -3.784 -1.080 8.942 1.00 24.15 H new ATOM 0 HA VAL A 80 -1.922 -1.494 6.709 1.00 75.53 H new ATOM 0 HB VAL A 80 -4.871 -2.220 6.974 1.00 62.31 H new ATOM 0 HG11 VAL A 80 -4.466 -3.650 5.004 1.00 63.10 H new ATOM 0 HG12 VAL A 80 -4.189 -1.930 4.641 1.00 63.10 H new ATOM 0 HG13 VAL A 80 -2.805 -3.021 4.890 1.00 63.10 H new ATOM 0 HG21 VAL A 80 -4.080 -4.529 7.342 1.00 42.02 H new ATOM 0 HG22 VAL A 80 -2.398 -3.948 7.366 1.00 42.02 H new ATOM 0 HG23 VAL A 80 -3.536 -3.431 8.632 1.00 42.02 H new ATOM 1313 N ILE A 81 -2.568 0.503 5.402 1.00 33.31 N ATOM 1314 CA ILE A 81 -2.846 1.665 4.563 1.00 62.02 C ATOM 1315 C ILE A 81 -3.056 1.173 3.129 1.00 73.24 C ATOM 1316 O ILE A 81 -2.154 0.590 2.548 1.00 21.02 O ATOM 1317 CB ILE A 81 -1.665 2.720 4.631 1.00 4.24 C ATOM 1318 CG1 ILE A 81 -1.706 3.566 5.942 1.00 31.41 C ATOM 1319 CG2 ILE A 81 -1.651 3.653 3.401 1.00 2.32 C ATOM 1320 CD1 ILE A 81 -1.529 2.797 7.237 1.00 33.44 C ATOM 0 H ILE A 81 -1.636 0.115 5.253 1.00 33.31 H new ATOM 0 HA ILE A 81 -3.742 2.172 4.921 1.00 62.02 H new ATOM 0 HB ILE A 81 -0.743 2.139 4.631 1.00 4.24 H new ATOM 0 HG12 ILE A 81 -0.927 4.326 5.885 1.00 31.41 H new ATOM 0 HG13 ILE A 81 -2.660 4.091 5.982 1.00 31.41 H new ATOM 0 HG21 ILE A 81 -0.826 4.360 3.490 1.00 2.32 H new ATOM 0 HG22 ILE A 81 -1.525 3.059 2.496 1.00 2.32 H new ATOM 0 HG23 ILE A 81 -2.593 4.200 3.348 1.00 2.32 H new ATOM 0 HD11 ILE A 81 -1.575 3.487 8.079 1.00 33.44 H new ATOM 0 HD12 ILE A 81 -2.323 2.056 7.331 1.00 33.44 H new ATOM 0 HD13 ILE A 81 -0.562 2.294 7.232 1.00 33.44 H new ATOM 1332 N VAL A 82 -4.244 1.399 2.575 1.00 42.33 N ATOM 1333 CA VAL A 82 -4.560 1.027 1.191 1.00 23.43 C ATOM 1334 C VAL A 82 -4.571 2.310 0.342 1.00 30.44 C ATOM 1335 O VAL A 82 -5.421 3.160 0.545 1.00 64.55 O ATOM 1336 CB VAL A 82 -5.954 0.285 1.138 1.00 1.52 C ATOM 1337 CG1 VAL A 82 -6.373 -0.062 -0.306 1.00 24.30 C ATOM 1338 CG2 VAL A 82 -5.933 -0.981 2.041 1.00 34.31 C ATOM 0 H VAL A 82 -5.017 1.845 3.069 1.00 42.33 H new ATOM 0 HA VAL A 82 -3.812 0.341 0.794 1.00 23.43 H new ATOM 0 HB VAL A 82 -6.707 0.971 1.526 1.00 1.52 H new ATOM 0 HG11 VAL A 82 -7.337 -0.571 -0.293 1.00 24.30 H new ATOM 0 HG12 VAL A 82 -6.454 0.854 -0.891 1.00 24.30 H new ATOM 0 HG13 VAL A 82 -5.624 -0.715 -0.755 1.00 24.30 H new ATOM 0 HG21 VAL A 82 -6.901 -1.479 1.992 1.00 34.31 H new ATOM 0 HG22 VAL A 82 -5.156 -1.663 1.694 1.00 34.31 H new ATOM 0 HG23 VAL A 82 -5.727 -0.690 3.071 1.00 34.31 H new ATOM 1348 N ILE A 83 -3.604 2.472 -0.581 1.00 71.21 N ATOM 1349 CA ILE A 83 -3.549 3.656 -1.472 1.00 44.12 C ATOM 1350 C ILE A 83 -3.891 3.219 -2.893 1.00 61.32 C ATOM 1351 O ILE A 83 -3.077 2.592 -3.568 1.00 63.24 O ATOM 1352 CB ILE A 83 -2.139 4.362 -1.435 1.00 64.51 C ATOM 1353 CG1 ILE A 83 -1.799 4.784 0.024 1.00 34.12 C ATOM 1354 CG2 ILE A 83 -2.084 5.588 -2.399 1.00 32.24 C ATOM 1355 CD1 ILE A 83 -0.437 5.413 0.216 1.00 73.41 C ATOM 0 H ILE A 83 -2.850 1.802 -0.732 1.00 71.21 H new ATOM 0 HA ILE A 83 -4.276 4.388 -1.119 1.00 44.12 H new ATOM 0 HB ILE A 83 -1.390 3.650 -1.781 1.00 64.51 H new ATOM 0 HG12 ILE A 83 -2.557 5.488 0.367 1.00 34.12 H new ATOM 0 HG13 ILE A 83 -1.868 3.904 0.664 1.00 34.12 H new ATOM 0 HG21 ILE A 83 -1.097 6.048 -2.346 1.00 32.24 H new ATOM 0 HG22 ILE A 83 -2.276 5.257 -3.420 1.00 32.24 H new ATOM 0 HG23 ILE A 83 -2.840 6.316 -2.105 1.00 32.24 H new ATOM 0 HD11 ILE A 83 -0.300 5.670 1.266 1.00 73.41 H new ATOM 0 HD12 ILE A 83 0.336 4.707 -0.089 1.00 73.41 H new ATOM 0 HD13 ILE A 83 -0.364 6.316 -0.391 1.00 73.41 H new ATOM 1367 N ILE A 84 -5.103 3.540 -3.334 1.00 35.51 N ATOM 1368 CA ILE A 84 -5.581 3.165 -4.664 1.00 5.15 C ATOM 1369 C ILE A 84 -5.303 4.311 -5.637 1.00 53.03 C ATOM 1370 O ILE A 84 -5.748 5.443 -5.399 1.00 41.54 O ATOM 1371 CB ILE A 84 -7.111 2.826 -4.658 1.00 35.12 C ATOM 1372 CG1 ILE A 84 -7.437 1.797 -3.534 1.00 72.04 C ATOM 1373 CG2 ILE A 84 -7.547 2.289 -6.046 1.00 72.53 C ATOM 1374 CD1 ILE A 84 -8.903 1.499 -3.369 1.00 3.03 C ATOM 0 H ILE A 84 -5.781 4.066 -2.783 1.00 35.51 H new ATOM 0 HA ILE A 84 -5.049 2.267 -4.979 1.00 5.15 H new ATOM 0 HB ILE A 84 -7.672 3.738 -4.453 1.00 35.12 H new ATOM 0 HG12 ILE A 84 -6.911 0.866 -3.747 1.00 72.04 H new ATOM 0 HG13 ILE A 84 -7.047 2.174 -2.589 1.00 72.04 H new ATOM 0 HG21 ILE A 84 -8.612 2.057 -6.028 1.00 72.53 H new ATOM 0 HG22 ILE A 84 -7.353 3.046 -6.806 1.00 72.53 H new ATOM 0 HG23 ILE A 84 -6.983 1.386 -6.280 1.00 72.53 H new ATOM 0 HD11 ILE A 84 -9.039 0.774 -2.566 1.00 3.03 H new ATOM 0 HD12 ILE A 84 -9.436 2.418 -3.122 1.00 3.03 H new ATOM 0 HD13 ILE A 84 -9.298 1.089 -4.299 1.00 3.03 H new ATOM 1386 N VAL A 85 -4.551 4.015 -6.707 1.00 21.14 N ATOM 1387 CA VAL A 85 -4.221 4.971 -7.762 1.00 12.23 C ATOM 1388 C VAL A 85 -4.916 4.527 -9.058 1.00 31.44 C ATOM 1389 O VAL A 85 -4.463 3.578 -9.705 1.00 2.35 O ATOM 1390 CB VAL A 85 -2.663 5.061 -8.001 1.00 1.32 C ATOM 1391 CG1 VAL A 85 -2.323 6.326 -8.814 1.00 11.42 C ATOM 1392 CG2 VAL A 85 -1.871 4.995 -6.669 1.00 23.11 C ATOM 0 H VAL A 85 -4.151 3.089 -6.862 1.00 21.14 H new ATOM 0 HA VAL A 85 -4.565 5.959 -7.457 1.00 12.23 H new ATOM 0 HB VAL A 85 -2.355 4.192 -8.583 1.00 1.32 H new ATOM 0 HG11 VAL A 85 -1.246 6.378 -8.973 1.00 11.42 H new ATOM 0 HG12 VAL A 85 -2.830 6.286 -9.778 1.00 11.42 H new ATOM 0 HG13 VAL A 85 -2.652 7.209 -8.267 1.00 11.42 H new ATOM 0 HG21 VAL A 85 -0.803 5.060 -6.877 1.00 23.11 H new ATOM 0 HG22 VAL A 85 -2.167 5.825 -6.028 1.00 23.11 H new ATOM 0 HG23 VAL A 85 -2.086 4.053 -6.164 1.00 23.11 H new ATOM 1402 N SER A 86 -6.024 5.186 -9.418 1.00 11.51 N ATOM 1403 CA SER A 86 -6.815 4.848 -10.613 1.00 11.41 C ATOM 1404 C SER A 86 -7.508 6.104 -11.155 1.00 50.12 C ATOM 1405 O SER A 86 -8.008 6.927 -10.379 1.00 64.15 O ATOM 1406 CB SER A 86 -7.885 3.767 -10.278 1.00 71.13 C ATOM 1407 OG SER A 86 -7.295 2.553 -9.833 1.00 11.01 O ATOM 0 H SER A 86 -6.401 5.972 -8.888 1.00 11.51 H new ATOM 0 HA SER A 86 -6.139 4.450 -11.369 1.00 11.41 H new ATOM 0 HB2 SER A 86 -8.556 4.148 -9.508 1.00 71.13 H new ATOM 0 HB3 SER A 86 -8.492 3.572 -11.162 1.00 71.13 H new ATOM 0 HG SER A 86 -7.999 1.902 -9.632 1.00 11.01 H new ATOM 1413 N GLN A 87 -7.541 6.232 -12.498 1.00 52.53 N ATOM 1414 CA GLN A 87 -8.354 7.255 -13.185 1.00 41.31 C ATOM 1415 C GLN A 87 -9.848 6.941 -12.974 1.00 33.40 C ATOM 1416 O GLN A 87 -10.693 7.843 -12.948 1.00 51.43 O ATOM 1417 CB GLN A 87 -8.018 7.316 -14.707 1.00 75.13 C ATOM 1418 CG GLN A 87 -8.320 6.017 -15.497 1.00 63.14 C ATOM 1419 CD GLN A 87 -7.972 6.096 -16.992 1.00 1.52 C ATOM 1420 OE1 GLN A 87 -7.049 6.802 -17.396 1.00 14.44 O ATOM 1421 NE2 GLN A 87 -8.702 5.357 -17.817 1.00 3.13 N ATOM 0 H GLN A 87 -7.010 5.634 -13.131 1.00 52.53 H new ATOM 0 HA GLN A 87 -8.123 8.232 -12.760 1.00 41.31 H new ATOM 0 HB2 GLN A 87 -8.580 8.135 -15.155 1.00 75.13 H new ATOM 0 HB3 GLN A 87 -6.961 7.555 -14.821 1.00 75.13 H new ATOM 0 HG2 GLN A 87 -7.763 5.194 -15.048 1.00 63.14 H new ATOM 0 HG3 GLN A 87 -9.379 5.779 -15.394 1.00 63.14 H new ATOM 0 HE21 GLN A 87 -9.461 4.782 -17.451 1.00 3.13 H new ATOM 0 HE22 GLN A 87 -8.505 5.364 -18.818 1.00 3.13 H new ATOM 1430 N ASP A 88 -10.136 5.631 -12.830 1.00 3.33 N ATOM 1431 CA ASP A 88 -11.457 5.115 -12.480 1.00 22.40 C ATOM 1432 C ASP A 88 -11.757 5.465 -11.015 1.00 61.12 C ATOM 1433 O ASP A 88 -11.323 4.755 -10.098 1.00 43.12 O ATOM 1434 CB ASP A 88 -11.512 3.576 -12.680 1.00 51.43 C ATOM 1435 CG ASP A 88 -11.248 3.137 -14.127 1.00 25.43 C ATOM 1436 OD1 ASP A 88 -10.063 3.074 -14.534 1.00 52.14 O ATOM 1437 OD2 ASP A 88 -12.218 2.868 -14.871 1.00 10.31 O ATOM 0 H ASP A 88 -9.439 4.897 -12.958 1.00 3.33 H new ATOM 0 HA ASP A 88 -12.205 5.570 -13.130 1.00 22.40 H new ATOM 0 HB2 ASP A 88 -10.777 3.106 -12.026 1.00 51.43 H new ATOM 0 HB3 ASP A 88 -12.492 3.212 -12.371 1.00 51.43 H new ATOM 1442 N GLU A 89 -12.457 6.586 -10.812 1.00 13.31 N ATOM 1443 CA GLU A 89 -12.864 7.056 -9.477 1.00 75.32 C ATOM 1444 C GLU A 89 -13.917 6.138 -8.842 1.00 55.01 C ATOM 1445 O GLU A 89 -14.074 6.134 -7.621 1.00 41.25 O ATOM 1446 CB GLU A 89 -13.369 8.513 -9.531 1.00 1.01 C ATOM 1447 CG GLU A 89 -12.303 9.531 -9.969 1.00 75.22 C ATOM 1448 CD GLU A 89 -12.772 10.974 -9.766 1.00 24.12 C ATOM 1449 OE1 GLU A 89 -12.677 11.478 -8.628 1.00 43.21 O ATOM 1450 OE2 GLU A 89 -13.263 11.602 -10.729 1.00 60.11 O ATOM 0 H GLU A 89 -12.760 7.198 -11.570 1.00 13.31 H new ATOM 0 HA GLU A 89 -11.978 7.024 -8.843 1.00 75.32 H new ATOM 0 HB2 GLU A 89 -14.213 8.568 -10.218 1.00 1.01 H new ATOM 0 HB3 GLU A 89 -13.741 8.794 -8.546 1.00 1.01 H new ATOM 0 HG2 GLU A 89 -11.387 9.364 -9.402 1.00 75.22 H new ATOM 0 HG3 GLU A 89 -12.060 9.373 -11.020 1.00 75.22 H new ATOM 1457 N GLU A 90 -14.632 5.379 -9.681 1.00 54.13 N ATOM 1458 CA GLU A 90 -15.566 4.341 -9.225 1.00 5.24 C ATOM 1459 C GLU A 90 -14.788 3.184 -8.577 1.00 13.02 C ATOM 1460 O GLU A 90 -15.218 2.634 -7.561 1.00 24.44 O ATOM 1461 CB GLU A 90 -16.433 3.852 -10.407 1.00 43.53 C ATOM 1462 CG GLU A 90 -17.277 4.969 -11.050 1.00 32.11 C ATOM 1463 CD GLU A 90 -18.191 4.459 -12.166 1.00 53.31 C ATOM 1464 OE1 GLU A 90 -19.282 3.935 -11.850 1.00 61.14 O ATOM 1465 OE2 GLU A 90 -17.827 4.572 -13.357 1.00 45.32 O ATOM 0 H GLU A 90 -14.580 5.467 -10.696 1.00 54.13 H new ATOM 0 HA GLU A 90 -16.235 4.758 -8.472 1.00 5.24 H new ATOM 0 HB2 GLU A 90 -15.785 3.414 -11.166 1.00 43.53 H new ATOM 0 HB3 GLU A 90 -17.096 3.061 -10.058 1.00 43.53 H new ATOM 0 HG2 GLU A 90 -17.884 5.447 -10.281 1.00 32.11 H new ATOM 0 HG3 GLU A 90 -16.612 5.733 -11.453 1.00 32.11 H new ATOM 1472 N ALA A 91 -13.620 2.848 -9.159 1.00 64.14 N ATOM 1473 CA ALA A 91 -12.697 1.847 -8.591 1.00 3.11 C ATOM 1474 C ALA A 91 -12.021 2.389 -7.314 1.00 51.12 C ATOM 1475 O ALA A 91 -11.752 1.625 -6.378 1.00 3.11 O ATOM 1476 CB ALA A 91 -11.645 1.426 -9.630 1.00 22.12 C ATOM 0 H ALA A 91 -13.291 3.261 -10.032 1.00 64.14 H new ATOM 0 HA ALA A 91 -13.277 0.965 -8.319 1.00 3.11 H new ATOM 0 HB1 ALA A 91 -10.975 0.687 -9.190 1.00 22.12 H new ATOM 0 HB2 ALA A 91 -12.143 0.993 -10.497 1.00 22.12 H new ATOM 0 HB3 ALA A 91 -11.070 2.299 -9.940 1.00 22.12 H new ATOM 1482 N LEU A 92 -11.751 3.718 -7.295 1.00 61.33 N ATOM 1483 CA LEU A 92 -11.249 4.417 -6.093 1.00 22.44 C ATOM 1484 C LEU A 92 -12.277 4.296 -4.951 1.00 24.00 C ATOM 1485 O LEU A 92 -11.923 3.950 -3.830 1.00 44.31 O ATOM 1486 CB LEU A 92 -10.968 5.930 -6.372 1.00 35.34 C ATOM 1487 CG LEU A 92 -9.828 6.278 -7.383 1.00 45.45 C ATOM 1488 CD1 LEU A 92 -9.660 7.813 -7.536 1.00 1.20 C ATOM 1489 CD2 LEU A 92 -8.505 5.623 -6.979 1.00 71.15 C ATOM 0 H LEU A 92 -11.874 4.327 -8.104 1.00 61.33 H new ATOM 0 HA LEU A 92 -10.309 3.944 -5.808 1.00 22.44 H new ATOM 0 HB2 LEU A 92 -11.890 6.382 -6.737 1.00 35.34 H new ATOM 0 HB3 LEU A 92 -10.733 6.409 -5.422 1.00 35.34 H new ATOM 0 HG LEU A 92 -10.118 5.874 -8.353 1.00 45.45 H new ATOM 0 HD11 LEU A 92 -8.860 8.022 -8.246 1.00 1.20 H new ATOM 0 HD12 LEU A 92 -10.591 8.246 -7.901 1.00 1.20 H new ATOM 0 HD13 LEU A 92 -9.411 8.250 -6.569 1.00 1.20 H new ATOM 0 HD21 LEU A 92 -7.733 5.885 -7.703 1.00 71.15 H new ATOM 0 HD22 LEU A 92 -8.211 5.977 -5.991 1.00 71.15 H new ATOM 0 HD23 LEU A 92 -8.627 4.540 -6.955 1.00 71.15 H new ATOM 1501 N ARG A 93 -13.553 4.557 -5.294 1.00 62.13 N ATOM 1502 CA ARG A 93 -14.671 4.681 -4.337 1.00 14.52 C ATOM 1503 C ARG A 93 -14.999 3.330 -3.672 1.00 74.34 C ATOM 1504 O ARG A 93 -15.141 3.257 -2.442 1.00 62.24 O ATOM 1505 CB ARG A 93 -15.927 5.236 -5.073 1.00 5.43 C ATOM 1506 CG ARG A 93 -17.179 5.457 -4.187 1.00 44.11 C ATOM 1507 CD ARG A 93 -16.981 6.523 -3.093 1.00 43.33 C ATOM 1508 NE ARG A 93 -18.167 6.637 -2.225 1.00 54.12 N ATOM 1509 CZ ARG A 93 -18.527 7.721 -1.516 1.00 3.21 C ATOM 1510 NH1 ARG A 93 -17.801 8.836 -1.556 1.00 62.51 N ATOM 1511 NH2 ARG A 93 -19.605 7.656 -0.746 1.00 52.23 N ATOM 0 H ARG A 93 -13.842 4.690 -6.263 1.00 62.13 H new ATOM 0 HA ARG A 93 -14.371 5.372 -3.549 1.00 14.52 H new ATOM 0 HB2 ARG A 93 -15.663 6.185 -5.540 1.00 5.43 H new ATOM 0 HB3 ARG A 93 -16.189 4.547 -5.876 1.00 5.43 H new ATOM 0 HG2 ARG A 93 -18.015 5.751 -4.821 1.00 44.11 H new ATOM 0 HG3 ARG A 93 -17.452 4.512 -3.717 1.00 44.11 H new ATOM 0 HD2 ARG A 93 -16.110 6.268 -2.489 1.00 43.33 H new ATOM 0 HD3 ARG A 93 -16.775 7.488 -3.557 1.00 43.33 H new ATOM 0 HE ARG A 93 -18.770 5.818 -2.156 1.00 54.12 H new ATOM 0 HH11 ARG A 93 -16.959 8.876 -2.130 1.00 62.51 H new ATOM 0 HH12 ARG A 93 -18.087 9.650 -1.013 1.00 62.51 H new ATOM 0 HH21 ARG A 93 -20.147 6.793 -0.699 1.00 52.23 H new ATOM 0 HH22 ARG A 93 -19.892 8.469 -0.201 1.00 52.23 H new ATOM 1525 N LYS A 94 -15.113 2.271 -4.499 1.00 73.11 N ATOM 1526 CA LYS A 94 -15.482 0.924 -4.021 1.00 13.31 C ATOM 1527 C LYS A 94 -14.412 0.383 -3.072 1.00 63.30 C ATOM 1528 O LYS A 94 -14.719 -0.019 -1.951 1.00 24.14 O ATOM 1529 CB LYS A 94 -15.707 -0.049 -5.207 1.00 71.34 C ATOM 1530 CG LYS A 94 -16.902 0.341 -6.095 1.00 2.34 C ATOM 1531 CD LYS A 94 -17.146 -0.633 -7.262 1.00 51.14 C ATOM 1532 CE LYS A 94 -18.355 -0.212 -8.109 1.00 35.14 C ATOM 1533 NZ LYS A 94 -18.621 -1.166 -9.215 1.00 71.52 N ATOM 0 H LYS A 94 -14.954 2.324 -5.505 1.00 73.11 H new ATOM 0 HA LYS A 94 -16.422 1.004 -3.474 1.00 13.31 H new ATOM 0 HB2 LYS A 94 -14.805 -0.082 -5.818 1.00 71.34 H new ATOM 0 HB3 LYS A 94 -15.865 -1.055 -4.818 1.00 71.34 H new ATOM 0 HG2 LYS A 94 -17.800 0.390 -5.480 1.00 2.34 H new ATOM 0 HG3 LYS A 94 -16.735 1.341 -6.496 1.00 2.34 H new ATOM 0 HD2 LYS A 94 -16.258 -0.676 -7.892 1.00 51.14 H new ATOM 0 HD3 LYS A 94 -17.308 -1.637 -6.870 1.00 51.14 H new ATOM 0 HE2 LYS A 94 -19.237 -0.141 -7.472 1.00 35.14 H new ATOM 0 HE3 LYS A 94 -18.180 0.781 -8.522 1.00 35.14 H new ATOM 0 HZ1 LYS A 94 -19.445 -0.843 -9.761 1.00 71.52 H new ATOM 0 HZ2 LYS A 94 -17.790 -1.215 -9.839 1.00 71.52 H new ATOM 0 HZ3 LYS A 94 -18.814 -2.109 -8.821 1.00 71.52 H new ATOM 1547 N GLY A 95 -13.149 0.450 -3.520 1.00 11.20 N ATOM 1548 CA GLY A 95 -12.015 0.020 -2.709 1.00 23.40 C ATOM 1549 C GLY A 95 -11.802 0.885 -1.474 1.00 72.24 C ATOM 1550 O GLY A 95 -11.295 0.398 -0.458 1.00 72.52 O ATOM 0 H GLY A 95 -12.894 0.800 -4.443 1.00 11.20 H new ATOM 0 HA2 GLY A 95 -12.169 -1.014 -2.399 1.00 23.40 H new ATOM 0 HA3 GLY A 95 -11.112 0.039 -3.319 1.00 23.40 H new ATOM 1554 N TYR A 96 -12.185 2.177 -1.570 1.00 53.25 N ATOM 1555 CA TYR A 96 -12.054 3.126 -0.455 1.00 31.44 C ATOM 1556 C TYR A 96 -12.896 2.666 0.732 1.00 73.11 C ATOM 1557 O TYR A 96 -12.361 2.374 1.793 1.00 54.14 O ATOM 1558 CB TYR A 96 -12.467 4.563 -0.881 1.00 35.44 C ATOM 1559 CG TYR A 96 -12.359 5.634 0.221 1.00 33.13 C ATOM 1560 CD1 TYR A 96 -11.129 5.945 0.813 1.00 72.31 C ATOM 1561 CD2 TYR A 96 -13.483 6.339 0.673 1.00 12.52 C ATOM 1562 CE1 TYR A 96 -11.027 6.911 1.794 1.00 70.41 C ATOM 1563 CE2 TYR A 96 -13.378 7.309 1.658 1.00 61.44 C ATOM 1564 CZ TYR A 96 -12.149 7.589 2.215 1.00 31.52 C ATOM 1565 OH TYR A 96 -12.044 8.545 3.200 1.00 52.22 O ATOM 0 H TYR A 96 -12.588 2.583 -2.414 1.00 53.25 H new ATOM 0 HA TYR A 96 -11.005 3.152 -0.160 1.00 31.44 H new ATOM 0 HB2 TYR A 96 -11.845 4.867 -1.723 1.00 35.44 H new ATOM 0 HB3 TYR A 96 -13.496 4.536 -1.239 1.00 35.44 H new ATOM 0 HD1 TYR A 96 -10.241 5.418 0.496 1.00 72.31 H new ATOM 0 HD2 TYR A 96 -14.451 6.122 0.245 1.00 12.52 H new ATOM 0 HE1 TYR A 96 -10.066 7.135 2.232 1.00 70.41 H new ATOM 0 HE2 TYR A 96 -14.257 7.844 1.988 1.00 61.44 H new ATOM 0 HH TYR A 96 -12.928 8.929 3.379 1.00 52.22 H new ATOM 1575 N GLU A 97 -14.201 2.521 0.490 1.00 23.20 N ATOM 1576 CA GLU A 97 -15.188 2.237 1.538 1.00 22.51 C ATOM 1577 C GLU A 97 -15.083 0.780 2.018 1.00 4.35 C ATOM 1578 O GLU A 97 -15.218 0.517 3.214 1.00 52.42 O ATOM 1579 CB GLU A 97 -16.606 2.548 1.013 1.00 53.31 C ATOM 1580 CG GLU A 97 -16.751 3.954 0.393 1.00 3.14 C ATOM 1581 CD GLU A 97 -18.116 4.177 -0.271 1.00 33.53 C ATOM 1582 OE1 GLU A 97 -18.344 3.630 -1.369 1.00 73.12 O ATOM 1583 OE2 GLU A 97 -18.963 4.907 0.295 1.00 65.14 O ATOM 0 H GLU A 97 -14.606 2.597 -0.443 1.00 23.20 H new ATOM 0 HA GLU A 97 -14.982 2.876 2.397 1.00 22.51 H new ATOM 0 HB2 GLU A 97 -16.877 1.803 0.265 1.00 53.31 H new ATOM 0 HB3 GLU A 97 -17.316 2.449 1.834 1.00 53.31 H new ATOM 0 HG2 GLU A 97 -16.604 4.705 1.169 1.00 3.14 H new ATOM 0 HG3 GLU A 97 -15.964 4.102 -0.347 1.00 3.14 H new ATOM 1590 N ASP A 98 -14.811 -0.144 1.073 1.00 2.12 N ATOM 1591 CA ASP A 98 -14.715 -1.597 1.346 1.00 12.52 C ATOM 1592 C ASP A 98 -13.579 -1.903 2.342 1.00 23.52 C ATOM 1593 O ASP A 98 -13.754 -2.692 3.269 1.00 25.12 O ATOM 1594 CB ASP A 98 -14.485 -2.380 0.027 1.00 61.42 C ATOM 1595 CG ASP A 98 -14.433 -3.905 0.217 1.00 5.00 C ATOM 1596 OD1 ASP A 98 -15.506 -4.536 0.333 1.00 34.22 O ATOM 1597 OD2 ASP A 98 -13.322 -4.483 0.282 1.00 22.24 O ATOM 0 H ASP A 98 -14.651 0.096 0.095 1.00 2.12 H new ATOM 0 HA ASP A 98 -15.657 -1.916 1.792 1.00 12.52 H new ATOM 0 HB2 ASP A 98 -15.283 -2.137 -0.674 1.00 61.42 H new ATOM 0 HB3 ASP A 98 -13.551 -2.047 -0.425 1.00 61.42 H new ATOM 1602 N LYS A 99 -12.417 -1.292 2.114 1.00 54.30 N ATOM 1603 CA LYS A 99 -11.238 -1.462 2.981 1.00 73.01 C ATOM 1604 C LYS A 99 -11.359 -0.593 4.264 1.00 12.21 C ATOM 1605 O LYS A 99 -10.921 -1.008 5.341 1.00 15.30 O ATOM 1606 CB LYS A 99 -9.924 -1.169 2.187 1.00 42.21 C ATOM 1607 CG LYS A 99 -9.442 -2.315 1.247 1.00 72.43 C ATOM 1608 CD LYS A 99 -10.450 -2.654 0.125 1.00 72.31 C ATOM 1609 CE LYS A 99 -9.996 -3.823 -0.762 1.00 74.43 C ATOM 1610 NZ LYS A 99 -11.078 -4.250 -1.688 1.00 3.23 N ATOM 0 H LYS A 99 -12.260 -0.664 1.325 1.00 54.30 H new ATOM 0 HA LYS A 99 -11.193 -2.501 3.308 1.00 73.01 H new ATOM 0 HB2 LYS A 99 -10.074 -0.270 1.589 1.00 42.21 H new ATOM 0 HB3 LYS A 99 -9.130 -0.949 2.900 1.00 42.21 H new ATOM 0 HG2 LYS A 99 -8.491 -2.030 0.797 1.00 72.43 H new ATOM 0 HG3 LYS A 99 -9.258 -3.209 1.842 1.00 72.43 H new ATOM 0 HD2 LYS A 99 -11.413 -2.898 0.572 1.00 72.31 H new ATOM 0 HD3 LYS A 99 -10.602 -1.772 -0.497 1.00 72.31 H new ATOM 0 HE2 LYS A 99 -9.118 -3.527 -1.337 1.00 74.43 H new ATOM 0 HE3 LYS A 99 -9.698 -4.664 -0.135 1.00 74.43 H new ATOM 0 HZ1 LYS A 99 -11.166 -5.286 -1.665 1.00 3.23 H new ATOM 0 HZ2 LYS A 99 -11.977 -3.819 -1.393 1.00 3.23 H new ATOM 0 HZ3 LYS A 99 -10.848 -3.944 -2.655 1.00 3.23 H new ATOM 1624 N LYS A 100 -11.984 0.592 4.142 1.00 4.44 N ATOM 1625 CA LYS A 100 -12.113 1.563 5.262 1.00 53.55 C ATOM 1626 C LYS A 100 -13.050 1.036 6.369 1.00 75.00 C ATOM 1627 O LYS A 100 -12.791 1.248 7.563 1.00 4.10 O ATOM 1628 CB LYS A 100 -12.607 2.926 4.710 1.00 32.44 C ATOM 1629 CG LYS A 100 -12.655 4.093 5.721 1.00 3.53 C ATOM 1630 CD LYS A 100 -13.045 5.423 5.033 1.00 15.14 C ATOM 1631 CE LYS A 100 -13.162 6.593 6.018 1.00 32.15 C ATOM 1632 NZ LYS A 100 -14.233 6.373 7.025 1.00 21.33 N ATOM 0 H LYS A 100 -12.414 0.909 3.273 1.00 4.44 H new ATOM 0 HA LYS A 100 -11.133 1.698 5.719 1.00 53.55 H new ATOM 0 HB2 LYS A 100 -11.959 3.216 3.882 1.00 32.44 H new ATOM 0 HB3 LYS A 100 -13.607 2.787 4.299 1.00 32.44 H new ATOM 0 HG2 LYS A 100 -13.374 3.865 6.508 1.00 3.53 H new ATOM 0 HG3 LYS A 100 -11.682 4.201 6.200 1.00 3.53 H new ATOM 0 HD2 LYS A 100 -12.300 5.666 4.275 1.00 15.14 H new ATOM 0 HD3 LYS A 100 -13.996 5.294 4.516 1.00 15.14 H new ATOM 0 HE2 LYS A 100 -12.209 6.733 6.528 1.00 32.15 H new ATOM 0 HE3 LYS A 100 -13.367 7.511 5.467 1.00 32.15 H new ATOM 0 HZ1 LYS A 100 -14.380 7.246 7.572 1.00 21.33 H new ATOM 0 HZ2 LYS A 100 -15.117 6.114 6.541 1.00 21.33 H new ATOM 0 HZ3 LYS A 100 -13.953 5.605 7.668 1.00 21.33 H new ATOM 1646 N LYS A 101 -14.118 0.324 5.965 1.00 10.14 N ATOM 1647 CA LYS A 101 -15.074 -0.312 6.910 1.00 51.10 C ATOM 1648 C LYS A 101 -14.426 -1.509 7.637 1.00 45.12 C ATOM 1649 O LYS A 101 -14.895 -1.920 8.699 1.00 13.22 O ATOM 1650 CB LYS A 101 -16.362 -0.781 6.178 1.00 24.31 C ATOM 1651 CG LYS A 101 -16.129 -1.861 5.108 1.00 55.24 C ATOM 1652 CD LYS A 101 -17.426 -2.411 4.483 1.00 11.34 C ATOM 1653 CE LYS A 101 -18.251 -3.257 5.466 1.00 13.14 C ATOM 1654 NZ LYS A 101 -19.396 -3.918 4.791 1.00 23.41 N ATOM 0 H LYS A 101 -14.348 0.170 4.983 1.00 10.14 H new ATOM 0 HA LYS A 101 -15.346 0.443 7.648 1.00 51.10 H new ATOM 0 HB2 LYS A 101 -17.065 -1.165 6.917 1.00 24.31 H new ATOM 0 HB3 LYS A 101 -16.833 0.083 5.708 1.00 24.31 H new ATOM 0 HG2 LYS A 101 -15.504 -1.446 4.317 1.00 55.24 H new ATOM 0 HG3 LYS A 101 -15.574 -2.686 5.554 1.00 55.24 H new ATOM 0 HD2 LYS A 101 -18.034 -1.579 4.129 1.00 11.34 H new ATOM 0 HD3 LYS A 101 -17.175 -3.016 3.612 1.00 11.34 H new ATOM 0 HE2 LYS A 101 -17.611 -4.013 5.922 1.00 13.14 H new ATOM 0 HE3 LYS A 101 -18.620 -2.623 6.272 1.00 13.14 H new ATOM 0 HZ1 LYS A 101 -19.930 -4.480 5.484 1.00 23.41 H new ATOM 0 HZ2 LYS A 101 -20.019 -3.196 4.377 1.00 23.41 H new ATOM 0 HZ3 LYS A 101 -19.042 -4.542 4.038 1.00 23.41 H new ATOM 1668 N LYS A 102 -13.361 -2.071 7.035 1.00 61.15 N ATOM 1669 CA LYS A 102 -12.558 -3.155 7.637 1.00 0.12 C ATOM 1670 C LYS A 102 -11.519 -2.590 8.638 1.00 4.22 C ATOM 1671 O LYS A 102 -10.882 -3.351 9.371 1.00 45.31 O ATOM 1672 CB LYS A 102 -11.846 -3.960 6.523 1.00 53.21 C ATOM 1673 CG LYS A 102 -12.781 -4.710 5.549 1.00 13.02 C ATOM 1674 CD LYS A 102 -11.999 -5.378 4.388 1.00 33.13 C ATOM 1675 CE LYS A 102 -12.889 -6.249 3.485 1.00 52.25 C ATOM 1676 NZ LYS A 102 -14.042 -5.500 2.916 1.00 61.01 N ATOM 0 H LYS A 102 -13.031 -1.785 6.113 1.00 61.15 H new ATOM 0 HA LYS A 102 -13.228 -3.816 8.187 1.00 0.12 H new ATOM 0 HB2 LYS A 102 -11.221 -3.277 5.947 1.00 53.21 H new ATOM 0 HB3 LYS A 102 -11.179 -4.684 6.991 1.00 53.21 H new ATOM 0 HG2 LYS A 102 -13.338 -5.471 6.095 1.00 13.02 H new ATOM 0 HG3 LYS A 102 -13.512 -4.013 5.139 1.00 13.02 H new ATOM 0 HD2 LYS A 102 -11.526 -4.604 3.784 1.00 33.13 H new ATOM 0 HD3 LYS A 102 -11.200 -5.993 4.802 1.00 33.13 H new ATOM 0 HE2 LYS A 102 -12.287 -6.654 2.671 1.00 52.25 H new ATOM 0 HE3 LYS A 102 -13.261 -7.098 4.059 1.00 52.25 H new ATOM 0 HZ1 LYS A 102 -14.220 -5.822 1.943 1.00 61.01 H new ATOM 0 HZ2 LYS A 102 -14.888 -5.671 3.497 1.00 61.01 H new ATOM 0 HZ3 LYS A 102 -13.826 -4.483 2.909 1.00 61.01 H new ATOM 1690 N GLY A 103 -11.355 -1.250 8.638 1.00 50.22 N ATOM 1691 CA GLY A 103 -10.463 -0.560 9.577 1.00 42.21 C ATOM 1692 C GLY A 103 -9.088 -0.258 8.998 1.00 4.13 C ATOM 1693 O GLY A 103 -8.101 -0.196 9.737 1.00 71.01 O ATOM 0 H GLY A 103 -11.836 -0.626 7.990 1.00 50.22 H new ATOM 0 HA2 GLY A 103 -10.930 0.374 9.890 1.00 42.21 H new ATOM 0 HA3 GLY A 103 -10.346 -1.173 10.471 1.00 42.21 H new ATOM 1697 N TYR A 104 -9.019 -0.073 7.666 1.00 71.12 N ATOM 1698 CA TYR A 104 -7.765 0.265 6.959 1.00 61.20 C ATOM 1699 C TYR A 104 -7.793 1.751 6.576 1.00 43.04 C ATOM 1700 O TYR A 104 -8.844 2.250 6.149 1.00 40.20 O ATOM 1701 CB TYR A 104 -7.602 -0.622 5.686 1.00 5.24 C ATOM 1702 CG TYR A 104 -7.780 -2.137 5.932 1.00 71.20 C ATOM 1703 CD1 TYR A 104 -7.320 -2.746 7.100 1.00 72.02 C ATOM 1704 CD2 TYR A 104 -8.440 -2.951 5.007 1.00 21.22 C ATOM 1705 CE1 TYR A 104 -7.511 -4.088 7.329 1.00 14.01 C ATOM 1706 CE2 TYR A 104 -8.638 -4.290 5.245 1.00 40.13 C ATOM 1707 CZ TYR A 104 -8.169 -4.850 6.404 1.00 32.13 C ATOM 1708 OH TYR A 104 -8.384 -6.178 6.645 1.00 41.43 O ATOM 0 H TYR A 104 -9.828 -0.153 7.049 1.00 71.12 H new ATOM 0 HA TYR A 104 -6.915 0.074 7.614 1.00 61.20 H new ATOM 0 HB2 TYR A 104 -8.328 -0.300 4.939 1.00 5.24 H new ATOM 0 HB3 TYR A 104 -6.612 -0.450 5.263 1.00 5.24 H new ATOM 0 HD1 TYR A 104 -6.804 -2.151 7.839 1.00 72.02 H new ATOM 0 HD2 TYR A 104 -8.802 -2.519 4.086 1.00 21.22 H new ATOM 0 HE1 TYR A 104 -7.142 -4.540 8.238 1.00 14.01 H new ATOM 0 HE2 TYR A 104 -9.161 -4.898 4.522 1.00 40.13 H new ATOM 0 HH TYR A 104 -8.866 -6.574 5.889 1.00 41.43 H new ATOM 1718 N ASP A 105 -6.651 2.456 6.742 1.00 42.13 N ATOM 1719 CA ASP A 105 -6.527 3.871 6.339 1.00 24.54 C ATOM 1720 C ASP A 105 -6.384 3.925 4.814 1.00 25.15 C ATOM 1721 O ASP A 105 -5.296 3.678 4.284 1.00 4.32 O ATOM 1722 CB ASP A 105 -5.295 4.551 7.005 1.00 53.22 C ATOM 1723 CG ASP A 105 -5.227 4.354 8.529 1.00 21.35 C ATOM 1724 OD1 ASP A 105 -6.001 5.000 9.265 1.00 34.24 O ATOM 1725 OD2 ASP A 105 -4.414 3.528 9.003 1.00 72.42 O ATOM 0 H ASP A 105 -5.803 2.066 7.153 1.00 42.13 H new ATOM 0 HA ASP A 105 -7.416 4.411 6.666 1.00 24.54 H new ATOM 0 HB2 ASP A 105 -4.385 4.154 6.555 1.00 53.22 H new ATOM 0 HB3 ASP A 105 -5.318 5.619 6.786 1.00 53.22 H new ATOM 1730 N VAL A 106 -7.478 4.240 4.101 1.00 51.32 N ATOM 1731 CA VAL A 106 -7.484 4.216 2.631 1.00 14.42 C ATOM 1732 C VAL A 106 -7.346 5.643 2.081 1.00 22.33 C ATOM 1733 O VAL A 106 -7.937 6.585 2.613 1.00 24.40 O ATOM 1734 CB VAL A 106 -8.766 3.519 2.037 1.00 75.01 C ATOM 1735 CG1 VAL A 106 -8.598 3.248 0.514 1.00 22.23 C ATOM 1736 CG2 VAL A 106 -9.087 2.220 2.800 1.00 34.31 C ATOM 0 H VAL A 106 -8.367 4.514 4.519 1.00 51.32 H new ATOM 0 HA VAL A 106 -6.629 3.618 2.317 1.00 14.42 H new ATOM 0 HB VAL A 106 -9.609 4.199 2.163 1.00 75.01 H new ATOM 0 HG11 VAL A 106 -9.497 2.766 0.129 1.00 22.23 H new ATOM 0 HG12 VAL A 106 -8.440 4.192 -0.008 1.00 22.23 H new ATOM 0 HG13 VAL A 106 -7.740 2.596 0.353 1.00 22.23 H new ATOM 0 HG21 VAL A 106 -9.976 1.757 2.372 1.00 34.31 H new ATOM 0 HG22 VAL A 106 -8.245 1.533 2.719 1.00 34.31 H new ATOM 0 HG23 VAL A 106 -9.268 2.450 3.850 1.00 34.31 H new ATOM 1746 N TYR A 107 -6.543 5.779 1.020 1.00 63.40 N ATOM 1747 CA TYR A 107 -6.246 7.045 0.352 1.00 72.33 C ATOM 1748 C TYR A 107 -6.542 6.858 -1.140 1.00 61.33 C ATOM 1749 O TYR A 107 -6.112 5.863 -1.736 1.00 65.32 O ATOM 1750 CB TYR A 107 -4.756 7.416 0.569 1.00 3.10 C ATOM 1751 CG TYR A 107 -4.337 7.557 2.051 1.00 40.04 C ATOM 1752 CD1 TYR A 107 -4.461 8.773 2.730 1.00 54.04 C ATOM 1753 CD2 TYR A 107 -3.818 6.476 2.769 1.00 14.33 C ATOM 1754 CE1 TYR A 107 -4.088 8.899 4.057 1.00 64.41 C ATOM 1755 CE2 TYR A 107 -3.447 6.604 4.096 1.00 22.11 C ATOM 1756 CZ TYR A 107 -3.579 7.812 4.733 1.00 35.42 C ATOM 1757 OH TYR A 107 -3.201 7.931 6.052 1.00 42.50 O ATOM 0 H TYR A 107 -6.068 4.984 0.591 1.00 63.40 H new ATOM 0 HA TYR A 107 -6.855 7.853 0.758 1.00 72.33 H new ATOM 0 HB2 TYR A 107 -4.133 6.654 0.100 1.00 3.10 H new ATOM 0 HB3 TYR A 107 -4.551 8.356 0.056 1.00 3.10 H new ATOM 0 HD1 TYR A 107 -4.856 9.632 2.208 1.00 54.04 H new ATOM 0 HD2 TYR A 107 -3.704 5.521 2.278 1.00 14.33 H new ATOM 0 HE1 TYR A 107 -4.196 9.848 4.561 1.00 64.41 H new ATOM 0 HE2 TYR A 107 -3.053 5.752 4.631 1.00 22.11 H new ATOM 0 HH TYR A 107 -3.829 7.436 6.618 1.00 42.50 H new ATOM 1767 N THR A 108 -7.278 7.801 -1.735 1.00 61.23 N ATOM 1768 CA THR A 108 -7.665 7.737 -3.150 1.00 54.42 C ATOM 1769 C THR A 108 -6.853 8.760 -3.951 1.00 34.32 C ATOM 1770 O THR A 108 -6.668 9.903 -3.512 1.00 52.01 O ATOM 1771 CB THR A 108 -9.198 8.006 -3.333 1.00 71.20 C ATOM 1772 OG1 THR A 108 -9.564 9.242 -2.690 1.00 2.02 O ATOM 1773 CG2 THR A 108 -10.046 6.859 -2.757 1.00 21.33 C ATOM 0 H THR A 108 -7.623 8.630 -1.251 1.00 61.23 H new ATOM 0 HA THR A 108 -7.455 6.733 -3.519 1.00 54.42 H new ATOM 0 HB THR A 108 -9.395 8.074 -4.403 1.00 71.20 H new ATOM 0 HG1 THR A 108 -10.523 9.402 -2.811 1.00 2.02 H new ATOM 0 HG21 THR A 108 -11.103 7.080 -2.902 1.00 21.33 H new ATOM 0 HG22 THR A 108 -9.796 5.929 -3.269 1.00 21.33 H new ATOM 0 HG23 THR A 108 -9.840 6.754 -1.692 1.00 21.33 H new ATOM 1781 N SER A 109 -6.372 8.329 -5.119 1.00 14.43 N ATOM 1782 CA SER A 109 -5.532 9.137 -6.001 1.00 45.15 C ATOM 1783 C SER A 109 -5.870 8.814 -7.452 1.00 75.44 C ATOM 1784 O SER A 109 -6.083 7.652 -7.790 1.00 12.50 O ATOM 1785 CB SER A 109 -4.041 8.860 -5.705 1.00 31.34 C ATOM 1786 OG SER A 109 -3.744 7.481 -5.682 1.00 24.41 O ATOM 0 H SER A 109 -6.559 7.395 -5.483 1.00 14.43 H new ATOM 0 HA SER A 109 -5.721 10.196 -5.825 1.00 45.15 H new ATOM 0 HB2 SER A 109 -3.427 9.349 -6.461 1.00 31.34 H new ATOM 0 HB3 SER A 109 -3.776 9.302 -4.745 1.00 31.34 H new ATOM 0 HG SER A 109 -4.569 6.971 -5.544 1.00 24.41 H new ATOM 1792 N ARG A 110 -5.948 9.845 -8.302 1.00 1.32 N ATOM 1793 CA ARG A 110 -6.204 9.654 -9.736 1.00 11.04 C ATOM 1794 C ARG A 110 -4.898 9.252 -10.438 1.00 42.45 C ATOM 1795 O ARG A 110 -4.916 8.433 -11.367 1.00 11.03 O ATOM 1796 CB ARG A 110 -6.816 10.919 -10.412 1.00 14.50 C ATOM 1797 CG ARG A 110 -8.260 11.302 -9.968 1.00 24.41 C ATOM 1798 CD ARG A 110 -8.341 11.879 -8.540 1.00 53.33 C ATOM 1799 NE ARG A 110 -9.721 12.249 -8.163 1.00 22.44 N ATOM 1800 CZ ARG A 110 -10.059 13.221 -7.294 1.00 22.15 C ATOM 1801 NH1 ARG A 110 -9.128 13.944 -6.690 1.00 41.24 N ATOM 1802 NH2 ARG A 110 -11.331 13.455 -7.032 1.00 42.20 N ATOM 0 H ARG A 110 -5.838 10.820 -8.022 1.00 1.32 H new ATOM 0 HA ARG A 110 -6.943 8.859 -9.836 1.00 11.04 H new ATOM 0 HB2 ARG A 110 -6.160 11.766 -10.213 1.00 14.50 H new ATOM 0 HB3 ARG A 110 -6.818 10.764 -11.491 1.00 14.50 H new ATOM 0 HG2 ARG A 110 -8.663 12.033 -10.668 1.00 24.41 H new ATOM 0 HG3 ARG A 110 -8.895 10.418 -10.029 1.00 24.41 H new ATOM 0 HD2 ARG A 110 -7.957 11.145 -7.831 1.00 53.33 H new ATOM 0 HD3 ARG A 110 -7.699 12.757 -8.468 1.00 53.33 H new ATOM 0 HE ARG A 110 -10.481 11.725 -8.597 1.00 22.44 H new ATOM 0 HH11 ARG A 110 -8.142 13.768 -6.881 1.00 41.24 H new ATOM 0 HH12 ARG A 110 -9.397 14.677 -6.034 1.00 41.24 H new ATOM 0 HH21 ARG A 110 -12.056 12.900 -7.487 1.00 42.20 H new ATOM 0 HH22 ARG A 110 -11.589 14.191 -6.374 1.00 42.20 H new ATOM 1816 N ASN A 111 -3.756 9.809 -9.969 1.00 34.44 N ATOM 1817 CA ASN A 111 -2.447 9.585 -10.630 1.00 73.35 C ATOM 1818 C ASN A 111 -1.282 9.709 -9.637 1.00 45.14 C ATOM 1819 O ASN A 111 -1.507 9.829 -8.422 1.00 12.31 O ATOM 1820 CB ASN A 111 -2.284 10.532 -11.866 1.00 12.15 C ATOM 1821 CG ASN A 111 -2.412 12.050 -11.603 1.00 32.31 C ATOM 1822 OD1 ASN A 111 -2.983 12.775 -12.415 1.00 4.42 O ATOM 1823 ND2 ASN A 111 -1.849 12.562 -10.518 1.00 43.50 N ATOM 0 H ASN A 111 -3.713 10.410 -9.146 1.00 34.44 H new ATOM 0 HA ASN A 111 -2.423 8.560 -11.001 1.00 73.35 H new ATOM 0 HB2 ASN A 111 -1.306 10.345 -12.310 1.00 12.15 H new ATOM 0 HB3 ASN A 111 -3.030 10.252 -12.609 1.00 12.15 H new ATOM 0 HD21 ASN A 111 -1.887 13.567 -10.350 1.00 43.50 H new ATOM 0 HD22 ASN A 111 -1.378 11.951 -9.851 1.00 43.50 H new ATOM 1830 N GLU A 112 -0.040 9.697 -10.187 1.00 32.55 N ATOM 1831 CA GLU A 112 1.212 9.740 -9.414 1.00 63.24 C ATOM 1832 C GLU A 112 1.244 10.933 -8.441 1.00 2.31 C ATOM 1833 O GLU A 112 1.611 10.751 -7.289 1.00 51.14 O ATOM 1834 CB GLU A 112 2.438 9.826 -10.367 1.00 54.04 C ATOM 1835 CG GLU A 112 3.817 9.944 -9.652 1.00 52.11 C ATOM 1836 CD GLU A 112 4.913 10.626 -10.497 1.00 21.53 C ATOM 1837 OE1 GLU A 112 4.581 11.501 -11.322 1.00 40.25 O ATOM 1838 OE2 GLU A 112 6.110 10.350 -10.285 1.00 32.42 O ATOM 0 H GLU A 112 0.113 9.657 -11.195 1.00 32.55 H new ATOM 0 HA GLU A 112 1.260 8.819 -8.832 1.00 63.24 H new ATOM 0 HB2 GLU A 112 2.449 8.940 -11.002 1.00 54.04 H new ATOM 0 HB3 GLU A 112 2.310 10.687 -11.023 1.00 54.04 H new ATOM 0 HG2 GLU A 112 3.687 10.505 -8.726 1.00 52.11 H new ATOM 0 HG3 GLU A 112 4.156 8.946 -9.375 1.00 52.11 H new ATOM 1845 N ASP A 113 0.837 12.131 -8.923 1.00 34.14 N ATOM 1846 CA ASP A 113 0.916 13.395 -8.143 1.00 74.31 C ATOM 1847 C ASP A 113 0.203 13.286 -6.783 1.00 25.35 C ATOM 1848 O ASP A 113 0.769 13.666 -5.741 1.00 52.35 O ATOM 1849 CB ASP A 113 0.316 14.577 -8.944 1.00 71.44 C ATOM 1850 CG ASP A 113 1.026 14.817 -10.284 1.00 21.53 C ATOM 1851 OD1 ASP A 113 0.666 14.157 -11.284 1.00 2.33 O ATOM 1852 OD2 ASP A 113 1.965 15.644 -10.343 1.00 13.34 O ATOM 0 H ASP A 113 0.446 12.251 -9.858 1.00 34.14 H new ATOM 0 HA ASP A 113 1.974 13.579 -7.958 1.00 74.31 H new ATOM 0 HB2 ASP A 113 -0.741 14.384 -9.129 1.00 71.44 H new ATOM 0 HB3 ASP A 113 0.374 15.483 -8.341 1.00 71.44 H new ATOM 1857 N GLU A 114 -1.032 12.754 -6.801 1.00 44.45 N ATOM 1858 CA GLU A 114 -1.829 12.564 -5.576 1.00 41.55 C ATOM 1859 C GLU A 114 -1.215 11.484 -4.686 1.00 1.43 C ATOM 1860 O GLU A 114 -0.987 11.704 -3.492 1.00 73.32 O ATOM 1861 CB GLU A 114 -3.286 12.198 -5.912 1.00 74.23 C ATOM 1862 CG GLU A 114 -4.088 13.309 -6.595 1.00 62.34 C ATOM 1863 CD GLU A 114 -3.841 13.402 -8.105 1.00 20.14 C ATOM 1864 OE1 GLU A 114 -4.343 12.525 -8.834 1.00 13.14 O ATOM 1865 OE2 GLU A 114 -3.150 14.334 -8.561 1.00 23.20 O ATOM 0 H GLU A 114 -1.501 12.447 -7.653 1.00 44.45 H new ATOM 0 HA GLU A 114 -1.824 13.510 -5.034 1.00 41.55 H new ATOM 0 HB2 GLU A 114 -3.285 11.320 -6.558 1.00 74.23 H new ATOM 0 HB3 GLU A 114 -3.796 11.915 -4.991 1.00 74.23 H new ATOM 0 HG2 GLU A 114 -5.150 13.140 -6.418 1.00 62.34 H new ATOM 0 HG3 GLU A 114 -3.836 14.264 -6.134 1.00 62.34 H new ATOM 1872 N ALA A 115 -0.907 10.341 -5.314 1.00 63.22 N ATOM 1873 CA ALA A 115 -0.374 9.149 -4.637 1.00 4.35 C ATOM 1874 C ALA A 115 0.976 9.428 -3.960 1.00 10.43 C ATOM 1875 O ALA A 115 1.288 8.852 -2.926 1.00 2.23 O ATOM 1876 CB ALA A 115 -0.236 8.008 -5.646 1.00 52.32 C ATOM 0 H ALA A 115 -1.022 10.216 -6.320 1.00 63.22 H new ATOM 0 HA ALA A 115 -1.075 8.865 -3.852 1.00 4.35 H new ATOM 0 HB1 ALA A 115 0.159 7.125 -5.144 1.00 52.32 H new ATOM 0 HB2 ALA A 115 -1.213 7.778 -6.071 1.00 52.32 H new ATOM 0 HB3 ALA A 115 0.445 8.307 -6.443 1.00 52.32 H new ATOM 1882 N LYS A 116 1.746 10.343 -4.568 1.00 12.23 N ATOM 1883 CA LYS A 116 3.090 10.748 -4.113 1.00 65.23 C ATOM 1884 C LYS A 116 3.012 11.451 -2.752 1.00 62.32 C ATOM 1885 O LYS A 116 3.883 11.266 -1.880 1.00 45.32 O ATOM 1886 CB LYS A 116 3.708 11.677 -5.193 1.00 31.14 C ATOM 1887 CG LYS A 116 5.074 12.304 -4.854 1.00 22.34 C ATOM 1888 CD LYS A 116 5.724 12.991 -6.079 1.00 31.21 C ATOM 1889 CE LYS A 116 6.085 11.992 -7.197 1.00 55.34 C ATOM 1890 NZ LYS A 116 6.704 12.660 -8.372 1.00 23.14 N ATOM 0 H LYS A 116 1.447 10.835 -5.410 1.00 12.23 H new ATOM 0 HA LYS A 116 3.723 9.870 -3.982 1.00 65.23 H new ATOM 0 HB2 LYS A 116 3.813 11.106 -6.116 1.00 31.14 H new ATOM 0 HB3 LYS A 116 3.002 12.483 -5.395 1.00 31.14 H new ATOM 0 HG2 LYS A 116 4.948 13.034 -4.055 1.00 22.34 H new ATOM 0 HG3 LYS A 116 5.743 11.531 -4.476 1.00 22.34 H new ATOM 0 HD2 LYS A 116 5.040 13.742 -6.475 1.00 31.21 H new ATOM 0 HD3 LYS A 116 6.625 13.516 -5.761 1.00 31.21 H new ATOM 0 HE2 LYS A 116 6.772 11.243 -6.804 1.00 55.34 H new ATOM 0 HE3 LYS A 116 5.186 11.464 -7.514 1.00 55.34 H new ATOM 0 HZ1 LYS A 116 6.697 12.011 -9.184 1.00 23.14 H new ATOM 0 HZ2 LYS A 116 6.164 13.517 -8.609 1.00 23.14 H new ATOM 0 HZ3 LYS A 116 7.685 12.921 -8.146 1.00 23.14 H new ATOM 1904 N LYS A 117 1.944 12.246 -2.587 1.00 10.42 N ATOM 1905 CA LYS A 117 1.676 12.971 -1.344 1.00 20.43 C ATOM 1906 C LYS A 117 1.144 11.995 -0.282 1.00 62.01 C ATOM 1907 O LYS A 117 1.712 11.889 0.805 1.00 62.03 O ATOM 1908 CB LYS A 117 0.687 14.136 -1.618 1.00 64.55 C ATOM 1909 CG LYS A 117 1.229 15.163 -2.646 1.00 53.20 C ATOM 1910 CD LYS A 117 0.245 16.309 -2.971 1.00 31.20 C ATOM 1911 CE LYS A 117 -1.040 15.827 -3.659 1.00 63.22 C ATOM 1912 NZ LYS A 117 -1.941 16.959 -4.008 1.00 2.14 N ATOM 0 H LYS A 117 1.245 12.402 -3.313 1.00 10.42 H new ATOM 0 HA LYS A 117 2.597 13.408 -0.958 1.00 20.43 H new ATOM 0 HB2 LYS A 117 -0.255 13.727 -1.984 1.00 64.55 H new ATOM 0 HB3 LYS A 117 0.470 14.649 -0.681 1.00 64.55 H new ATOM 0 HG2 LYS A 117 2.155 15.591 -2.262 1.00 53.20 H new ATOM 0 HG3 LYS A 117 1.479 14.640 -3.569 1.00 53.20 H new ATOM 0 HD2 LYS A 117 -0.017 16.827 -2.048 1.00 31.20 H new ATOM 0 HD3 LYS A 117 0.743 17.035 -3.614 1.00 31.20 H new ATOM 0 HE2 LYS A 117 -0.783 15.276 -4.563 1.00 63.22 H new ATOM 0 HE3 LYS A 117 -1.566 15.134 -3.002 1.00 63.22 H new ATOM 0 HZ1 LYS A 117 -2.797 16.592 -4.470 1.00 2.14 H new ATOM 0 HZ2 LYS A 117 -2.207 17.470 -3.142 1.00 2.14 H new ATOM 0 HZ3 LYS A 117 -1.449 17.607 -4.655 1.00 2.14 H new ATOM 1926 N LYS A 118 0.109 11.223 -0.662 1.00 2.42 N ATOM 1927 CA LYS A 118 -0.612 10.300 0.245 1.00 72.42 C ATOM 1928 C LYS A 118 0.309 9.182 0.794 1.00 31.24 C ATOM 1929 O LYS A 118 0.120 8.710 1.925 1.00 21.24 O ATOM 1930 CB LYS A 118 -1.823 9.675 -0.510 1.00 20.24 C ATOM 1931 CG LYS A 118 -2.863 10.689 -1.094 1.00 55.13 C ATOM 1932 CD LYS A 118 -4.009 11.110 -0.119 1.00 62.30 C ATOM 1933 CE LYS A 118 -3.556 11.943 1.102 1.00 52.44 C ATOM 1934 NZ LYS A 118 -2.976 13.253 0.719 1.00 51.43 N ATOM 0 H LYS A 118 -0.256 11.220 -1.614 1.00 2.42 H new ATOM 0 HA LYS A 118 -0.963 10.876 1.101 1.00 72.42 H new ATOM 0 HB2 LYS A 118 -1.440 9.065 -1.328 1.00 20.24 H new ATOM 0 HB3 LYS A 118 -2.344 9.003 0.172 1.00 20.24 H new ATOM 0 HG2 LYS A 118 -2.331 11.586 -1.412 1.00 55.13 H new ATOM 0 HG3 LYS A 118 -3.311 10.251 -1.986 1.00 55.13 H new ATOM 0 HD2 LYS A 118 -4.748 11.684 -0.678 1.00 62.30 H new ATOM 0 HD3 LYS A 118 -4.509 10.210 0.239 1.00 62.30 H new ATOM 0 HE2 LYS A 118 -4.409 12.107 1.761 1.00 52.44 H new ATOM 0 HE3 LYS A 118 -2.818 11.376 1.670 1.00 52.44 H new ATOM 0 HZ1 LYS A 118 -1.975 13.284 0.998 1.00 51.43 H new ATOM 0 HZ2 LYS A 118 -3.053 13.379 -0.310 1.00 51.43 H new ATOM 0 HZ3 LYS A 118 -3.493 14.016 1.201 1.00 51.43 H new ATOM 1948 N LEU A 119 1.302 8.783 -0.027 1.00 12.24 N ATOM 1949 CA LEU A 119 2.258 7.712 0.303 1.00 73.22 C ATOM 1950 C LEU A 119 3.216 8.165 1.401 1.00 34.32 C ATOM 1951 O LEU A 119 3.388 7.470 2.412 1.00 73.23 O ATOM 1952 CB LEU A 119 3.039 7.282 -0.965 1.00 61.02 C ATOM 1953 CG LEU A 119 4.059 6.113 -0.803 1.00 24.25 C ATOM 1954 CD1 LEU A 119 3.389 4.847 -0.221 1.00 52.13 C ATOM 1955 CD2 LEU A 119 4.748 5.811 -2.150 1.00 13.31 C ATOM 0 H LEU A 119 1.462 9.200 -0.944 1.00 12.24 H new ATOM 0 HA LEU A 119 1.702 6.852 0.675 1.00 73.22 H new ATOM 0 HB2 LEU A 119 2.315 6.997 -1.729 1.00 61.02 H new ATOM 0 HB3 LEU A 119 3.577 8.151 -1.343 1.00 61.02 H new ATOM 0 HG LEU A 119 4.820 6.428 -0.089 1.00 24.25 H new ATOM 0 HD11 LEU A 119 4.131 4.055 -0.123 1.00 52.13 H new ATOM 0 HD12 LEU A 119 2.970 5.075 0.759 1.00 52.13 H new ATOM 0 HD13 LEU A 119 2.593 4.517 -0.888 1.00 52.13 H new ATOM 0 HD21 LEU A 119 5.457 4.993 -2.021 1.00 13.31 H new ATOM 0 HD22 LEU A 119 3.997 5.527 -2.887 1.00 13.31 H new ATOM 0 HD23 LEU A 119 5.278 6.699 -2.495 1.00 13.31 H new ATOM 1967 N LYS A 120 3.817 9.353 1.201 1.00 54.03 N ATOM 1968 CA LYS A 120 4.770 9.924 2.170 1.00 21.51 C ATOM 1969 C LYS A 120 4.063 10.311 3.480 1.00 53.12 C ATOM 1970 O LYS A 120 4.653 10.196 4.547 1.00 64.31 O ATOM 1971 CB LYS A 120 5.549 11.127 1.578 1.00 13.13 C ATOM 1972 CG LYS A 120 6.609 10.730 0.516 1.00 1.53 C ATOM 1973 CD LYS A 120 7.636 11.857 0.236 1.00 44.33 C ATOM 1974 CE LYS A 120 7.010 13.109 -0.383 1.00 15.42 C ATOM 1975 NZ LYS A 120 6.452 12.832 -1.724 1.00 1.32 N ATOM 0 H LYS A 120 3.659 9.935 0.378 1.00 54.03 H new ATOM 0 HA LYS A 120 5.502 9.148 2.397 1.00 21.51 H new ATOM 0 HB2 LYS A 120 4.839 11.820 1.127 1.00 13.13 H new ATOM 0 HB3 LYS A 120 6.044 11.661 2.389 1.00 13.13 H new ATOM 0 HG2 LYS A 120 7.138 9.839 0.854 1.00 1.53 H new ATOM 0 HG3 LYS A 120 6.104 10.467 -0.413 1.00 1.53 H new ATOM 0 HD2 LYS A 120 8.129 12.130 1.169 1.00 44.33 H new ATOM 0 HD3 LYS A 120 8.408 11.477 -0.433 1.00 44.33 H new ATOM 0 HE2 LYS A 120 6.221 13.483 0.270 1.00 15.42 H new ATOM 0 HE3 LYS A 120 7.762 13.894 -0.456 1.00 15.42 H new ATOM 0 HZ1 LYS A 120 6.838 13.513 -2.408 1.00 1.32 H new ATOM 0 HZ2 LYS A 120 6.709 11.867 -2.014 1.00 1.32 H new ATOM 0 HZ3 LYS A 120 5.416 12.921 -1.694 1.00 1.32 H new ATOM 1989 N GLU A 121 2.789 10.729 3.378 1.00 72.11 N ATOM 1990 CA GLU A 121 1.936 11.044 4.547 1.00 23.33 C ATOM 1991 C GLU A 121 1.676 9.791 5.410 1.00 4.22 C ATOM 1992 O GLU A 121 1.677 9.861 6.648 1.00 60.54 O ATOM 1993 CB GLU A 121 0.604 11.685 4.073 1.00 71.13 C ATOM 1994 CG GLU A 121 0.761 13.133 3.559 1.00 73.31 C ATOM 1995 CD GLU A 121 -0.522 13.716 2.946 1.00 65.24 C ATOM 1996 OE1 GLU A 121 -1.553 13.776 3.653 1.00 42.23 O ATOM 1997 OE2 GLU A 121 -0.517 14.097 1.756 1.00 75.42 O ATOM 0 H GLU A 121 2.317 10.859 2.483 1.00 72.11 H new ATOM 0 HA GLU A 121 2.464 11.761 5.175 1.00 23.33 H new ATOM 0 HB2 GLU A 121 0.178 11.071 3.279 1.00 71.13 H new ATOM 0 HB3 GLU A 121 -0.107 11.677 4.899 1.00 71.13 H new ATOM 0 HG2 GLU A 121 1.080 13.769 4.385 1.00 73.31 H new ATOM 0 HG3 GLU A 121 1.554 13.159 2.812 1.00 73.31 H new ATOM 2004 N ALA A 122 1.473 8.651 4.737 1.00 1.01 N ATOM 2005 CA ALA A 122 1.295 7.339 5.386 1.00 23.11 C ATOM 2006 C ALA A 122 2.613 6.845 6.020 1.00 32.15 C ATOM 2007 O ALA A 122 2.587 6.134 7.030 1.00 51.01 O ATOM 2008 CB ALA A 122 0.762 6.336 4.360 1.00 50.35 C ATOM 0 H ALA A 122 1.427 8.610 3.719 1.00 1.01 H new ATOM 0 HA ALA A 122 0.571 7.438 6.195 1.00 23.11 H new ATOM 0 HB1 ALA A 122 0.629 5.364 4.836 1.00 50.35 H new ATOM 0 HB2 ALA A 122 -0.196 6.685 3.974 1.00 50.35 H new ATOM 0 HB3 ALA A 122 1.473 6.243 3.539 1.00 50.35 H new ATOM 2014 N LEU A 123 3.754 7.233 5.412 1.00 73.12 N ATOM 2015 CA LEU A 123 5.103 6.960 5.959 1.00 30.14 C ATOM 2016 C LEU A 123 5.380 7.846 7.205 1.00 63.33 C ATOM 2017 O LEU A 123 6.041 7.407 8.149 1.00 21.34 O ATOM 2018 CB LEU A 123 6.199 7.205 4.873 1.00 41.25 C ATOM 2019 CG LEU A 123 6.191 6.250 3.626 1.00 25.50 C ATOM 2020 CD1 LEU A 123 7.144 6.754 2.514 1.00 14.33 C ATOM 2021 CD2 LEU A 123 6.535 4.797 4.020 1.00 13.21 C ATOM 0 H LEU A 123 3.768 7.744 4.529 1.00 73.12 H new ATOM 0 HA LEU A 123 5.139 5.913 6.261 1.00 30.14 H new ATOM 0 HB2 LEU A 123 6.099 8.230 4.516 1.00 41.25 H new ATOM 0 HB3 LEU A 123 7.175 7.128 5.353 1.00 41.25 H new ATOM 0 HG LEU A 123 5.176 6.259 3.228 1.00 25.50 H new ATOM 0 HD11 LEU A 123 7.111 6.067 1.668 1.00 14.33 H new ATOM 0 HD12 LEU A 123 6.831 7.746 2.189 1.00 14.33 H new ATOM 0 HD13 LEU A 123 8.161 6.804 2.902 1.00 14.33 H new ATOM 0 HD21 LEU A 123 6.520 4.166 3.132 1.00 13.21 H new ATOM 0 HD22 LEU A 123 7.528 4.767 4.469 1.00 13.21 H new ATOM 0 HD23 LEU A 123 5.801 4.431 4.738 1.00 13.21 H new ATOM 2033 N GLU A 124 4.853 9.091 7.200 1.00 41.11 N ATOM 2034 CA GLU A 124 5.088 10.083 8.281 1.00 54.33 C ATOM 2035 C GLU A 124 4.379 9.686 9.583 1.00 50.44 C ATOM 2036 O GLU A 124 5.010 9.635 10.650 1.00 63.23 O ATOM 2037 CB GLU A 124 4.616 11.499 7.841 1.00 62.23 C ATOM 2038 CG GLU A 124 5.516 12.169 6.794 1.00 20.11 C ATOM 2039 CD GLU A 124 4.983 13.538 6.347 1.00 44.44 C ATOM 2040 OE1 GLU A 124 5.264 14.543 7.034 1.00 54.22 O ATOM 2041 OE2 GLU A 124 4.270 13.609 5.322 1.00 12.44 O ATOM 0 H GLU A 124 4.254 9.438 6.451 1.00 41.11 H new ATOM 0 HA GLU A 124 6.161 10.102 8.469 1.00 54.33 H new ATOM 0 HB2 GLU A 124 3.606 11.424 7.439 1.00 62.23 H new ATOM 0 HB3 GLU A 124 4.562 12.141 8.721 1.00 62.23 H new ATOM 0 HG2 GLU A 124 6.518 12.290 7.206 1.00 20.11 H new ATOM 0 HG3 GLU A 124 5.605 11.516 5.925 1.00 20.11 H new ATOM 2048 N LYS A 125 3.075 9.381 9.477 1.00 31.05 N ATOM 2049 CA LYS A 125 2.222 9.080 10.647 1.00 53.13 C ATOM 2050 C LYS A 125 2.591 7.735 11.300 1.00 4.24 C ATOM 2051 O LYS A 125 2.267 7.493 12.466 1.00 35.54 O ATOM 2052 CB LYS A 125 0.704 9.170 10.258 1.00 22.12 C ATOM 2053 CG LYS A 125 0.197 8.263 9.108 1.00 32.44 C ATOM 2054 CD LYS A 125 -0.019 6.789 9.515 1.00 60.04 C ATOM 2055 CE LYS A 125 -0.653 5.959 8.404 1.00 61.20 C ATOM 2056 NZ LYS A 125 -2.065 6.340 8.125 1.00 72.14 N ATOM 0 H LYS A 125 2.582 9.335 8.585 1.00 31.05 H new ATOM 0 HA LYS A 125 2.408 9.838 11.408 1.00 53.13 H new ATOM 0 HB2 LYS A 125 0.116 8.943 11.147 1.00 22.12 H new ATOM 0 HB3 LYS A 125 0.488 10.204 9.989 1.00 22.12 H new ATOM 0 HG2 LYS A 125 -0.743 8.666 8.730 1.00 32.44 H new ATOM 0 HG3 LYS A 125 0.913 8.301 8.287 1.00 32.44 H new ATOM 0 HD2 LYS A 125 0.939 6.348 9.791 1.00 60.04 H new ATOM 0 HD3 LYS A 125 -0.654 6.750 10.400 1.00 60.04 H new ATOM 0 HE2 LYS A 125 -0.065 6.073 7.493 1.00 61.20 H new ATOM 0 HE3 LYS A 125 -0.615 4.905 8.679 1.00 61.20 H new ATOM 0 HZ1 LYS A 125 -2.635 5.481 7.985 1.00 72.14 H new ATOM 0 HZ2 LYS A 125 -2.444 6.880 8.929 1.00 72.14 H new ATOM 0 HZ3 LYS A 125 -2.103 6.925 7.266 1.00 72.14 H new ATOM 2070 N SER A 126 3.263 6.866 10.528 1.00 30.42 N ATOM 2071 CA SER A 126 3.743 5.564 11.010 1.00 64.23 C ATOM 2072 C SER A 126 5.037 5.708 11.828 1.00 40.12 C ATOM 2073 O SER A 126 5.338 4.864 12.681 1.00 10.43 O ATOM 2074 CB SER A 126 3.959 4.626 9.812 1.00 23.55 C ATOM 2075 OG SER A 126 4.804 5.197 8.846 1.00 3.31 O ATOM 0 H SER A 126 3.488 7.048 9.550 1.00 30.42 H new ATOM 0 HA SER A 126 2.989 5.139 11.672 1.00 64.23 H new ATOM 0 HB2 SER A 126 4.388 3.686 10.159 1.00 23.55 H new ATOM 0 HB3 SER A 126 2.997 4.389 9.358 1.00 23.55 H new ATOM 0 HG SER A 126 5.143 6.056 9.174 1.00 3.31 H new ATOM 2081 N GLY A 127 5.806 6.768 11.542 1.00 52.14 N ATOM 2082 CA GLY A 127 7.044 7.058 12.264 1.00 32.34 C ATOM 2083 C GLY A 127 8.150 7.551 11.341 1.00 3.42 C ATOM 2084 O GLY A 127 8.871 8.489 11.690 1.00 61.33 O ATOM 0 H GLY A 127 5.586 7.442 10.808 1.00 52.14 H new ATOM 0 HA2 GLY A 127 6.849 7.811 13.028 1.00 32.34 H new ATOM 0 HA3 GLY A 127 7.379 6.159 12.781 1.00 32.34 H new ATOM 2088 N SER A 128 8.269 6.920 10.153 1.00 33.03 N ATOM 2089 CA SER A 128 9.326 7.227 9.170 1.00 54.24 C ATOM 2090 C SER A 128 9.184 8.666 8.630 1.00 1.12 C ATOM 2091 O SER A 128 8.305 8.960 7.829 1.00 31.23 O ATOM 2092 CB SER A 128 9.280 6.204 8.004 1.00 10.24 C ATOM 2093 OG SER A 128 9.499 4.878 8.465 1.00 12.35 O ATOM 0 H SER A 128 7.633 6.183 9.850 1.00 33.03 H new ATOM 0 HA SER A 128 10.291 7.152 9.671 1.00 54.24 H new ATOM 0 HB2 SER A 128 8.312 6.262 7.506 1.00 10.24 H new ATOM 0 HB3 SER A 128 10.036 6.462 7.262 1.00 10.24 H new ATOM 0 HG SER A 128 9.462 4.258 7.707 1.00 12.35 H new ATOM 2099 N LEU A 129 10.029 9.567 9.129 1.00 54.53 N ATOM 2100 CA LEU A 129 10.152 10.940 8.612 1.00 52.03 C ATOM 2101 C LEU A 129 11.381 11.013 7.696 1.00 31.41 C ATOM 2102 O LEU A 129 12.290 10.175 7.809 1.00 42.41 O ATOM 2103 CB LEU A 129 10.270 11.942 9.795 1.00 11.11 C ATOM 2104 CG LEU A 129 9.033 12.000 10.751 1.00 43.15 C ATOM 2105 CD1 LEU A 129 9.273 12.972 11.928 1.00 63.52 C ATOM 2106 CD2 LEU A 129 7.748 12.363 9.975 1.00 12.45 C ATOM 0 H LEU A 129 10.655 9.369 9.910 1.00 54.53 H new ATOM 0 HA LEU A 129 9.266 11.209 8.037 1.00 52.03 H new ATOM 0 HB2 LEU A 129 11.150 11.682 10.383 1.00 11.11 H new ATOM 0 HB3 LEU A 129 10.441 12.939 9.389 1.00 11.11 H new ATOM 0 HG LEU A 129 8.896 11.005 11.174 1.00 43.15 H new ATOM 0 HD11 LEU A 129 8.394 12.988 12.572 1.00 63.52 H new ATOM 0 HD12 LEU A 129 10.138 12.641 12.503 1.00 63.52 H new ATOM 0 HD13 LEU A 129 9.457 13.974 11.541 1.00 63.52 H new ATOM 0 HD21 LEU A 129 6.904 12.396 10.664 1.00 12.45 H new ATOM 0 HD22 LEU A 129 7.871 13.338 9.504 1.00 12.45 H new ATOM 0 HD23 LEU A 129 7.561 11.611 9.208 1.00 12.45 H new ATOM 2118 N GLU A 130 11.404 12.011 6.793 1.00 2.34 N ATOM 2119 CA GLU A 130 12.571 12.274 5.933 1.00 72.15 C ATOM 2120 C GLU A 130 13.748 12.690 6.818 1.00 1.31 C ATOM 2121 O GLU A 130 13.645 13.688 7.540 1.00 73.15 O ATOM 2122 CB GLU A 130 12.254 13.360 4.875 1.00 2.32 C ATOM 2123 CG GLU A 130 10.983 13.054 4.073 1.00 60.10 C ATOM 2124 CD GLU A 130 10.719 14.004 2.906 1.00 74.13 C ATOM 2125 OE1 GLU A 130 10.668 15.229 3.132 1.00 5.23 O ATOM 2126 OE2 GLU A 130 10.558 13.535 1.763 1.00 53.33 O ATOM 0 H GLU A 130 10.624 12.650 6.640 1.00 2.34 H new ATOM 0 HA GLU A 130 12.831 11.367 5.386 1.00 72.15 H new ATOM 0 HB2 GLU A 130 12.141 14.323 5.372 1.00 2.32 H new ATOM 0 HB3 GLU A 130 13.097 13.451 4.190 1.00 2.32 H new ATOM 0 HG2 GLU A 130 11.049 12.037 3.687 1.00 60.10 H new ATOM 0 HG3 GLU A 130 10.128 13.084 4.748 1.00 60.10 H new ATOM 2133 N HIS A 131 14.838 11.898 6.762 1.00 53.41 N ATOM 2134 CA HIS A 131 16.027 12.004 7.653 1.00 4.33 C ATOM 2135 C HIS A 131 16.698 13.384 7.591 1.00 60.44 C ATOM 2136 O HIS A 131 17.393 13.803 8.527 1.00 72.01 O ATOM 2137 CB HIS A 131 17.046 10.896 7.289 1.00 3.43 C ATOM 2138 CG HIS A 131 16.432 9.526 7.264 1.00 61.42 C ATOM 2139 ND1 HIS A 131 16.051 8.939 6.083 1.00 33.31 N ATOM 2140 CD2 HIS A 131 16.119 8.700 8.286 1.00 41.33 C ATOM 2141 CE1 HIS A 131 15.511 7.789 6.421 1.00 53.23 C ATOM 2142 NE2 HIS A 131 15.530 7.595 7.738 1.00 5.12 N ATOM 0 H HIS A 131 14.925 11.145 6.080 1.00 53.41 H new ATOM 0 HA HIS A 131 15.679 11.873 8.678 1.00 4.33 H new ATOM 0 HB2 HIS A 131 17.478 11.113 6.312 1.00 3.43 H new ATOM 0 HB3 HIS A 131 17.864 10.910 8.010 1.00 3.43 H new ATOM 0 HD2 HIS A 131 16.300 8.879 9.336 1.00 41.33 H new ATOM 0 HE1 HIS A 131 15.100 7.084 5.713 1.00 53.23 H new ATOM 0 HE2 HIS A 131 15.175 6.781 8.240 1.00 5.12 H new ATOM 2150 N HIS A 132 16.456 14.093 6.483 1.00 22.23 N ATOM 2151 CA HIS A 132 16.944 15.461 6.267 1.00 41.25 C ATOM 2152 C HIS A 132 15.948 16.501 6.859 1.00 22.32 C ATOM 2153 O HIS A 132 15.969 17.660 6.477 1.00 55.21 O ATOM 2154 CB HIS A 132 17.181 15.673 4.739 1.00 42.35 C ATOM 2155 CG HIS A 132 18.132 16.793 4.392 1.00 31.45 C ATOM 2156 ND1 HIS A 132 18.047 17.457 3.194 1.00 51.31 N ATOM 2157 CD2 HIS A 132 19.180 17.292 5.099 1.00 73.42 C ATOM 2158 CE1 HIS A 132 19.038 18.325 3.194 1.00 30.32 C ATOM 2159 NE2 HIS A 132 19.746 18.262 4.327 1.00 64.23 N ATOM 0 H HIS A 132 15.910 13.730 5.702 1.00 22.23 H new ATOM 0 HA HIS A 132 17.890 15.608 6.788 1.00 41.25 H new ATOM 0 HB2 HIS A 132 17.564 14.746 4.314 1.00 42.35 H new ATOM 0 HB3 HIS A 132 16.221 15.870 4.261 1.00 42.35 H new ATOM 0 HD2 HIS A 132 19.502 16.980 6.082 1.00 73.42 H new ATOM 0 HE1 HIS A 132 19.252 19.003 2.381 1.00 30.32 H new ATOM 0 HE2 HIS A 132 20.557 18.832 4.568 1.00 64.23 H new ATOM 2167 N HIS A 133 15.087 16.049 7.809 1.00 0.24 N ATOM 2168 CA HIS A 133 14.108 16.889 8.557 1.00 1.41 C ATOM 2169 C HIS A 133 13.112 17.603 7.610 1.00 64.55 C ATOM 2170 O HIS A 133 12.677 18.732 7.882 1.00 63.34 O ATOM 2171 CB HIS A 133 14.834 17.911 9.483 1.00 3.15 C ATOM 2172 CG HIS A 133 15.762 17.296 10.504 1.00 31.14 C ATOM 2173 ND1 HIS A 133 15.439 17.165 11.839 1.00 74.44 N ATOM 2174 CD2 HIS A 133 17.028 16.820 10.382 1.00 71.44 C ATOM 2175 CE1 HIS A 133 16.460 16.641 12.485 1.00 55.03 C ATOM 2176 NE2 HIS A 133 17.433 16.417 11.627 1.00 62.42 N ATOM 0 H HIS A 133 15.052 15.067 8.084 1.00 0.24 H new ATOM 0 HA HIS A 133 13.526 16.217 9.187 1.00 1.41 H new ATOM 0 HB2 HIS A 133 15.406 18.600 8.861 1.00 3.15 H new ATOM 0 HB3 HIS A 133 14.083 18.503 10.006 1.00 3.15 H new ATOM 0 HD2 HIS A 133 17.608 16.769 9.472 1.00 71.44 H new ATOM 0 HE1 HIS A 133 16.494 16.430 13.544 1.00 55.03 H new ATOM 0 HE2 HIS A 133 18.341 16.010 11.853 1.00 62.42 H new ATOM 2185 N HIS A 134 12.726 16.893 6.522 1.00 31.03 N ATOM 2186 CA HIS A 134 11.809 17.404 5.474 1.00 32.41 C ATOM 2187 C HIS A 134 12.390 18.635 4.724 1.00 53.22 C ATOM 2188 O HIS A 134 11.636 19.477 4.232 1.00 61.50 O ATOM 2189 CB HIS A 134 10.376 17.705 6.035 1.00 34.24 C ATOM 2190 CG HIS A 134 9.591 16.487 6.461 1.00 32.15 C ATOM 2191 ND1 HIS A 134 9.078 15.584 5.566 1.00 13.22 N ATOM 2192 CD2 HIS A 134 9.220 16.042 7.689 1.00 33.03 C ATOM 2193 CE1 HIS A 134 8.422 14.644 6.210 1.00 65.43 C ATOM 2194 NE2 HIS A 134 8.485 14.893 7.504 1.00 3.34 N ATOM 0 H HIS A 134 13.046 15.941 6.346 1.00 31.03 H new ATOM 0 HA HIS A 134 11.711 16.601 4.744 1.00 32.41 H new ATOM 0 HB2 HIS A 134 10.470 18.376 6.889 1.00 34.24 H new ATOM 0 HB3 HIS A 134 9.808 18.237 5.272 1.00 34.24 H new ATOM 0 HD1 HIS A 134 9.189 15.634 4.553 1.00 13.22 H new ATOM 0 HD2 HIS A 134 9.458 16.504 8.636 1.00 33.03 H new ATOM 0 HE1 HIS A 134 7.915 13.806 5.755 1.00 65.43 H new ATOM 2203 N HIS A 135 13.737 18.706 4.595 1.00 53.34 N ATOM 2204 CA HIS A 135 14.408 19.718 3.728 1.00 20.32 C ATOM 2205 C HIS A 135 14.464 19.249 2.250 1.00 14.24 C ATOM 2206 O HIS A 135 15.170 19.851 1.442 1.00 35.34 O ATOM 2207 CB HIS A 135 15.846 20.039 4.241 1.00 51.32 C ATOM 2208 CG HIS A 135 15.911 20.894 5.481 1.00 32.12 C ATOM 2209 ND1 HIS A 135 16.345 22.205 5.472 1.00 14.21 N ATOM 2210 CD2 HIS A 135 15.629 20.612 6.774 1.00 50.14 C ATOM 2211 CE1 HIS A 135 16.336 22.678 6.702 1.00 11.34 C ATOM 2212 NE2 HIS A 135 15.904 21.735 7.509 1.00 54.45 N ATOM 0 H HIS A 135 14.382 18.079 5.076 1.00 53.34 H new ATOM 0 HA HIS A 135 13.811 20.629 3.778 1.00 20.32 H new ATOM 0 HB2 HIS A 135 16.361 19.099 4.440 1.00 51.32 H new ATOM 0 HB3 HIS A 135 16.395 20.541 3.444 1.00 51.32 H new ATOM 0 HD2 HIS A 135 15.256 19.674 7.157 1.00 50.14 H new ATOM 0 HE1 HIS A 135 16.634 23.673 6.997 1.00 11.34 H new ATOM 0 HE2 HIS A 135 15.792 21.825 8.519 1.00 54.45 H new ATOM 2221 N HIS A 136 13.713 18.176 1.933 1.00 31.22 N ATOM 2222 CA HIS A 136 13.553 17.621 0.570 1.00 54.34 C ATOM 2223 C HIS A 136 13.059 18.724 -0.415 1.00 3.11 C ATOM 2224 O HIS A 136 11.916 19.207 -0.252 1.00 12.32 O ATOM 2225 CB HIS A 136 12.540 16.438 0.659 1.00 70.43 C ATOM 2226 CG HIS A 136 12.280 15.631 -0.599 1.00 31.21 C ATOM 2227 ND1 HIS A 136 12.029 14.274 -0.562 1.00 33.55 N ATOM 2228 CD2 HIS A 136 12.177 15.980 -1.909 1.00 32.04 C ATOM 2229 CE1 HIS A 136 11.762 13.838 -1.774 1.00 31.32 C ATOM 2230 NE2 HIS A 136 11.852 14.851 -2.608 1.00 65.20 N ATOM 2231 OXT HIS A 136 13.809 19.084 -1.349 1.00 37.71 O ATOM 0 H HIS A 136 13.186 17.656 2.635 1.00 31.22 H new ATOM 0 HA HIS A 136 14.507 17.261 0.185 1.00 54.34 H new ATOM 0 HB2 HIS A 136 12.893 15.752 1.429 1.00 70.43 H new ATOM 0 HB3 HIS A 136 11.586 16.839 1.002 1.00 70.43 H new ATOM 0 HD1 HIS A 136 12.048 13.696 0.279 1.00 33.55 H new ATOM 0 HD2 HIS A 136 12.325 16.967 -2.321 1.00 32.04 H new ATOM 0 HE1 HIS A 136 11.512 12.821 -2.039 1.00 31.32 H new TER 2240 HIS A 136