USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 973 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 94 ASN : amide:sc= -0.96 K(o=-0.38,f=-3.5) USER MOD Set 1.2: A 103 LYS NZ :NH3+ 137:sc= 0.576 (180deg=0) USER MOD Set 1.3: A 124 GLN : amide:sc= 0.00315 X(o=-0.38,f=-0.49) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 CYS SG : rot 130:sc= -0.284 USER MOD Single : A 22 THR OG1 : rot 70:sc= 0.6 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 HIS : no HD1:sc= -0.0577 X(o=-0.058,f=-0.18) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 150:sc= -1.02 USER MOD Single : A 34 TYR OH : rot 76:sc= -3.34! USER MOD Single : A 37 MET CE :methyl -131:sc= -0.897 (180deg=-3.33!) USER MOD Single : A 38 HIS : no HD1:sc= -2.29 K(o=-2.3,f=-1.2) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot -13:sc= 0.914 USER MOD Single : A 56 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 59 GLN : amide:sc= -0.0652 K(o=-0.065,f=-0.63) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.751 X(o=-0.75,f=-1.2) USER MOD Single : A 70 CYS SG : rot -3:sc= -0.411 USER MOD Single : A 71 TYR OH : rot -121:sc= 1.04 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 SER OG : rot 132:sc= 1.07 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -172:sc= -1.47! USER MOD Single : A 104 MET CE :methyl -144:sc= -0.228 (180deg=-1.03) USER MOD Single : A 106 TYR OH : rot 180:sc= -0.51 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -59:sc= 0.641 USER MOD Single : A 109 SER OG : rot 175:sc= -3.73! USER MOD Single : A 117 THR OG1 : rot -16:sc= 0.739 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= -0.0905 X(o=-0.091,f=-0.0028) USER MOD Single : A 126 ASN : amide:sc= -0.198 X(o=-0.2,f=-0.31) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 82:sc= 0.00847 USER MOD Single : A 139 LYS NZ :NH3+ -157:sc= 0.851 (180deg=0.558) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 98:sc= 0.808 USER MOD Single : A 143 ASN : amide:sc= -0.016 X(o=-0.016,f=-0.076) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -5.125 7.073 -3.072 1.00 42.10 N ATOM 64 CA VAL A 14 -5.753 7.916 -2.062 1.00 5.52 C ATOM 65 C VAL A 14 -4.931 9.176 -1.810 1.00 31.24 C ATOM 66 O VAL A 14 -3.890 9.130 -1.154 1.00 33.50 O ATOM 67 CB VAL A 14 -5.933 7.160 -0.732 1.00 72.14 C ATOM 68 CG1 VAL A 14 -6.310 8.123 0.383 1.00 32.22 C ATOM 69 CG2 VAL A 14 -6.980 6.066 -0.880 1.00 52.34 C ATOM 0 HA VAL A 14 -6.733 8.195 -2.448 1.00 5.52 H new ATOM 0 HB VAL A 14 -4.985 6.691 -0.469 1.00 72.14 H new ATOM 0 HG11 VAL A 14 -6.433 7.571 1.315 1.00 32.22 H new ATOM 0 HG12 VAL A 14 -5.522 8.867 0.503 1.00 32.22 H new ATOM 0 HG13 VAL A 14 -7.245 8.623 0.131 1.00 32.22 H new ATOM 0 HG21 VAL A 14 -7.095 5.542 0.069 1.00 52.34 H new ATOM 0 HG22 VAL A 14 -7.933 6.511 -1.167 1.00 52.34 H new ATOM 0 HG23 VAL A 14 -6.663 5.361 -1.648 1.00 52.34 H new ATOM 79 N SER A 15 -5.406 10.301 -2.334 1.00 74.34 N ATOM 80 CA SER A 15 -4.714 11.574 -2.169 1.00 72.51 C ATOM 81 C SER A 15 -5.355 12.400 -1.059 1.00 12.34 C ATOM 82 O SER A 15 -6.579 12.491 -0.964 1.00 33.33 O ATOM 83 CB SER A 15 -4.730 12.361 -3.481 1.00 31.13 C ATOM 84 OG SER A 15 -3.431 12.448 -4.039 1.00 5.00 O ATOM 0 H SER A 15 -6.268 10.357 -2.877 1.00 74.34 H new ATOM 0 HA SER A 15 -3.681 11.365 -1.892 1.00 72.51 H new ATOM 0 HB2 SER A 15 -5.402 11.878 -4.190 1.00 31.13 H new ATOM 0 HB3 SER A 15 -5.121 13.363 -3.303 1.00 31.13 H new ATOM 0 HG SER A 15 -3.468 12.954 -4.877 1.00 5.00 H new ATOM 90 N VAL A 16 -4.518 13.003 -0.219 1.00 74.55 N ATOM 91 CA VAL A 16 -5.002 13.823 0.885 1.00 44.25 C ATOM 92 C VAL A 16 -5.326 15.238 0.417 1.00 61.50 C ATOM 93 O VAL A 16 -4.532 15.870 -0.279 1.00 23.42 O ATOM 94 CB VAL A 16 -3.968 13.895 2.024 1.00 13.34 C ATOM 95 CG1 VAL A 16 -2.632 14.403 1.503 1.00 35.21 C ATOM 96 CG2 VAL A 16 -4.480 14.779 3.152 1.00 33.30 C ATOM 0 H VAL A 16 -3.502 12.939 -0.283 1.00 74.55 H new ATOM 0 HA VAL A 16 -5.910 13.350 1.258 1.00 44.25 H new ATOM 0 HB VAL A 16 -3.818 12.890 2.419 1.00 13.34 H new ATOM 0 HG11 VAL A 16 -1.915 14.447 2.323 1.00 35.21 H new ATOM 0 HG12 VAL A 16 -2.261 13.727 0.732 1.00 35.21 H new ATOM 0 HG13 VAL A 16 -2.761 15.399 1.080 1.00 35.21 H new ATOM 0 HG21 VAL A 16 -3.737 14.819 3.949 1.00 33.30 H new ATOM 0 HG22 VAL A 16 -4.660 15.785 2.773 1.00 33.30 H new ATOM 0 HG23 VAL A 16 -5.410 14.367 3.544 1.00 33.30 H new ATOM 106 N ALA A 17 -6.498 15.729 0.805 1.00 73.23 N ATOM 107 CA ALA A 17 -6.927 17.070 0.428 1.00 60.15 C ATOM 108 C ALA A 17 -6.266 18.125 1.307 1.00 3.43 C ATOM 109 O ALA A 17 -5.957 17.872 2.472 1.00 62.23 O ATOM 110 CB ALA A 17 -8.442 17.183 0.512 1.00 1.13 C ATOM 0 H ALA A 17 -7.168 15.218 1.380 1.00 73.23 H new ATOM 0 HA ALA A 17 -6.617 17.248 -0.602 1.00 60.15 H new ATOM 0 HB1 ALA A 17 -8.748 18.190 0.228 1.00 1.13 H new ATOM 0 HB2 ALA A 17 -8.899 16.460 -0.164 1.00 1.13 H new ATOM 0 HB3 ALA A 17 -8.766 16.980 1.533 1.00 1.13 H new ATOM 116 N ASP A 18 -6.051 19.309 0.743 1.00 23.32 N ATOM 117 CA ASP A 18 -5.426 20.403 1.477 1.00 40.31 C ATOM 118 C ASP A 18 -6.161 20.669 2.787 1.00 55.24 C ATOM 119 O ASP A 18 -5.546 21.010 3.796 1.00 32.23 O ATOM 120 CB ASP A 18 -5.405 21.672 0.623 1.00 72.24 C ATOM 121 CG ASP A 18 -4.159 21.772 -0.234 1.00 42.35 C ATOM 122 OD1 ASP A 18 -3.878 20.816 -0.987 1.00 52.41 O ATOM 123 OD2 ASP A 18 -3.463 22.807 -0.152 1.00 33.40 O ATOM 0 H ASP A 18 -6.300 19.535 -0.220 1.00 23.32 H new ATOM 0 HA ASP A 18 -4.401 20.113 1.709 1.00 40.31 H new ATOM 0 HB2 ASP A 18 -6.286 21.689 -0.018 1.00 72.24 H new ATOM 0 HB3 ASP A 18 -5.467 22.545 1.273 1.00 72.24 H new ATOM 128 N GLU A 19 -7.481 20.512 2.761 1.00 73.11 N ATOM 129 CA GLU A 19 -8.300 20.737 3.946 1.00 10.13 C ATOM 130 C GLU A 19 -7.864 19.825 5.090 1.00 53.32 C ATOM 131 O GLU A 19 -7.739 20.264 6.234 1.00 64.41 O ATOM 132 CB GLU A 19 -9.777 20.501 3.626 1.00 73.35 C ATOM 133 CG GLU A 19 -10.057 19.138 3.015 1.00 71.22 C ATOM 134 CD GLU A 19 -11.487 18.998 2.530 1.00 50.20 C ATOM 135 OE1 GLU A 19 -12.247 19.983 2.635 1.00 13.52 O ATOM 136 OE2 GLU A 19 -11.846 17.905 2.046 1.00 61.41 O ATOM 0 H GLU A 19 -8.005 20.230 1.933 1.00 73.11 H new ATOM 0 HA GLU A 19 -8.165 21.773 4.258 1.00 10.13 H new ATOM 0 HB2 GLU A 19 -10.360 20.606 4.541 1.00 73.35 H new ATOM 0 HB3 GLU A 19 -10.120 21.275 2.939 1.00 73.35 H new ATOM 0 HG2 GLU A 19 -9.376 18.972 2.180 1.00 71.22 H new ATOM 0 HG3 GLU A 19 -9.851 18.364 3.754 1.00 71.22 H new ATOM 143 N CYS A 20 -7.636 18.556 4.772 1.00 73.10 N ATOM 144 CA CYS A 20 -7.216 17.581 5.772 1.00 30.12 C ATOM 145 C CYS A 20 -5.840 17.932 6.329 1.00 13.02 C ATOM 146 O CYS A 20 -5.607 17.846 7.535 1.00 43.51 O ATOM 147 CB CYS A 20 -7.191 16.177 5.167 1.00 74.41 C ATOM 148 SG CYS A 20 -8.800 15.599 4.576 1.00 2.04 S ATOM 0 H CYS A 20 -7.735 18.178 3.830 1.00 73.10 H new ATOM 0 HA CYS A 20 -7.936 17.603 6.590 1.00 30.12 H new ATOM 0 HB2 CYS A 20 -6.485 16.163 4.337 1.00 74.41 H new ATOM 0 HB3 CYS A 20 -6.818 15.477 5.915 1.00 74.41 H new ATOM 0 HG CYS A 20 -8.681 15.150 3.362 1.00 2.04 H new ATOM 154 N VAL A 21 -4.932 18.326 5.443 1.00 45.13 N ATOM 155 CA VAL A 21 -3.578 18.690 5.845 1.00 32.43 C ATOM 156 C VAL A 21 -3.593 19.834 6.852 1.00 11.40 C ATOM 157 O VAL A 21 -2.965 19.756 7.908 1.00 1.14 O ATOM 158 CB VAL A 21 -2.722 19.099 4.632 1.00 75.12 C ATOM 159 CG1 VAL A 21 -1.286 19.362 5.056 1.00 43.51 C ATOM 160 CG2 VAL A 21 -2.781 18.027 3.554 1.00 42.34 C ATOM 0 H VAL A 21 -5.109 18.402 4.441 1.00 45.13 H new ATOM 0 HA VAL A 21 -3.138 17.807 6.309 1.00 32.43 H new ATOM 0 HB VAL A 21 -3.127 20.022 4.217 1.00 75.12 H new ATOM 0 HG11 VAL A 21 -0.696 19.650 4.185 1.00 43.51 H new ATOM 0 HG12 VAL A 21 -1.265 20.167 5.791 1.00 43.51 H new ATOM 0 HG13 VAL A 21 -0.865 18.458 5.496 1.00 43.51 H new ATOM 0 HG21 VAL A 21 -2.171 18.332 2.704 1.00 42.34 H new ATOM 0 HG22 VAL A 21 -2.402 17.087 3.955 1.00 42.34 H new ATOM 0 HG23 VAL A 21 -3.813 17.893 3.230 1.00 42.34 H new ATOM 170 N THR A 22 -4.316 20.899 6.518 1.00 3.44 N ATOM 171 CA THR A 22 -4.413 22.062 7.392 1.00 23.54 C ATOM 172 C THR A 22 -5.083 21.702 8.713 1.00 33.33 C ATOM 173 O THR A 22 -4.660 22.152 9.778 1.00 73.33 O ATOM 174 CB THR A 22 -5.201 23.203 6.724 1.00 53.24 C ATOM 175 OG1 THR A 22 -4.926 23.231 5.319 1.00 40.43 O ATOM 176 CG2 THR A 22 -4.841 24.545 7.343 1.00 11.11 C ATOM 0 H THR A 22 -4.843 20.980 5.648 1.00 3.44 H new ATOM 0 HA THR A 22 -3.394 22.399 7.584 1.00 23.54 H new ATOM 0 HB THR A 22 -6.264 23.022 6.882 1.00 53.24 H new ATOM 0 HG1 THR A 22 -5.337 22.452 4.890 1.00 40.43 H new ATOM 0 HG21 THR A 22 -5.411 25.336 6.854 1.00 11.11 H new ATOM 0 HG22 THR A 22 -5.079 24.531 8.407 1.00 11.11 H new ATOM 0 HG23 THR A 22 -3.775 24.732 7.212 1.00 11.11 H new ATOM 184 N ALA A 23 -6.131 20.887 8.637 1.00 2.42 N ATOM 185 CA ALA A 23 -6.858 20.465 9.828 1.00 51.13 C ATOM 186 C ALA A 23 -5.933 19.762 10.815 1.00 33.23 C ATOM 187 O ALA A 23 -5.947 20.056 12.011 1.00 24.45 O ATOM 188 CB ALA A 23 -8.015 19.554 9.444 1.00 3.00 C ATOM 0 H ALA A 23 -6.495 20.506 7.763 1.00 2.42 H new ATOM 0 HA ALA A 23 -7.257 21.355 10.315 1.00 51.13 H new ATOM 0 HB1 ALA A 23 -8.549 19.246 10.343 1.00 3.00 H new ATOM 0 HB2 ALA A 23 -8.696 20.090 8.782 1.00 3.00 H new ATOM 0 HB3 ALA A 23 -7.630 18.673 8.931 1.00 3.00 H new ATOM 194 N LEU A 24 -5.132 18.832 10.308 1.00 23.44 N ATOM 195 CA LEU A 24 -4.200 18.085 11.147 1.00 41.23 C ATOM 196 C LEU A 24 -3.103 18.997 11.687 1.00 13.24 C ATOM 197 O LEU A 24 -2.698 18.879 12.843 1.00 50.01 O ATOM 198 CB LEU A 24 -3.577 16.936 10.353 1.00 73.55 C ATOM 199 CG LEU A 24 -4.553 15.896 9.800 1.00 40.03 C ATOM 200 CD1 LEU A 24 -3.902 15.093 8.684 1.00 22.25 C ATOM 201 CD2 LEU A 24 -5.037 14.975 10.910 1.00 1.12 C ATOM 0 H LEU A 24 -5.109 18.577 9.321 1.00 23.44 H new ATOM 0 HA LEU A 24 -4.756 17.676 11.991 1.00 41.23 H new ATOM 0 HB2 LEU A 24 -3.017 17.359 9.519 1.00 73.55 H new ATOM 0 HB3 LEU A 24 -2.858 16.426 10.994 1.00 73.55 H new ATOM 0 HG LEU A 24 -5.416 16.419 9.388 1.00 40.03 H new ATOM 0 HD11 LEU A 24 -4.611 14.358 8.303 1.00 22.25 H new ATOM 0 HD12 LEU A 24 -3.606 15.764 7.878 1.00 22.25 H new ATOM 0 HD13 LEU A 24 -3.021 14.580 9.071 1.00 22.25 H new ATOM 0 HD21 LEU A 24 -5.730 14.242 10.498 1.00 1.12 H new ATOM 0 HD22 LEU A 24 -4.185 14.460 11.353 1.00 1.12 H new ATOM 0 HD23 LEU A 24 -5.543 15.563 11.676 1.00 1.12 H new ATOM 213 N ASN A 25 -2.629 19.908 10.844 1.00 41.11 N ATOM 214 CA ASN A 25 -1.580 20.842 11.238 1.00 72.02 C ATOM 215 C ASN A 25 -2.013 21.668 12.445 1.00 0.13 C ATOM 216 O ASN A 25 -1.253 21.837 13.399 1.00 13.12 O ATOM 217 CB ASN A 25 -1.229 21.768 10.072 1.00 63.03 C ATOM 218 CG ASN A 25 0.186 21.553 9.569 1.00 73.13 C ATOM 219 OD1 ASN A 25 1.024 22.452 9.638 1.00 64.52 O ATOM 220 ND2 ASN A 25 0.457 20.357 9.059 1.00 53.02 N ATOM 0 H ASN A 25 -2.954 20.020 9.884 1.00 41.11 H new ATOM 0 HA ASN A 25 -0.698 20.264 11.513 1.00 72.02 H new ATOM 0 HB2 ASN A 25 -1.931 21.602 9.255 1.00 63.03 H new ATOM 0 HB3 ASN A 25 -1.346 22.805 10.387 1.00 63.03 H new ATOM 0 HD21 ASN A 25 1.391 20.154 8.704 1.00 53.02 H new ATOM 0 HD22 ASN A 25 -0.269 19.642 9.022 1.00 53.02 H new ATOM 227 N ASP A 26 -3.238 22.180 12.397 1.00 61.34 N ATOM 228 CA ASP A 26 -3.773 22.987 13.487 1.00 73.02 C ATOM 229 C ASP A 26 -4.079 22.121 14.705 1.00 62.11 C ATOM 230 O ASP A 26 -3.883 22.543 15.845 1.00 5.22 O ATOM 231 CB ASP A 26 -5.038 23.718 13.035 1.00 75.11 C ATOM 232 CG ASP A 26 -4.830 25.214 12.911 1.00 5.40 C ATOM 233 OD1 ASP A 26 -3.678 25.635 12.675 1.00 23.34 O ATOM 234 OD2 ASP A 26 -5.818 25.965 13.051 1.00 42.44 O ATOM 0 H ASP A 26 -3.879 22.050 11.614 1.00 61.34 H new ATOM 0 HA ASP A 26 -3.018 23.722 13.767 1.00 73.02 H new ATOM 0 HB2 ASP A 26 -5.361 23.318 12.074 1.00 75.11 H new ATOM 0 HB3 ASP A 26 -5.840 23.524 13.747 1.00 75.11 H new ATOM 239 N LEU A 27 -4.561 20.908 14.456 1.00 11.42 N ATOM 240 CA LEU A 27 -4.895 19.982 15.533 1.00 52.33 C ATOM 241 C LEU A 27 -3.676 19.696 16.403 1.00 44.10 C ATOM 242 O LEU A 27 -3.769 19.669 17.630 1.00 0.42 O ATOM 243 CB LEU A 27 -5.443 18.675 14.956 1.00 4.42 C ATOM 244 CG LEU A 27 -6.462 17.934 15.823 1.00 43.54 C ATOM 245 CD1 LEU A 27 -7.879 18.320 15.428 1.00 43.42 C ATOM 246 CD2 LEU A 27 -6.265 16.430 15.708 1.00 32.22 C ATOM 0 H LEU A 27 -4.729 20.543 13.519 1.00 11.42 H new ATOM 0 HA LEU A 27 -5.660 20.447 16.155 1.00 52.33 H new ATOM 0 HB2 LEU A 27 -5.905 18.892 13.993 1.00 4.42 H new ATOM 0 HB3 LEU A 27 -4.604 18.006 14.764 1.00 4.42 H new ATOM 0 HG LEU A 27 -6.305 18.222 16.862 1.00 43.54 H new ATOM 0 HD11 LEU A 27 -8.591 17.783 16.055 1.00 43.42 H new ATOM 0 HD12 LEU A 27 -8.015 19.393 15.562 1.00 43.42 H new ATOM 0 HD13 LEU A 27 -8.049 18.061 14.383 1.00 43.42 H new ATOM 0 HD21 LEU A 27 -6.998 15.918 16.331 1.00 32.22 H new ATOM 0 HD22 LEU A 27 -6.395 16.124 14.670 1.00 32.22 H new ATOM 0 HD23 LEU A 27 -5.260 16.168 16.040 1.00 32.22 H new ATOM 258 N ARG A 28 -2.532 19.485 15.759 1.00 32.23 N ATOM 259 CA ARG A 28 -1.294 19.202 16.475 1.00 62.24 C ATOM 260 C ARG A 28 -0.885 20.387 17.345 1.00 75.03 C ATOM 261 O ARG A 28 -0.161 20.229 18.328 1.00 63.44 O ATOM 262 CB ARG A 28 -0.174 18.871 15.487 1.00 64.32 C ATOM 263 CG ARG A 28 0.607 20.089 15.021 1.00 25.31 C ATOM 264 CD ARG A 28 1.839 20.323 15.882 1.00 41.13 C ATOM 265 NE ARG A 28 3.075 20.042 15.157 1.00 61.25 N ATOM 266 CZ ARG A 28 3.581 20.845 14.228 1.00 44.14 C ATOM 267 NH1 ARG A 28 2.961 21.974 13.913 1.00 70.20 N ATOM 268 NH2 ARG A 28 4.711 20.520 13.612 1.00 51.23 N ATOM 0 H ARG A 28 -2.437 19.505 14.744 1.00 32.23 H new ATOM 0 HA ARG A 28 -1.466 18.342 17.122 1.00 62.24 H new ATOM 0 HB2 ARG A 28 0.514 18.166 15.953 1.00 64.32 H new ATOM 0 HB3 ARG A 28 -0.603 18.371 14.619 1.00 64.32 H new ATOM 0 HG2 ARG A 28 0.908 19.954 13.982 1.00 25.31 H new ATOM 0 HG3 ARG A 28 -0.035 20.969 15.055 1.00 25.31 H new ATOM 0 HD2 ARG A 28 1.849 21.357 16.228 1.00 41.13 H new ATOM 0 HD3 ARG A 28 1.787 19.691 16.768 1.00 41.13 H new ATOM 0 HE ARG A 28 3.577 19.182 15.376 1.00 61.25 H new ATOM 0 HH11 ARG A 28 2.093 22.228 14.385 1.00 70.20 H new ATOM 0 HH12 ARG A 28 3.352 22.589 13.199 1.00 70.20 H new ATOM 0 HH21 ARG A 28 5.192 19.653 13.852 1.00 51.23 H new ATOM 0 HH22 ARG A 28 5.099 21.137 12.899 1.00 51.23 H new ATOM 282 N HIS A 29 -1.355 21.575 16.976 1.00 31.31 N ATOM 283 CA HIS A 29 -1.039 22.787 17.723 1.00 40.11 C ATOM 284 C HIS A 29 -2.121 23.086 18.757 1.00 43.15 C ATOM 285 O HIS A 29 -2.251 24.217 19.225 1.00 1.04 O ATOM 286 CB HIS A 29 -0.886 23.973 16.770 1.00 21.01 C ATOM 287 CG HIS A 29 0.482 24.582 16.786 1.00 24.34 C ATOM 288 ND1 HIS A 29 1.157 24.886 17.950 1.00 52.20 N ATOM 289 CD2 HIS A 29 1.304 24.941 15.772 1.00 13.02 C ATOM 290 CE1 HIS A 29 2.333 25.408 17.651 1.00 50.22 C ATOM 291 NE2 HIS A 29 2.447 25.452 16.336 1.00 50.04 N ATOM 0 H HIS A 29 -1.955 21.724 16.165 1.00 31.31 H new ATOM 0 HA HIS A 29 -0.096 22.627 18.246 1.00 40.11 H new ATOM 0 HB2 HIS A 29 -1.117 23.646 15.756 1.00 21.01 H new ATOM 0 HB3 HIS A 29 -1.618 24.737 17.033 1.00 21.01 H new ATOM 0 HD2 HIS A 29 1.099 24.844 14.716 1.00 13.02 H new ATOM 0 HE1 HIS A 29 3.075 25.742 18.361 1.00 50.22 H new ATOM 0 HE2 HIS A 29 3.253 25.808 15.823 1.00 50.04 H new ATOM 299 N LYS A 30 -2.896 22.065 19.107 1.00 5.21 N ATOM 300 CA LYS A 30 -3.966 22.217 20.085 1.00 11.23 C ATOM 301 C LYS A 30 -4.993 23.242 19.613 1.00 30.42 C ATOM 302 O LYS A 30 -5.405 24.118 20.373 1.00 53.42 O ATOM 303 CB LYS A 30 -3.392 22.642 21.439 1.00 63.42 C ATOM 304 CG LYS A 30 -2.244 21.767 21.914 1.00 51.23 C ATOM 305 CD LYS A 30 -0.930 22.530 21.925 1.00 62.41 C ATOM 306 CE LYS A 30 -0.870 23.521 23.077 1.00 53.01 C ATOM 307 NZ LYS A 30 0.414 23.426 23.825 1.00 51.03 N ATOM 0 H LYS A 30 -2.803 21.123 18.727 1.00 5.21 H new ATOM 0 HA LYS A 30 -4.463 21.253 20.194 1.00 11.23 H new ATOM 0 HB2 LYS A 30 -3.047 23.674 21.371 1.00 63.42 H new ATOM 0 HB3 LYS A 30 -4.187 22.620 22.184 1.00 63.42 H new ATOM 0 HG2 LYS A 30 -2.459 21.396 22.916 1.00 51.23 H new ATOM 0 HG3 LYS A 30 -2.155 20.897 21.264 1.00 51.23 H new ATOM 0 HD2 LYS A 30 -0.101 21.827 22.005 1.00 62.41 H new ATOM 0 HD3 LYS A 30 -0.808 23.061 20.981 1.00 62.41 H new ATOM 0 HE2 LYS A 30 -0.992 24.533 22.692 1.00 53.01 H new ATOM 0 HE3 LYS A 30 -1.701 23.337 23.758 1.00 53.01 H new ATOM 0 HZ1 LYS A 30 0.415 24.118 24.602 1.00 51.03 H new ATOM 0 HZ2 LYS A 30 0.519 22.467 24.215 1.00 51.03 H new ATOM 0 HZ3 LYS A 30 1.206 23.627 23.182 1.00 51.03 H new ATOM 321 N LYS A 31 -5.404 23.124 18.355 1.00 3.20 N ATOM 322 CA LYS A 31 -6.385 24.038 17.782 1.00 62.24 C ATOM 323 C LYS A 31 -7.775 23.768 18.348 1.00 53.32 C ATOM 324 O LYS A 31 -8.338 24.600 19.060 1.00 42.12 O ATOM 325 CB LYS A 31 -6.408 23.903 16.257 1.00 32.44 C ATOM 326 CG LYS A 31 -7.501 24.720 15.591 1.00 52.10 C ATOM 327 CD LYS A 31 -8.449 23.839 14.794 1.00 44.55 C ATOM 328 CE LYS A 31 -9.064 24.596 13.627 1.00 41.54 C ATOM 329 NZ LYS A 31 -9.972 25.683 14.087 1.00 10.14 N ATOM 0 H LYS A 31 -5.073 22.404 17.713 1.00 3.20 H new ATOM 0 HA LYS A 31 -6.096 25.055 18.046 1.00 62.24 H new ATOM 0 HB2 LYS A 31 -5.441 24.212 15.859 1.00 32.44 H new ATOM 0 HB3 LYS A 31 -6.540 22.853 15.995 1.00 32.44 H new ATOM 0 HG2 LYS A 31 -8.062 25.266 16.350 1.00 52.10 H new ATOM 0 HG3 LYS A 31 -7.051 25.462 14.931 1.00 52.10 H new ATOM 0 HD2 LYS A 31 -7.911 22.968 14.421 1.00 44.55 H new ATOM 0 HD3 LYS A 31 -9.240 23.470 15.447 1.00 44.55 H new ATOM 0 HE2 LYS A 31 -8.271 25.021 13.012 1.00 41.54 H new ATOM 0 HE3 LYS A 31 -9.619 23.902 12.996 1.00 41.54 H new ATOM 0 HZ1 LYS A 31 -10.371 26.175 13.262 1.00 10.14 H new ATOM 0 HZ2 LYS A 31 -10.743 25.275 14.653 1.00 10.14 H new ATOM 0 HZ3 LYS A 31 -9.437 26.360 14.668 1.00 10.14 H new ATOM 343 N SER A 32 -8.324 22.600 18.028 1.00 45.51 N ATOM 344 CA SER A 32 -9.649 22.223 18.503 1.00 34.31 C ATOM 345 C SER A 32 -9.561 21.076 19.505 1.00 22.23 C ATOM 346 O SER A 32 -9.696 21.279 20.712 1.00 53.42 O ATOM 347 CB SER A 32 -10.540 21.819 17.327 1.00 52.34 C ATOM 348 OG SER A 32 -11.546 22.790 17.092 1.00 44.02 O ATOM 0 H SER A 32 -7.871 21.899 17.442 1.00 45.51 H new ATOM 0 HA SER A 32 -10.088 23.087 19.003 1.00 34.31 H new ATOM 0 HB2 SER A 32 -9.932 21.697 16.431 1.00 52.34 H new ATOM 0 HB3 SER A 32 -11.003 20.854 17.532 1.00 52.34 H new ATOM 0 HG SER A 32 -11.775 22.800 16.139 1.00 44.02 H new ATOM 354 N ARG A 33 -9.333 19.870 18.996 1.00 65.30 N ATOM 355 CA ARG A 33 -9.227 18.689 19.845 1.00 0.21 C ATOM 356 C ARG A 33 -8.956 17.441 19.010 1.00 50.21 C ATOM 357 O ARG A 33 -7.887 16.837 19.106 1.00 14.42 O ATOM 358 CB ARG A 33 -10.509 18.503 20.658 1.00 14.32 C ATOM 359 CG ARG A 33 -10.261 18.174 22.121 1.00 3.31 C ATOM 360 CD ARG A 33 -11.499 17.583 22.777 1.00 4.23 C ATOM 361 NE ARG A 33 -11.731 18.139 24.108 1.00 51.03 N ATOM 362 CZ ARG A 33 -12.686 17.711 24.926 1.00 10.52 C ATOM 363 NH1 ARG A 33 -13.493 16.728 24.552 1.00 2.04 N ATOM 364 NH2 ARG A 33 -12.835 18.268 26.122 1.00 70.34 N ATOM 0 H ARG A 33 -9.218 19.685 18.000 1.00 65.30 H new ATOM 0 HA ARG A 33 -8.390 18.837 20.527 1.00 0.21 H new ATOM 0 HB2 ARG A 33 -11.104 19.414 20.595 1.00 14.32 H new ATOM 0 HB3 ARG A 33 -11.100 17.704 20.210 1.00 14.32 H new ATOM 0 HG2 ARG A 33 -9.434 17.469 22.201 1.00 3.31 H new ATOM 0 HG3 ARG A 33 -9.962 19.077 22.653 1.00 3.31 H new ATOM 0 HD2 ARG A 33 -12.369 17.773 22.148 1.00 4.23 H new ATOM 0 HD3 ARG A 33 -11.389 16.501 22.850 1.00 4.23 H new ATOM 0 HE ARG A 33 -11.127 18.897 24.426 1.00 51.03 H new ATOM 0 HH11 ARG A 33 -13.382 16.298 23.634 1.00 2.04 H new ATOM 0 HH12 ARG A 33 -14.225 16.402 25.182 1.00 2.04 H new ATOM 0 HH21 ARG A 33 -12.216 19.025 26.413 1.00 70.34 H new ATOM 0 HH22 ARG A 33 -13.568 17.939 26.750 1.00 70.34 H new ATOM 378 N TYR A 34 -9.931 17.060 18.192 1.00 44.43 N ATOM 379 CA TYR A 34 -9.799 15.883 17.342 1.00 62.11 C ATOM 380 C TYR A 34 -10.500 16.095 16.004 1.00 53.41 C ATOM 381 O TYR A 34 -11.565 16.709 15.938 1.00 15.14 O ATOM 382 CB TYR A 34 -10.378 14.654 18.044 1.00 23.35 C ATOM 383 CG TYR A 34 -11.689 14.920 18.749 1.00 3.41 C ATOM 384 CD1 TYR A 34 -12.890 14.907 18.051 1.00 32.11 C ATOM 385 CD2 TYR A 34 -11.726 15.187 20.112 1.00 30.21 C ATOM 386 CE1 TYR A 34 -14.090 15.151 18.690 1.00 34.33 C ATOM 387 CE2 TYR A 34 -12.922 15.430 20.760 1.00 44.22 C ATOM 388 CZ TYR A 34 -14.101 15.411 20.045 1.00 40.22 C ATOM 389 OH TYR A 34 -15.294 15.655 20.686 1.00 21.41 O ATOM 0 H TYR A 34 -10.821 17.549 18.100 1.00 44.43 H new ATOM 0 HA TYR A 34 -8.738 15.720 17.154 1.00 62.11 H new ATOM 0 HB2 TYR A 34 -10.524 13.862 17.310 1.00 23.35 H new ATOM 0 HB3 TYR A 34 -9.653 14.286 18.770 1.00 23.35 H new ATOM 0 HD1 TYR A 34 -12.885 14.703 16.991 1.00 32.11 H new ATOM 0 HD2 TYR A 34 -10.804 15.205 20.675 1.00 30.21 H new ATOM 0 HE1 TYR A 34 -15.015 15.138 18.132 1.00 34.33 H new ATOM 0 HE2 TYR A 34 -12.933 15.634 21.821 1.00 44.22 H new ATOM 0 HH TYR A 34 -15.774 14.811 20.816 1.00 21.41 H new ATOM 399 N VAL A 35 -9.895 15.582 14.938 1.00 43.34 N ATOM 400 CA VAL A 35 -10.460 15.713 13.600 1.00 14.12 C ATOM 401 C VAL A 35 -10.533 14.361 12.900 1.00 54.13 C ATOM 402 O VAL A 35 -9.528 13.662 12.771 1.00 3.24 O ATOM 403 CB VAL A 35 -9.636 16.684 12.734 1.00 24.24 C ATOM 404 CG1 VAL A 35 -8.188 16.225 12.650 1.00 44.52 C ATOM 405 CG2 VAL A 35 -10.246 16.809 11.347 1.00 43.05 C ATOM 0 H VAL A 35 -9.013 15.071 14.975 1.00 43.34 H new ATOM 0 HA VAL A 35 -11.467 16.112 13.720 1.00 14.12 H new ATOM 0 HB VAL A 35 -9.654 17.668 13.203 1.00 24.24 H new ATOM 0 HG11 VAL A 35 -7.620 16.923 12.034 1.00 44.52 H new ATOM 0 HG12 VAL A 35 -7.758 16.192 13.651 1.00 44.52 H new ATOM 0 HG13 VAL A 35 -8.147 15.231 12.204 1.00 44.52 H new ATOM 0 HG21 VAL A 35 -9.651 17.499 10.749 1.00 43.05 H new ATOM 0 HG22 VAL A 35 -10.260 15.831 10.866 1.00 43.05 H new ATOM 0 HG23 VAL A 35 -11.265 17.187 11.430 1.00 43.05 H new ATOM 415 N ILE A 36 -11.729 13.999 12.448 1.00 72.22 N ATOM 416 CA ILE A 36 -11.933 12.731 11.758 1.00 21.25 C ATOM 417 C ILE A 36 -12.201 12.949 10.273 1.00 13.34 C ATOM 418 O ILE A 36 -12.975 13.828 9.895 1.00 1.40 O ATOM 419 CB ILE A 36 -13.105 11.940 12.369 1.00 25.34 C ATOM 420 CG1 ILE A 36 -12.971 11.884 13.893 1.00 74.33 C ATOM 421 CG2 ILE A 36 -13.158 10.536 11.785 1.00 2.00 C ATOM 422 CD1 ILE A 36 -14.113 11.161 14.573 1.00 51.21 C ATOM 0 H ILE A 36 -12.571 14.566 12.547 1.00 72.22 H new ATOM 0 HA ILE A 36 -11.015 12.156 11.878 1.00 21.25 H new ATOM 0 HB ILE A 36 -14.036 12.450 12.123 1.00 25.34 H new ATOM 0 HG12 ILE A 36 -12.034 11.389 14.150 1.00 74.33 H new ATOM 0 HG13 ILE A 36 -12.912 12.900 14.282 1.00 74.33 H new ATOM 0 HG21 ILE A 36 -13.991 9.989 12.227 1.00 2.00 H new ATOM 0 HG22 ILE A 36 -13.295 10.596 10.705 1.00 2.00 H new ATOM 0 HG23 ILE A 36 -12.226 10.015 12.004 1.00 2.00 H new ATOM 0 HD11 ILE A 36 -13.952 11.160 15.651 1.00 51.21 H new ATOM 0 HD12 ILE A 36 -15.051 11.668 14.347 1.00 51.21 H new ATOM 0 HD13 ILE A 36 -14.160 10.134 14.212 1.00 51.21 H new ATOM 434 N MET A 37 -11.558 12.142 9.436 1.00 21.04 N ATOM 435 CA MET A 37 -11.730 12.245 7.992 1.00 42.31 C ATOM 436 C MET A 37 -11.934 10.868 7.369 1.00 60.01 C ATOM 437 O MET A 37 -11.498 9.856 7.919 1.00 53.00 O ATOM 438 CB MET A 37 -10.516 12.929 7.360 1.00 62.11 C ATOM 439 CG MET A 37 -10.078 14.188 8.091 1.00 32.31 C ATOM 440 SD MET A 37 -8.647 13.912 9.153 1.00 51.32 S ATOM 441 CE MET A 37 -7.399 13.495 7.938 1.00 73.24 C ATOM 0 H MET A 37 -10.913 11.410 9.733 1.00 21.04 H new ATOM 0 HA MET A 37 -12.618 12.846 7.799 1.00 42.31 H new ATOM 0 HB2 MET A 37 -9.684 12.225 7.336 1.00 62.11 H new ATOM 0 HB3 MET A 37 -10.749 13.182 6.326 1.00 62.11 H new ATOM 0 HG2 MET A 37 -9.841 14.963 7.362 1.00 32.31 H new ATOM 0 HG3 MET A 37 -10.906 14.560 8.694 1.00 32.31 H new ATOM 0 HE1 MET A 37 -6.881 12.586 8.245 1.00 73.24 H new ATOM 0 HE2 MET A 37 -7.873 13.333 6.970 1.00 73.24 H new ATOM 0 HE3 MET A 37 -6.682 14.312 7.858 1.00 73.24 H new ATOM 451 N HIS A 38 -12.599 10.836 6.218 1.00 13.45 N ATOM 452 CA HIS A 38 -12.861 9.582 5.521 1.00 43.43 C ATOM 453 C HIS A 38 -12.422 9.671 4.062 1.00 21.41 C ATOM 454 O HIS A 38 -12.118 10.753 3.560 1.00 3.11 O ATOM 455 CB HIS A 38 -14.347 9.232 5.598 1.00 21.40 C ATOM 456 CG HIS A 38 -15.209 10.080 4.715 1.00 72.44 C ATOM 457 ND1 HIS A 38 -16.029 9.557 3.737 1.00 35.44 N ATOM 458 CD2 HIS A 38 -15.377 11.422 4.666 1.00 34.23 C ATOM 459 CE1 HIS A 38 -16.664 10.541 3.125 1.00 64.51 C ATOM 460 NE2 HIS A 38 -16.286 11.683 3.670 1.00 21.31 N ATOM 0 H HIS A 38 -12.966 11.664 5.749 1.00 13.45 H new ATOM 0 HA HIS A 38 -12.285 8.796 6.009 1.00 43.43 H new ATOM 0 HB2 HIS A 38 -14.480 8.185 5.324 1.00 21.40 H new ATOM 0 HB3 HIS A 38 -14.684 9.337 6.629 1.00 21.40 H new ATOM 0 HD2 HIS A 38 -14.887 12.152 5.293 1.00 34.23 H new ATOM 0 HE1 HIS A 38 -17.372 10.430 2.317 1.00 64.51 H new ATOM 0 HE2 HIS A 38 -16.616 12.609 3.396 1.00 21.31 H new ATOM 468 N ILE A 39 -12.391 8.526 3.388 1.00 30.24 N ATOM 469 CA ILE A 39 -11.990 8.475 1.988 1.00 23.31 C ATOM 470 C ILE A 39 -13.205 8.494 1.067 1.00 42.20 C ATOM 471 O ILE A 39 -13.994 7.550 1.043 1.00 73.23 O ATOM 472 CB ILE A 39 -11.152 7.218 1.688 1.00 72.40 C ATOM 473 CG1 ILE A 39 -9.907 7.184 2.577 1.00 71.54 C ATOM 474 CG2 ILE A 39 -10.762 7.180 0.218 1.00 23.30 C ATOM 475 CD1 ILE A 39 -9.070 5.937 2.396 1.00 23.20 C ATOM 0 H ILE A 39 -12.639 7.622 3.789 1.00 30.24 H new ATOM 0 HA ILE A 39 -11.382 9.360 1.802 1.00 23.31 H new ATOM 0 HB ILE A 39 -11.755 6.337 1.906 1.00 72.40 H new ATOM 0 HG12 ILE A 39 -9.293 8.059 2.362 1.00 71.54 H new ATOM 0 HG13 ILE A 39 -10.213 7.258 3.620 1.00 71.54 H new ATOM 0 HG21 ILE A 39 -10.170 6.286 0.022 1.00 23.30 H new ATOM 0 HG22 ILE A 39 -11.662 7.162 -0.397 1.00 23.30 H new ATOM 0 HG23 ILE A 39 -10.174 8.065 -0.025 1.00 23.30 H new ATOM 0 HD11 ILE A 39 -8.204 5.981 3.057 1.00 23.20 H new ATOM 0 HD12 ILE A 39 -9.668 5.059 2.639 1.00 23.20 H new ATOM 0 HD13 ILE A 39 -8.734 5.872 1.361 1.00 23.20 H new ATOM 487 N VAL A 40 -13.348 9.576 0.308 1.00 11.21 N ATOM 488 CA VAL A 40 -14.465 9.718 -0.618 1.00 15.13 C ATOM 489 C VAL A 40 -14.055 9.339 -2.036 1.00 51.43 C ATOM 490 O VAL A 40 -12.923 9.586 -2.453 1.00 31.02 O ATOM 491 CB VAL A 40 -15.013 11.158 -0.620 1.00 62.24 C ATOM 492 CG1 VAL A 40 -14.011 12.109 -1.256 1.00 45.11 C ATOM 493 CG2 VAL A 40 -16.350 11.218 -1.343 1.00 61.44 C ATOM 0 H VAL A 40 -12.704 10.367 0.316 1.00 11.21 H new ATOM 0 HA VAL A 40 -15.247 9.040 -0.276 1.00 15.13 H new ATOM 0 HB VAL A 40 -15.170 11.470 0.412 1.00 62.24 H new ATOM 0 HG11 VAL A 40 -14.415 13.121 -1.249 1.00 45.11 H new ATOM 0 HG12 VAL A 40 -13.079 12.086 -0.692 1.00 45.11 H new ATOM 0 HG13 VAL A 40 -13.820 11.802 -2.284 1.00 45.11 H new ATOM 0 HG21 VAL A 40 -16.722 12.242 -1.335 1.00 61.44 H new ATOM 0 HG22 VAL A 40 -16.222 10.887 -2.373 1.00 61.44 H new ATOM 0 HG23 VAL A 40 -17.065 10.568 -0.839 1.00 61.44 H new ATOM 503 N ASP A 41 -14.983 8.740 -2.774 1.00 64.52 N ATOM 504 CA ASP A 41 -14.718 8.328 -4.148 1.00 74.30 C ATOM 505 C ASP A 41 -13.543 7.357 -4.208 1.00 33.22 C ATOM 506 O ASP A 41 -12.921 7.186 -5.255 1.00 62.34 O ATOM 507 CB ASP A 41 -14.432 9.549 -5.023 1.00 40.00 C ATOM 508 CG ASP A 41 -15.109 9.463 -6.377 1.00 23.21 C ATOM 509 OD1 ASP A 41 -16.236 8.930 -6.443 1.00 40.03 O ATOM 510 OD2 ASP A 41 -14.511 9.927 -7.370 1.00 43.42 O ATOM 0 H ASP A 41 -15.925 8.529 -2.444 1.00 64.52 H new ATOM 0 HA ASP A 41 -15.605 7.820 -4.526 1.00 74.30 H new ATOM 0 HB2 ASP A 41 -14.769 10.448 -4.508 1.00 40.00 H new ATOM 0 HB3 ASP A 41 -13.356 9.647 -5.164 1.00 40.00 H new ATOM 515 N GLN A 42 -13.246 6.725 -3.077 1.00 0.23 N ATOM 516 CA GLN A 42 -12.144 5.773 -3.001 1.00 13.10 C ATOM 517 C GLN A 42 -10.950 6.256 -3.818 1.00 12.04 C ATOM 518 O GLN A 42 -10.307 5.475 -4.519 1.00 71.20 O ATOM 519 CB GLN A 42 -12.595 4.399 -3.498 1.00 71.44 C ATOM 520 CG GLN A 42 -13.001 4.385 -4.963 1.00 64.25 C ATOM 521 CD GLN A 42 -13.011 2.988 -5.553 1.00 44.21 C ATOM 522 OE1 GLN A 42 -12.144 2.633 -6.353 1.00 11.33 O ATOM 523 NE2 GLN A 42 -13.994 2.187 -5.161 1.00 22.45 N ATOM 0 H GLN A 42 -13.753 6.855 -2.201 1.00 0.23 H new ATOM 0 HA GLN A 42 -11.838 5.692 -1.958 1.00 13.10 H new ATOM 0 HB2 GLN A 42 -11.786 3.684 -3.347 1.00 71.44 H new ATOM 0 HB3 GLN A 42 -13.437 4.061 -2.893 1.00 71.44 H new ATOM 0 HG2 GLN A 42 -13.993 4.826 -5.065 1.00 64.25 H new ATOM 0 HG3 GLN A 42 -12.314 5.011 -5.532 1.00 64.25 H new ATOM 0 HE21 GLN A 42 -14.691 2.523 -4.496 1.00 22.45 H new ATOM 0 HE22 GLN A 42 -14.052 1.236 -5.524 1.00 22.45 H new ATOM 532 N LYS A 43 -10.659 7.549 -3.722 1.00 63.15 N ATOM 533 CA LYS A 43 -9.541 8.137 -4.451 1.00 54.42 C ATOM 534 C LYS A 43 -9.072 9.424 -3.781 1.00 1.54 C ATOM 535 O LYS A 43 -7.874 9.701 -3.716 1.00 71.14 O ATOM 536 CB LYS A 43 -9.944 8.422 -5.900 1.00 10.21 C ATOM 537 CG LYS A 43 -8.822 8.197 -6.899 1.00 10.04 C ATOM 538 CD LYS A 43 -9.252 8.556 -8.311 1.00 11.20 C ATOM 539 CE LYS A 43 -8.093 9.114 -9.122 1.00 5.11 C ATOM 540 NZ LYS A 43 -8.562 9.989 -10.232 1.00 30.12 N ATOM 0 H LYS A 43 -11.182 8.210 -3.147 1.00 63.15 H new ATOM 0 HA LYS A 43 -8.718 7.422 -4.443 1.00 54.42 H new ATOM 0 HB2 LYS A 43 -10.788 7.786 -6.165 1.00 10.21 H new ATOM 0 HB3 LYS A 43 -10.286 9.454 -5.977 1.00 10.21 H new ATOM 0 HG2 LYS A 43 -7.957 8.798 -6.617 1.00 10.04 H new ATOM 0 HG3 LYS A 43 -8.509 7.153 -6.867 1.00 10.04 H new ATOM 0 HD2 LYS A 43 -9.652 7.671 -8.807 1.00 11.20 H new ATOM 0 HD3 LYS A 43 -10.057 9.290 -8.272 1.00 11.20 H new ATOM 0 HE2 LYS A 43 -7.432 9.681 -8.467 1.00 5.11 H new ATOM 0 HE3 LYS A 43 -7.507 8.291 -9.531 1.00 5.11 H new ATOM 0 HZ1 LYS A 43 -7.742 10.349 -10.760 1.00 30.12 H new ATOM 0 HZ2 LYS A 43 -9.173 9.441 -10.871 1.00 30.12 H new ATOM 0 HZ3 LYS A 43 -9.100 10.789 -9.840 1.00 30.12 H new ATOM 554 N SER A 44 -10.023 10.207 -3.281 1.00 50.21 N ATOM 555 CA SER A 44 -9.706 11.466 -2.617 1.00 54.21 C ATOM 556 C SER A 44 -10.113 11.422 -1.147 1.00 44.31 C ATOM 557 O SER A 44 -11.054 10.723 -0.773 1.00 34.11 O ATOM 558 CB SER A 44 -10.412 12.629 -3.318 1.00 60.53 C ATOM 559 OG SER A 44 -10.356 12.484 -4.727 1.00 32.21 O ATOM 0 H SER A 44 -11.019 9.992 -3.323 1.00 50.21 H new ATOM 0 HA SER A 44 -8.628 11.617 -2.674 1.00 54.21 H new ATOM 0 HB2 SER A 44 -11.452 12.675 -2.995 1.00 60.53 H new ATOM 0 HB3 SER A 44 -9.946 13.570 -3.027 1.00 60.53 H new ATOM 0 HG SER A 44 -10.815 13.238 -5.152 1.00 32.21 H new ATOM 565 N ILE A 45 -9.395 12.174 -0.319 1.00 13.10 N ATOM 566 CA ILE A 45 -9.681 12.222 1.110 1.00 41.35 C ATOM 567 C ILE A 45 -10.412 13.508 1.481 1.00 41.01 C ATOM 568 O ILE A 45 -9.995 14.602 1.103 1.00 41.41 O ATOM 569 CB ILE A 45 -8.391 12.118 1.945 1.00 15.53 C ATOM 570 CG1 ILE A 45 -7.587 10.885 1.531 1.00 72.50 C ATOM 571 CG2 ILE A 45 -8.725 12.067 3.429 1.00 64.32 C ATOM 572 CD1 ILE A 45 -6.213 10.820 2.160 1.00 32.42 C ATOM 0 H ILE A 45 -8.612 12.758 -0.613 1.00 13.10 H new ATOM 0 HA ILE A 45 -10.319 11.367 1.334 1.00 41.35 H new ATOM 0 HB ILE A 45 -7.782 13.003 1.759 1.00 15.53 H new ATOM 0 HG12 ILE A 45 -8.145 9.989 1.803 1.00 72.50 H new ATOM 0 HG13 ILE A 45 -7.482 10.877 0.446 1.00 72.50 H new ATOM 0 HG21 ILE A 45 -7.804 11.994 4.007 1.00 64.32 H new ATOM 0 HG22 ILE A 45 -9.260 12.973 3.713 1.00 64.32 H new ATOM 0 HG23 ILE A 45 -9.351 11.198 3.631 1.00 64.32 H new ATOM 0 HD11 ILE A 45 -5.700 9.920 1.822 1.00 32.42 H new ATOM 0 HD12 ILE A 45 -5.637 11.698 1.867 1.00 32.42 H new ATOM 0 HD13 ILE A 45 -6.310 10.796 3.245 1.00 32.42 H new ATOM 584 N ALA A 46 -11.504 13.368 2.225 1.00 20.51 N ATOM 585 CA ALA A 46 -12.291 14.518 2.651 1.00 32.23 C ATOM 586 C ALA A 46 -12.775 14.350 4.088 1.00 51.14 C ATOM 587 O ALA A 46 -12.995 13.232 4.553 1.00 63.42 O ATOM 588 CB ALA A 46 -13.473 14.725 1.715 1.00 5.11 C ATOM 0 H ALA A 46 -11.864 12.469 2.545 1.00 20.51 H new ATOM 0 HA ALA A 46 -11.651 15.400 2.611 1.00 32.23 H new ATOM 0 HB1 ALA A 46 -14.052 15.587 2.045 1.00 5.11 H new ATOM 0 HB2 ALA A 46 -13.109 14.899 0.702 1.00 5.11 H new ATOM 0 HB3 ALA A 46 -14.106 13.837 1.726 1.00 5.11 H new ATOM 594 N VAL A 47 -12.939 15.469 4.787 1.00 60.15 N ATOM 595 CA VAL A 47 -13.397 15.446 6.170 1.00 34.44 C ATOM 596 C VAL A 47 -14.855 15.008 6.259 1.00 12.21 C ATOM 597 O VAL A 47 -15.690 15.422 5.454 1.00 4.41 O ATOM 598 CB VAL A 47 -13.246 16.827 6.835 1.00 21.32 C ATOM 599 CG1 VAL A 47 -11.780 17.223 6.915 1.00 25.14 C ATOM 600 CG2 VAL A 47 -14.049 17.873 6.077 1.00 2.24 C ATOM 0 H VAL A 47 -12.761 16.403 4.417 1.00 60.15 H new ATOM 0 HA VAL A 47 -12.771 14.727 6.698 1.00 34.44 H new ATOM 0 HB VAL A 47 -13.637 16.767 7.851 1.00 21.32 H new ATOM 0 HG11 VAL A 47 -11.693 18.201 7.388 1.00 25.14 H new ATOM 0 HG12 VAL A 47 -11.235 16.485 7.504 1.00 25.14 H new ATOM 0 HG13 VAL A 47 -11.360 17.267 5.910 1.00 25.14 H new ATOM 0 HG21 VAL A 47 -13.931 18.843 6.560 1.00 2.24 H new ATOM 0 HG22 VAL A 47 -13.690 17.933 5.050 1.00 2.24 H new ATOM 0 HG23 VAL A 47 -15.103 17.593 6.077 1.00 2.24 H new ATOM 610 N LYS A 48 -15.156 14.168 7.244 1.00 52.33 N ATOM 611 CA LYS A 48 -16.514 13.675 7.441 1.00 61.44 C ATOM 612 C LYS A 48 -17.165 14.341 8.649 1.00 71.54 C ATOM 613 O LYS A 48 -18.336 14.721 8.606 1.00 63.33 O ATOM 614 CB LYS A 48 -16.504 12.156 7.626 1.00 75.52 C ATOM 615 CG LYS A 48 -17.654 11.450 6.927 1.00 50.40 C ATOM 616 CD LYS A 48 -17.527 9.940 7.030 1.00 30.23 C ATOM 617 CE LYS A 48 -18.613 9.348 7.916 1.00 2.42 C ATOM 618 NZ LYS A 48 -19.842 9.019 7.142 1.00 24.43 N ATOM 0 H LYS A 48 -14.477 13.814 7.918 1.00 52.33 H new ATOM 0 HA LYS A 48 -17.097 13.923 6.554 1.00 61.44 H new ATOM 0 HB2 LYS A 48 -15.562 11.759 7.249 1.00 75.52 H new ATOM 0 HB3 LYS A 48 -16.542 11.928 8.691 1.00 75.52 H new ATOM 0 HG2 LYS A 48 -18.599 11.767 7.368 1.00 50.40 H new ATOM 0 HG3 LYS A 48 -17.678 11.743 5.877 1.00 50.40 H new ATOM 0 HD2 LYS A 48 -17.588 9.500 6.035 1.00 30.23 H new ATOM 0 HD3 LYS A 48 -16.547 9.683 7.433 1.00 30.23 H new ATOM 0 HE2 LYS A 48 -18.236 8.447 8.399 1.00 2.42 H new ATOM 0 HE3 LYS A 48 -18.861 10.055 8.708 1.00 2.42 H new ATOM 0 HZ1 LYS A 48 -20.558 8.618 7.781 1.00 24.43 H new ATOM 0 HZ2 LYS A 48 -20.216 9.883 6.701 1.00 24.43 H new ATOM 0 HZ3 LYS A 48 -19.611 8.325 6.402 1.00 24.43 H new ATOM 632 N THR A 49 -16.399 14.480 9.726 1.00 11.42 N ATOM 633 CA THR A 49 -16.901 15.101 10.946 1.00 72.34 C ATOM 634 C THR A 49 -15.756 15.557 11.842 1.00 20.24 C ATOM 635 O THR A 49 -15.049 14.736 12.427 1.00 22.14 O ATOM 636 CB THR A 49 -17.804 14.135 11.736 1.00 11.23 C ATOM 637 OG1 THR A 49 -18.954 13.789 10.956 1.00 44.23 O ATOM 638 CG2 THR A 49 -18.247 14.762 13.050 1.00 62.30 C ATOM 0 H THR A 49 -15.428 14.171 9.779 1.00 11.42 H new ATOM 0 HA THR A 49 -17.487 15.968 10.642 1.00 72.34 H new ATOM 0 HB THR A 49 -17.230 13.234 11.955 1.00 11.23 H new ATOM 0 HG1 THR A 49 -19.022 14.394 10.188 1.00 44.23 H new ATOM 0 HG21 THR A 49 -18.884 14.062 13.591 1.00 62.30 H new ATOM 0 HG22 THR A 49 -17.371 14.997 13.654 1.00 62.30 H new ATOM 0 HG23 THR A 49 -18.804 15.677 12.847 1.00 62.30 H new ATOM 646 N ILE A 50 -15.579 16.870 11.947 1.00 71.54 N ATOM 647 CA ILE A 50 -14.520 17.434 12.774 1.00 32.22 C ATOM 648 C ILE A 50 -15.049 17.832 14.148 1.00 54.43 C ATOM 649 O ILE A 50 -16.194 18.262 14.283 1.00 73.22 O ATOM 650 CB ILE A 50 -13.879 18.665 12.106 1.00 33.34 C ATOM 651 CG1 ILE A 50 -12.620 19.086 12.866 1.00 2.41 C ATOM 652 CG2 ILE A 50 -14.876 19.812 12.044 1.00 41.51 C ATOM 653 CD1 ILE A 50 -11.787 20.114 12.132 1.00 14.44 C ATOM 0 H ILE A 50 -16.156 17.563 11.469 1.00 71.54 H new ATOM 0 HA ILE A 50 -13.763 16.659 12.890 1.00 32.22 H new ATOM 0 HB ILE A 50 -13.594 18.402 11.087 1.00 33.34 H new ATOM 0 HG12 ILE A 50 -12.909 19.490 13.836 1.00 2.41 H new ATOM 0 HG13 ILE A 50 -12.009 18.204 13.057 1.00 2.41 H new ATOM 0 HG21 ILE A 50 -14.409 20.675 11.569 1.00 41.51 H new ATOM 0 HG22 ILE A 50 -15.747 19.506 11.464 1.00 41.51 H new ATOM 0 HG23 ILE A 50 -15.188 20.078 13.054 1.00 41.51 H new ATOM 0 HD11 ILE A 50 -10.911 20.366 12.729 1.00 14.44 H new ATOM 0 HD12 ILE A 50 -11.468 19.706 11.173 1.00 14.44 H new ATOM 0 HD13 ILE A 50 -12.382 21.012 11.964 1.00 14.44 H new ATOM 665 N GLY A 51 -14.206 17.689 15.166 1.00 60.34 N ATOM 666 CA GLY A 51 -14.606 18.040 16.516 1.00 70.34 C ATOM 667 C GLY A 51 -13.997 19.348 16.979 1.00 54.41 C ATOM 668 O GLY A 51 -13.343 20.044 16.203 1.00 1.23 O ATOM 0 H GLY A 51 -13.253 17.336 15.080 1.00 60.34 H new ATOM 0 HA2 GLY A 51 -15.693 18.112 16.563 1.00 70.34 H new ATOM 0 HA3 GLY A 51 -14.310 17.243 17.198 1.00 70.34 H new ATOM 672 N GLU A 52 -14.215 19.685 18.247 1.00 60.44 N ATOM 673 CA GLU A 52 -13.684 20.920 18.810 1.00 15.43 C ATOM 674 C GLU A 52 -14.061 21.052 20.283 1.00 2.03 C ATOM 675 O GLU A 52 -14.640 22.055 20.699 1.00 14.25 O ATOM 676 CB GLU A 52 -14.206 22.128 18.029 1.00 11.44 C ATOM 677 CG GLU A 52 -15.715 22.130 17.847 1.00 64.12 C ATOM 678 CD GLU A 52 -16.322 23.508 18.025 1.00 74.33 C ATOM 679 OE1 GLU A 52 -16.488 23.937 19.186 1.00 75.31 O ATOM 680 OE2 GLU A 52 -16.632 24.157 17.004 1.00 71.52 O ATOM 0 H GLU A 52 -14.755 19.120 18.902 1.00 60.44 H new ATOM 0 HA GLU A 52 -12.597 20.887 18.732 1.00 15.43 H new ATOM 0 HB2 GLU A 52 -13.910 23.040 18.547 1.00 11.44 H new ATOM 0 HB3 GLU A 52 -13.730 22.149 17.049 1.00 11.44 H new ATOM 0 HG2 GLU A 52 -15.958 21.756 16.852 1.00 64.12 H new ATOM 0 HG3 GLU A 52 -16.165 21.444 18.564 1.00 64.12 H new ATOM 687 N ARG A 53 -13.727 20.031 21.067 1.00 53.54 N ATOM 688 CA ARG A 53 -14.031 20.032 22.492 1.00 33.44 C ATOM 689 C ARG A 53 -15.538 20.094 22.727 1.00 2.21 C ATOM 690 O ARG A 53 -15.993 20.435 23.818 1.00 2.20 O ATOM 691 CB ARG A 53 -13.347 21.214 23.181 1.00 35.13 C ATOM 692 CG ARG A 53 -11.898 21.405 22.767 1.00 24.31 C ATOM 693 CD ARG A 53 -11.257 22.571 23.503 1.00 42.10 C ATOM 694 NE ARG A 53 -9.801 22.462 23.539 1.00 1.01 N ATOM 695 CZ ARG A 53 -9.146 21.630 24.341 1.00 20.12 C ATOM 696 NH1 ARG A 53 -9.814 20.838 25.169 1.00 40.23 N ATOM 697 NH2 ARG A 53 -7.820 21.588 24.316 1.00 1.40 N ATOM 0 H ARG A 53 -13.246 19.194 20.739 1.00 53.54 H new ATOM 0 HA ARG A 53 -13.652 19.103 22.919 1.00 33.44 H new ATOM 0 HB2 ARG A 53 -13.903 22.125 22.958 1.00 35.13 H new ATOM 0 HB3 ARG A 53 -13.392 21.070 24.260 1.00 35.13 H new ATOM 0 HG2 ARG A 53 -11.337 20.493 22.970 1.00 24.31 H new ATOM 0 HG3 ARG A 53 -11.845 21.579 21.692 1.00 24.31 H new ATOM 0 HD2 ARG A 53 -11.539 23.505 23.017 1.00 42.10 H new ATOM 0 HD3 ARG A 53 -11.643 22.613 24.522 1.00 42.10 H new ATOM 0 HE ARG A 53 -9.257 23.057 22.914 1.00 1.01 H new ATOM 0 HH11 ARG A 53 -10.833 20.867 25.191 1.00 40.23 H new ATOM 0 HH12 ARG A 53 -9.308 20.200 25.784 1.00 40.23 H new ATOM 0 HH21 ARG A 53 -7.302 22.195 23.680 1.00 1.40 H new ATOM 0 HH22 ARG A 53 -7.318 20.949 24.932 1.00 1.40 H new ATOM 711 N GLY A 54 -16.307 19.763 21.694 1.00 21.12 N ATOM 712 CA GLY A 54 -17.753 19.789 21.808 1.00 34.31 C ATOM 713 C GLY A 54 -18.396 18.501 21.332 1.00 65.13 C ATOM 714 O GLY A 54 -19.412 18.069 21.874 1.00 73.01 O ATOM 0 H GLY A 54 -15.954 19.477 20.781 1.00 21.12 H new ATOM 0 HA2 GLY A 54 -18.029 19.967 22.847 1.00 34.31 H new ATOM 0 HA3 GLY A 54 -18.145 20.624 21.227 1.00 34.31 H new ATOM 718 N ALA A 55 -17.802 17.887 20.314 1.00 63.33 N ATOM 719 CA ALA A 55 -18.322 16.641 19.765 1.00 71.34 C ATOM 720 C ALA A 55 -18.551 15.609 20.864 1.00 10.54 C ATOM 721 O ALA A 55 -17.674 15.367 21.693 1.00 74.45 O ATOM 722 CB ALA A 55 -17.371 16.090 18.712 1.00 55.32 C ATOM 0 H ALA A 55 -16.960 18.232 19.853 1.00 63.33 H new ATOM 0 HA ALA A 55 -19.283 16.854 19.296 1.00 71.34 H new ATOM 0 HB1 ALA A 55 -17.772 15.159 18.311 1.00 55.32 H new ATOM 0 HB2 ALA A 55 -17.261 16.815 17.906 1.00 55.32 H new ATOM 0 HB3 ALA A 55 -16.398 15.900 19.164 1.00 55.32 H new ATOM 728 N ASN A 56 -19.735 15.006 20.866 1.00 14.34 N ATOM 729 CA ASN A 56 -20.080 14.002 21.866 1.00 62.31 C ATOM 730 C ASN A 56 -19.682 12.606 21.394 1.00 3.44 C ATOM 731 O ASN A 56 -19.279 12.419 20.246 1.00 23.22 O ATOM 732 CB ASN A 56 -21.580 14.043 22.165 1.00 62.34 C ATOM 733 CG ASN A 56 -21.958 15.202 23.065 1.00 15.53 C ATOM 734 OD1 ASN A 56 -21.435 16.308 22.925 1.00 15.12 O ATOM 735 ND2 ASN A 56 -22.872 14.954 23.997 1.00 50.44 N ATOM 0 H ASN A 56 -20.472 15.195 20.186 1.00 14.34 H new ATOM 0 HA ASN A 56 -19.529 14.229 22.778 1.00 62.31 H new ATOM 0 HB2 ASN A 56 -22.132 14.119 21.228 1.00 62.34 H new ATOM 0 HB3 ASN A 56 -21.879 13.107 22.637 1.00 62.34 H new ATOM 0 HD21 ASN A 56 -23.167 15.695 24.632 1.00 50.44 H new ATOM 0 HD22 ASN A 56 -23.279 14.022 24.077 1.00 50.44 H new ATOM 742 N PHE A 57 -19.798 11.630 22.288 1.00 12.14 N ATOM 743 CA PHE A 57 -19.450 10.251 21.964 1.00 13.45 C ATOM 744 C PHE A 57 -20.450 9.656 20.978 1.00 72.33 C ATOM 745 O PHE A 57 -20.071 8.945 20.047 1.00 74.52 O ATOM 746 CB PHE A 57 -19.404 9.402 23.237 1.00 54.45 C ATOM 747 CG PHE A 57 -18.541 9.988 24.317 1.00 65.50 C ATOM 748 CD1 PHE A 57 -17.187 10.196 24.104 1.00 74.25 C ATOM 749 CD2 PHE A 57 -19.082 10.330 25.546 1.00 65.33 C ATOM 750 CE1 PHE A 57 -16.390 10.733 25.096 1.00 12.33 C ATOM 751 CE2 PHE A 57 -18.289 10.868 26.542 1.00 13.13 C ATOM 752 CZ PHE A 57 -16.942 11.071 26.317 1.00 40.03 C ATOM 0 H PHE A 57 -20.130 11.768 23.242 1.00 12.14 H new ATOM 0 HA PHE A 57 -18.464 10.250 21.499 1.00 13.45 H new ATOM 0 HB2 PHE A 57 -20.417 9.279 23.619 1.00 54.45 H new ATOM 0 HB3 PHE A 57 -19.035 8.407 22.988 1.00 54.45 H new ATOM 0 HD1 PHE A 57 -16.750 9.935 23.151 1.00 74.25 H new ATOM 0 HD2 PHE A 57 -20.135 10.174 25.728 1.00 65.33 H new ATOM 0 HE1 PHE A 57 -15.336 10.889 24.918 1.00 12.33 H new ATOM 0 HE2 PHE A 57 -18.723 11.129 27.496 1.00 13.13 H new ATOM 0 HZ PHE A 57 -16.321 11.493 27.093 1.00 40.03 H new ATOM 762 N ASP A 58 -21.728 9.951 21.189 1.00 70.10 N ATOM 763 CA ASP A 58 -22.783 9.446 20.319 1.00 75.43 C ATOM 764 C ASP A 58 -22.545 9.869 18.873 1.00 64.23 C ATOM 765 O ASP A 58 -22.642 9.055 17.954 1.00 2.34 O ATOM 766 CB ASP A 58 -24.148 9.949 20.792 1.00 73.34 C ATOM 767 CG ASP A 58 -24.618 9.250 22.052 1.00 3.05 C ATOM 768 OD1 ASP A 58 -24.193 8.099 22.286 1.00 34.24 O ATOM 769 OD2 ASP A 58 -25.409 9.855 22.806 1.00 62.22 O ATOM 0 H ASP A 58 -22.058 10.538 21.955 1.00 70.10 H new ATOM 0 HA ASP A 58 -22.769 8.357 20.367 1.00 75.43 H new ATOM 0 HB2 ASP A 58 -24.093 11.022 20.974 1.00 73.34 H new ATOM 0 HB3 ASP A 58 -24.882 9.797 20.001 1.00 73.34 H new ATOM 774 N GLN A 59 -22.233 11.146 18.679 1.00 0.31 N ATOM 775 CA GLN A 59 -21.982 11.677 17.344 1.00 13.24 C ATOM 776 C GLN A 59 -20.739 11.042 16.731 1.00 42.32 C ATOM 777 O GLN A 59 -20.684 10.799 15.525 1.00 2.30 O ATOM 778 CB GLN A 59 -21.819 13.197 17.399 1.00 12.15 C ATOM 779 CG GLN A 59 -23.037 13.920 17.951 1.00 12.23 C ATOM 780 CD GLN A 59 -24.223 13.870 17.008 1.00 44.43 C ATOM 781 OE1 GLN A 59 -24.883 12.840 16.876 1.00 33.43 O ATOM 782 NE2 GLN A 59 -24.499 14.987 16.344 1.00 1.04 N ATOM 0 H GLN A 59 -22.148 11.832 19.429 1.00 0.31 H new ATOM 0 HA GLN A 59 -22.839 11.433 16.716 1.00 13.24 H new ATOM 0 HB2 GLN A 59 -20.953 13.439 18.015 1.00 12.15 H new ATOM 0 HB3 GLN A 59 -21.610 13.568 16.396 1.00 12.15 H new ATOM 0 HG2 GLN A 59 -23.318 13.474 18.905 1.00 12.23 H new ATOM 0 HG3 GLN A 59 -22.779 14.960 18.149 1.00 12.23 H new ATOM 0 HE21 GLN A 59 -23.925 15.819 16.484 1.00 1.04 H new ATOM 0 HE22 GLN A 59 -25.285 15.013 15.694 1.00 1.04 H new ATOM 791 N PHE A 60 -19.742 10.776 17.568 1.00 2.31 N ATOM 792 CA PHE A 60 -18.498 10.171 17.108 1.00 64.33 C ATOM 793 C PHE A 60 -18.749 8.778 16.537 1.00 12.10 C ATOM 794 O PHE A 60 -18.319 8.464 15.427 1.00 70.12 O ATOM 795 CB PHE A 60 -17.490 10.089 18.256 1.00 2.21 C ATOM 796 CG PHE A 60 -16.290 9.243 17.941 1.00 24.24 C ATOM 797 CD1 PHE A 60 -15.643 9.361 16.722 1.00 63.21 C ATOM 798 CD2 PHE A 60 -15.809 8.329 18.865 1.00 63.41 C ATOM 799 CE1 PHE A 60 -14.538 8.584 16.429 1.00 23.41 C ATOM 800 CE2 PHE A 60 -14.704 7.549 18.578 1.00 10.20 C ATOM 801 CZ PHE A 60 -14.068 7.676 17.358 1.00 35.13 C ATOM 0 H PHE A 60 -19.771 10.970 18.569 1.00 2.31 H new ATOM 0 HA PHE A 60 -18.088 10.800 16.318 1.00 64.33 H new ATOM 0 HB2 PHE A 60 -17.158 11.096 18.510 1.00 2.21 H new ATOM 0 HB3 PHE A 60 -17.988 9.685 19.138 1.00 2.21 H new ATOM 0 HD1 PHE A 60 -16.006 10.069 15.992 1.00 63.21 H new ATOM 0 HD2 PHE A 60 -16.303 8.225 19.820 1.00 63.41 H new ATOM 0 HE1 PHE A 60 -14.043 8.687 15.475 1.00 23.41 H new ATOM 0 HE2 PHE A 60 -14.338 6.841 19.307 1.00 10.20 H new ATOM 0 HZ PHE A 60 -13.205 7.067 17.131 1.00 35.13 H new ATOM 811 N ILE A 61 -19.448 7.948 17.304 1.00 2.23 N ATOM 812 CA ILE A 61 -19.757 6.590 16.876 1.00 71.15 C ATOM 813 C ILE A 61 -20.655 6.594 15.643 1.00 61.50 C ATOM 814 O ILE A 61 -20.455 5.809 14.716 1.00 54.41 O ATOM 815 CB ILE A 61 -20.446 5.789 17.996 1.00 21.12 C ATOM 816 CG1 ILE A 61 -19.556 5.741 19.240 1.00 64.34 C ATOM 817 CG2 ILE A 61 -20.773 4.382 17.518 1.00 51.35 C ATOM 818 CD1 ILE A 61 -20.173 4.985 20.396 1.00 41.52 C ATOM 0 H ILE A 61 -19.811 8.193 18.225 1.00 2.23 H new ATOM 0 HA ILE A 61 -18.808 6.113 16.631 1.00 71.15 H new ATOM 0 HB ILE A 61 -21.379 6.288 18.258 1.00 21.12 H new ATOM 0 HG12 ILE A 61 -18.605 5.276 18.979 1.00 64.34 H new ATOM 0 HG13 ILE A 61 -19.336 6.760 19.559 1.00 64.34 H new ATOM 0 HG21 ILE A 61 -21.260 3.829 18.321 1.00 51.35 H new ATOM 0 HG22 ILE A 61 -21.441 4.436 16.658 1.00 51.35 H new ATOM 0 HG23 ILE A 61 -19.853 3.872 17.232 1.00 51.35 H new ATOM 0 HD11 ILE A 61 -19.487 4.992 21.243 1.00 41.52 H new ATOM 0 HD12 ILE A 61 -21.110 5.462 20.684 1.00 41.52 H new ATOM 0 HD13 ILE A 61 -20.368 3.956 20.095 1.00 41.52 H new ATOM 830 N GLU A 62 -21.643 7.483 15.640 1.00 70.11 N ATOM 831 CA GLU A 62 -22.571 7.589 14.520 1.00 21.10 C ATOM 832 C GLU A 62 -21.831 7.937 13.232 1.00 71.05 C ATOM 833 O GLU A 62 -22.139 7.407 12.164 1.00 3.23 O ATOM 834 CB GLU A 62 -23.637 8.647 14.811 1.00 51.23 C ATOM 835 CG GLU A 62 -24.761 8.150 15.705 1.00 63.25 C ATOM 836 CD GLU A 62 -25.782 7.321 14.951 1.00 74.04 C ATOM 837 OE1 GLU A 62 -26.490 7.888 14.092 1.00 34.24 O ATOM 838 OE2 GLU A 62 -25.873 6.105 15.219 1.00 34.42 O ATOM 0 H GLU A 62 -21.821 8.140 16.400 1.00 70.11 H new ATOM 0 HA GLU A 62 -23.056 6.622 14.390 1.00 21.10 H new ATOM 0 HB2 GLU A 62 -23.163 9.508 15.282 1.00 51.23 H new ATOM 0 HB3 GLU A 62 -24.060 8.993 13.868 1.00 51.23 H new ATOM 0 HG2 GLU A 62 -24.340 7.553 16.514 1.00 63.25 H new ATOM 0 HG3 GLU A 62 -25.259 9.004 16.165 1.00 63.25 H new ATOM 845 N ALA A 63 -20.855 8.832 13.340 1.00 23.02 N ATOM 846 CA ALA A 63 -20.070 9.250 12.185 1.00 1.33 C ATOM 847 C ALA A 63 -19.184 8.115 11.683 1.00 10.22 C ATOM 848 O ALA A 63 -19.223 7.760 10.505 1.00 61.21 O ATOM 849 CB ALA A 63 -19.225 10.467 12.534 1.00 73.12 C ATOM 0 H ALA A 63 -20.589 9.282 14.216 1.00 23.02 H new ATOM 0 HA ALA A 63 -20.760 9.517 11.385 1.00 1.33 H new ATOM 0 HB1 ALA A 63 -18.644 10.768 11.663 1.00 73.12 H new ATOM 0 HB2 ALA A 63 -19.876 11.287 12.837 1.00 73.12 H new ATOM 0 HB3 ALA A 63 -18.549 10.218 13.352 1.00 73.12 H new ATOM 855 N ILE A 64 -18.386 7.551 12.584 1.00 74.23 N ATOM 856 CA ILE A 64 -17.491 6.456 12.231 1.00 34.31 C ATOM 857 C ILE A 64 -18.269 5.167 11.988 1.00 31.32 C ATOM 858 O ILE A 64 -19.027 4.715 12.847 1.00 2.52 O ATOM 859 CB ILE A 64 -16.442 6.210 13.331 1.00 33.54 C ATOM 860 CG1 ILE A 64 -17.130 5.933 14.670 1.00 54.51 C ATOM 861 CG2 ILE A 64 -15.506 7.403 13.447 1.00 11.12 C ATOM 862 CD1 ILE A 64 -16.973 4.507 15.147 1.00 20.23 C ATOM 0 H ILE A 64 -18.341 7.834 13.563 1.00 74.23 H new ATOM 0 HA ILE A 64 -16.981 6.748 11.313 1.00 34.31 H new ATOM 0 HB ILE A 64 -15.851 5.335 13.060 1.00 33.54 H new ATOM 0 HG12 ILE A 64 -16.723 6.607 15.424 1.00 54.51 H new ATOM 0 HG13 ILE A 64 -18.192 6.162 14.578 1.00 54.51 H new ATOM 0 HG21 ILE A 64 -14.770 7.214 14.229 1.00 11.12 H new ATOM 0 HG22 ILE A 64 -14.994 7.558 12.497 1.00 11.12 H new ATOM 0 HG23 ILE A 64 -16.081 8.294 13.698 1.00 11.12 H new ATOM 0 HD11 ILE A 64 -17.486 4.384 16.101 1.00 20.23 H new ATOM 0 HD12 ILE A 64 -17.406 3.828 14.412 1.00 20.23 H new ATOM 0 HD13 ILE A 64 -15.914 4.280 15.272 1.00 20.23 H new ATOM 874 N ASP A 65 -18.075 4.578 10.813 1.00 21.34 N ATOM 875 CA ASP A 65 -18.756 3.338 10.458 1.00 43.12 C ATOM 876 C ASP A 65 -17.749 2.234 10.152 1.00 61.40 C ATOM 877 O ASP A 65 -16.896 2.381 9.276 1.00 74.42 O ATOM 878 CB ASP A 65 -19.669 3.561 9.251 1.00 32.14 C ATOM 879 CG ASP A 65 -21.130 3.666 9.643 1.00 40.40 C ATOM 880 OD1 ASP A 65 -21.704 2.644 10.072 1.00 31.10 O ATOM 881 OD2 ASP A 65 -21.699 4.771 9.520 1.00 55.24 O ATOM 0 H ASP A 65 -17.452 4.939 10.090 1.00 21.34 H new ATOM 0 HA ASP A 65 -19.361 3.027 11.310 1.00 43.12 H new ATOM 0 HB2 ASP A 65 -19.368 4.472 8.735 1.00 32.14 H new ATOM 0 HB3 ASP A 65 -19.543 2.739 8.547 1.00 32.14 H new ATOM 886 N LYS A 66 -17.852 1.127 10.881 1.00 54.43 N ATOM 887 CA LYS A 66 -16.952 -0.003 10.688 1.00 22.15 C ATOM 888 C LYS A 66 -17.137 -0.617 9.305 1.00 74.33 C ATOM 889 O LYS A 66 -17.967 -1.506 9.116 1.00 22.12 O ATOM 890 CB LYS A 66 -17.194 -1.063 11.765 1.00 22.23 C ATOM 891 CG LYS A 66 -18.655 -1.444 11.926 1.00 33.13 C ATOM 892 CD LYS A 66 -18.823 -2.941 12.125 1.00 62.25 C ATOM 893 CE LYS A 66 -19.375 -3.610 10.875 1.00 35.44 C ATOM 894 NZ LYS A 66 -20.227 -4.786 11.207 1.00 70.33 N ATOM 0 H LYS A 66 -18.551 0.989 11.611 1.00 54.43 H new ATOM 0 HA LYS A 66 -15.928 0.362 10.769 1.00 22.15 H new ATOM 0 HB2 LYS A 66 -16.619 -1.956 11.520 1.00 22.23 H new ATOM 0 HB3 LYS A 66 -16.817 -0.693 12.718 1.00 22.23 H new ATOM 0 HG2 LYS A 66 -19.078 -0.913 12.779 1.00 33.13 H new ATOM 0 HG3 LYS A 66 -19.213 -1.128 11.045 1.00 33.13 H new ATOM 0 HD2 LYS A 66 -17.862 -3.385 12.383 1.00 62.25 H new ATOM 0 HD3 LYS A 66 -19.494 -3.125 12.964 1.00 62.25 H new ATOM 0 HE2 LYS A 66 -19.959 -2.888 10.304 1.00 35.44 H new ATOM 0 HE3 LYS A 66 -18.549 -3.928 10.238 1.00 35.44 H new ATOM 0 HZ1 LYS A 66 -20.584 -5.215 10.329 1.00 70.33 H new ATOM 0 HZ2 LYS A 66 -19.663 -5.486 11.730 1.00 70.33 H new ATOM 0 HZ3 LYS A 66 -21.029 -4.479 11.794 1.00 70.33 H new ATOM 908 N ASN A 67 -16.359 -0.138 8.340 1.00 24.22 N ATOM 909 CA ASN A 67 -16.437 -0.641 6.974 1.00 70.44 C ATOM 910 C ASN A 67 -15.434 0.073 6.073 1.00 70.44 C ATOM 911 O ASN A 67 -14.405 -0.492 5.701 1.00 73.34 O ATOM 912 CB ASN A 67 -17.853 -0.462 6.422 1.00 1.33 C ATOM 913 CG ASN A 67 -18.614 -1.771 6.346 1.00 32.13 C ATOM 914 OD1 ASN A 67 -19.595 -1.974 7.062 1.00 53.12 O ATOM 915 ND2 ASN A 67 -18.164 -2.667 5.476 1.00 20.41 N ATOM 0 H ASN A 67 -15.667 0.598 8.479 1.00 24.22 H new ATOM 0 HA ASN A 67 -16.192 -1.703 6.990 1.00 70.44 H new ATOM 0 HB2 ASN A 67 -18.401 0.237 7.054 1.00 1.33 H new ATOM 0 HB3 ASN A 67 -17.799 -0.018 5.428 1.00 1.33 H new ATOM 0 HD21 ASN A 67 -18.635 -3.567 5.381 1.00 20.41 H new ATOM 0 HD22 ASN A 67 -17.347 -2.456 4.903 1.00 20.41 H new ATOM 922 N VAL A 68 -15.741 1.319 5.726 1.00 62.45 N ATOM 923 CA VAL A 68 -14.866 2.111 4.870 1.00 50.23 C ATOM 924 C VAL A 68 -13.654 2.620 5.643 1.00 74.43 C ATOM 925 O VAL A 68 -13.688 2.780 6.863 1.00 61.10 O ATOM 926 CB VAL A 68 -15.614 3.312 4.261 1.00 11.34 C ATOM 927 CG1 VAL A 68 -16.636 2.842 3.238 1.00 52.24 C ATOM 928 CG2 VAL A 68 -16.281 4.133 5.355 1.00 51.33 C ATOM 0 H VAL A 68 -16.589 1.801 6.024 1.00 62.45 H new ATOM 0 HA VAL A 68 -14.531 1.455 4.066 1.00 50.23 H new ATOM 0 HB VAL A 68 -14.891 3.948 3.750 1.00 11.34 H new ATOM 0 HG11 VAL A 68 -17.154 3.704 2.819 1.00 52.24 H new ATOM 0 HG12 VAL A 68 -16.129 2.300 2.440 1.00 52.24 H new ATOM 0 HG13 VAL A 68 -17.358 2.184 3.721 1.00 52.24 H new ATOM 0 HG21 VAL A 68 -16.805 4.978 4.908 1.00 51.33 H new ATOM 0 HG22 VAL A 68 -16.993 3.509 5.895 1.00 51.33 H new ATOM 0 HG23 VAL A 68 -15.523 4.501 6.047 1.00 51.33 H new ATOM 938 N PRO A 69 -12.557 2.880 4.917 1.00 3.44 N ATOM 939 CA PRO A 69 -11.313 3.376 5.514 1.00 22.13 C ATOM 940 C PRO A 69 -11.442 4.810 6.016 1.00 44.24 C ATOM 941 O PRO A 69 -11.845 5.704 5.271 1.00 52.22 O ATOM 942 CB PRO A 69 -10.311 3.301 4.359 1.00 21.04 C ATOM 943 CG PRO A 69 -11.145 3.390 3.128 1.00 3.31 C ATOM 944 CD PRO A 69 -12.445 2.712 3.459 1.00 54.22 C ATOM 0 HA PRO A 69 -11.020 2.795 6.388 1.00 22.13 H new ATOM 0 HB2 PRO A 69 -9.589 4.116 4.408 1.00 21.04 H new ATOM 0 HB3 PRO A 69 -9.744 2.371 4.387 1.00 21.04 H new ATOM 0 HG2 PRO A 69 -11.309 4.429 2.842 1.00 3.31 H new ATOM 0 HG3 PRO A 69 -10.653 2.901 2.287 1.00 3.31 H new ATOM 0 HD2 PRO A 69 -13.283 3.173 2.936 1.00 54.22 H new ATOM 0 HD3 PRO A 69 -12.433 1.660 3.176 1.00 54.22 H new ATOM 952 N CYS A 70 -11.096 5.023 7.280 1.00 31.15 N ATOM 953 CA CYS A 70 -11.174 6.350 7.881 1.00 25.24 C ATOM 954 C CYS A 70 -10.047 6.557 8.888 1.00 44.40 C ATOM 955 O CYS A 70 -9.555 5.603 9.491 1.00 73.22 O ATOM 956 CB CYS A 70 -12.527 6.544 8.566 1.00 53.21 C ATOM 957 SG CYS A 70 -13.944 6.409 7.451 1.00 53.10 S ATOM 0 H CYS A 70 -10.759 4.294 7.909 1.00 31.15 H new ATOM 0 HA CYS A 70 -11.068 7.089 7.086 1.00 25.24 H new ATOM 0 HB2 CYS A 70 -12.630 5.803 9.359 1.00 53.21 H new ATOM 0 HB3 CYS A 70 -12.544 7.525 9.041 1.00 53.21 H new ATOM 0 HG CYS A 70 -13.523 6.239 6.233 1.00 53.10 H new ATOM 963 N TYR A 71 -9.641 7.810 9.063 1.00 23.14 N ATOM 964 CA TYR A 71 -8.568 8.143 9.994 1.00 74.42 C ATOM 965 C TYR A 71 -8.994 9.263 10.937 1.00 12.34 C ATOM 966 O TYR A 71 -9.494 10.300 10.502 1.00 1.11 O ATOM 967 CB TYR A 71 -7.310 8.556 9.228 1.00 34.22 C ATOM 968 CG TYR A 71 -6.817 7.503 8.261 1.00 11.50 C ATOM 969 CD1 TYR A 71 -7.419 7.335 7.020 1.00 3.31 C ATOM 970 CD2 TYR A 71 -5.748 6.678 8.588 1.00 33.22 C ATOM 971 CE1 TYR A 71 -6.972 6.375 6.134 1.00 63.51 C ATOM 972 CE2 TYR A 71 -5.294 5.715 7.708 1.00 44.44 C ATOM 973 CZ TYR A 71 -5.909 5.567 6.482 1.00 2.30 C ATOM 974 OH TYR A 71 -5.460 4.610 5.601 1.00 4.04 O ATOM 0 H TYR A 71 -10.038 8.612 8.573 1.00 23.14 H new ATOM 0 HA TYR A 71 -8.348 7.256 10.588 1.00 74.42 H new ATOM 0 HB2 TYR A 71 -7.515 9.475 8.678 1.00 34.22 H new ATOM 0 HB3 TYR A 71 -6.518 8.781 9.942 1.00 34.22 H new ATOM 0 HD1 TYR A 71 -8.251 7.966 6.744 1.00 3.31 H new ATOM 0 HD2 TYR A 71 -5.264 6.792 9.547 1.00 33.22 H new ATOM 0 HE1 TYR A 71 -7.452 6.257 5.174 1.00 63.51 H new ATOM 0 HE2 TYR A 71 -4.462 5.081 7.978 1.00 44.44 H new ATOM 0 HH TYR A 71 -5.528 3.725 6.017 1.00 4.04 H new ATOM 984 N ALA A 72 -8.791 9.046 12.233 1.00 55.12 N ATOM 985 CA ALA A 72 -9.151 10.037 13.239 1.00 11.40 C ATOM 986 C ALA A 72 -7.938 10.442 14.069 1.00 3.40 C ATOM 987 O ALA A 72 -7.254 9.594 14.640 1.00 24.14 O ATOM 988 CB ALA A 72 -10.253 9.500 14.140 1.00 73.54 C ATOM 0 H ALA A 72 -8.379 8.192 12.610 1.00 55.12 H new ATOM 0 HA ALA A 72 -9.519 10.924 12.723 1.00 11.40 H new ATOM 0 HB1 ALA A 72 -10.511 10.251 14.886 1.00 73.54 H new ATOM 0 HB2 ALA A 72 -11.133 9.267 13.540 1.00 73.54 H new ATOM 0 HB3 ALA A 72 -9.906 8.596 14.640 1.00 73.54 H new ATOM 994 N ALA A 73 -7.676 11.744 14.130 1.00 31.12 N ATOM 995 CA ALA A 73 -6.546 12.261 14.892 1.00 63.05 C ATOM 996 C ALA A 73 -7.013 12.949 16.169 1.00 12.24 C ATOM 997 O ALA A 73 -7.768 13.921 16.123 1.00 72.33 O ATOM 998 CB ALA A 73 -5.731 13.223 14.039 1.00 32.13 C ATOM 0 H ALA A 73 -8.231 12.460 13.661 1.00 31.12 H new ATOM 0 HA ALA A 73 -5.915 11.419 15.175 1.00 63.05 H new ATOM 0 HB1 ALA A 73 -4.890 13.602 14.620 1.00 32.13 H new ATOM 0 HB2 ALA A 73 -5.357 12.701 13.158 1.00 32.13 H new ATOM 0 HB3 ALA A 73 -6.361 14.056 13.727 1.00 32.13 H new ATOM 1004 N PHE A 74 -6.561 12.439 17.310 1.00 4.51 N ATOM 1005 CA PHE A 74 -6.934 13.004 18.602 1.00 52.55 C ATOM 1006 C PHE A 74 -5.711 13.554 19.329 1.00 23.23 C ATOM 1007 O PHE A 74 -4.711 12.856 19.500 1.00 71.43 O ATOM 1008 CB PHE A 74 -7.623 11.946 19.465 1.00 23.33 C ATOM 1009 CG PHE A 74 -9.091 11.804 19.183 1.00 51.00 C ATOM 1010 CD1 PHE A 74 -9.536 11.434 17.924 1.00 65.40 C ATOM 1011 CD2 PHE A 74 -10.027 12.042 20.177 1.00 72.24 C ATOM 1012 CE1 PHE A 74 -10.886 11.302 17.661 1.00 71.01 C ATOM 1013 CE2 PHE A 74 -11.379 11.911 19.920 1.00 42.35 C ATOM 1014 CZ PHE A 74 -11.809 11.542 18.660 1.00 41.21 C ATOM 0 H PHE A 74 -5.936 11.635 17.366 1.00 4.51 H new ATOM 0 HA PHE A 74 -7.628 13.826 18.425 1.00 52.55 H new ATOM 0 HB2 PHE A 74 -7.136 10.984 19.304 1.00 23.33 H new ATOM 0 HB3 PHE A 74 -7.486 12.201 20.516 1.00 23.33 H new ATOM 0 HD1 PHE A 74 -8.819 11.246 17.139 1.00 65.40 H new ATOM 0 HD2 PHE A 74 -9.697 12.333 21.163 1.00 72.24 H new ATOM 0 HE1 PHE A 74 -11.219 11.012 16.676 1.00 71.01 H new ATOM 0 HE2 PHE A 74 -12.099 12.097 20.704 1.00 42.35 H new ATOM 0 HZ PHE A 74 -12.865 11.441 18.457 1.00 41.21 H new ATOM 1024 N ASP A 75 -5.798 14.809 19.756 1.00 63.13 N ATOM 1025 CA ASP A 75 -4.699 15.453 20.466 1.00 42.13 C ATOM 1026 C ASP A 75 -4.936 15.427 21.972 1.00 11.44 C ATOM 1027 O ASP A 75 -5.988 15.849 22.453 1.00 53.21 O ATOM 1028 CB ASP A 75 -4.531 16.896 19.988 1.00 51.32 C ATOM 1029 CG ASP A 75 -3.576 17.687 20.859 1.00 4.43 C ATOM 1030 OD1 ASP A 75 -2.709 17.064 21.508 1.00 41.14 O ATOM 1031 OD2 ASP A 75 -3.694 18.930 20.892 1.00 31.05 O ATOM 0 H ASP A 75 -6.618 15.401 19.623 1.00 63.13 H new ATOM 0 HA ASP A 75 -3.785 14.899 20.251 1.00 42.13 H new ATOM 0 HB2 ASP A 75 -4.166 16.895 18.961 1.00 51.32 H new ATOM 0 HB3 ASP A 75 -5.503 17.388 19.980 1.00 51.32 H new ATOM 1036 N PHE A 76 -3.952 14.929 22.713 1.00 64.12 N ATOM 1037 CA PHE A 76 -4.054 14.846 24.165 1.00 20.01 C ATOM 1038 C PHE A 76 -2.760 15.308 24.829 1.00 51.42 C ATOM 1039 O PHE A 76 -1.681 14.800 24.528 1.00 43.21 O ATOM 1040 CB PHE A 76 -4.377 13.413 24.594 1.00 45.11 C ATOM 1041 CG PHE A 76 -5.200 13.334 25.848 1.00 71.55 C ATOM 1042 CD1 PHE A 76 -6.403 14.013 25.946 1.00 54.41 C ATOM 1043 CD2 PHE A 76 -4.771 12.579 26.927 1.00 33.52 C ATOM 1044 CE1 PHE A 76 -7.163 13.942 27.099 1.00 44.44 C ATOM 1045 CE2 PHE A 76 -5.527 12.503 28.082 1.00 5.44 C ATOM 1046 CZ PHE A 76 -6.724 13.186 28.168 1.00 73.54 C ATOM 0 H PHE A 76 -3.074 14.577 22.331 1.00 64.12 H new ATOM 0 HA PHE A 76 -4.861 15.505 24.485 1.00 20.01 H new ATOM 0 HB2 PHE A 76 -4.911 12.912 23.786 1.00 45.11 H new ATOM 0 HB3 PHE A 76 -3.445 12.869 24.746 1.00 45.11 H new ATOM 0 HD1 PHE A 76 -6.752 14.605 25.112 1.00 54.41 H new ATOM 0 HD2 PHE A 76 -3.835 12.043 26.865 1.00 33.52 H new ATOM 0 HE1 PHE A 76 -8.099 14.477 27.163 1.00 44.44 H new ATOM 0 HE2 PHE A 76 -5.182 11.910 28.916 1.00 5.44 H new ATOM 0 HZ PHE A 76 -7.316 13.129 29.070 1.00 73.54 H new ATOM 1056 N GLU A 77 -2.879 16.276 25.733 1.00 44.14 N ATOM 1057 CA GLU A 77 -1.718 16.808 26.438 1.00 53.13 C ATOM 1058 C GLU A 77 -1.871 16.633 27.946 1.00 63.31 C ATOM 1059 O GLU A 77 -2.917 16.944 28.515 1.00 1.14 O ATOM 1060 CB GLU A 77 -1.525 18.288 26.102 1.00 5.43 C ATOM 1061 CG GLU A 77 -0.352 18.928 26.827 1.00 13.20 C ATOM 1062 CD GLU A 77 -0.723 20.240 27.492 1.00 60.32 C ATOM 1063 OE1 GLU A 77 -1.475 20.207 28.488 1.00 11.24 O ATOM 1064 OE2 GLU A 77 -0.262 21.298 27.016 1.00 62.02 O ATOM 0 H GLU A 77 -3.766 16.707 25.994 1.00 44.14 H new ATOM 0 HA GLU A 77 -0.839 16.251 26.112 1.00 53.13 H new ATOM 0 HB2 GLU A 77 -1.377 18.392 25.027 1.00 5.43 H new ATOM 0 HB3 GLU A 77 -2.436 18.831 26.353 1.00 5.43 H new ATOM 0 HG2 GLU A 77 0.025 18.237 27.581 1.00 13.20 H new ATOM 0 HG3 GLU A 77 0.458 19.100 26.118 1.00 13.20 H new ATOM 1167 N ARG A 85 3.243 17.707 28.445 1.00 41.14 N ATOM 1168 CA ARG A 85 3.625 17.349 27.084 1.00 53.22 C ATOM 1169 C ARG A 85 2.392 17.063 26.231 1.00 41.21 C ATOM 1170 O ARG A 85 1.370 16.599 26.736 1.00 72.33 O ATOM 1171 CB ARG A 85 4.545 16.128 27.094 1.00 24.42 C ATOM 1172 CG ARG A 85 6.011 16.468 26.882 1.00 44.03 C ATOM 1173 CD ARG A 85 6.319 16.715 25.413 1.00 73.10 C ATOM 1174 NE ARG A 85 7.627 16.189 25.031 1.00 34.35 N ATOM 1175 CZ ARG A 85 7.876 14.896 24.855 1.00 33.14 C ATOM 1176 NH1 ARG A 85 6.911 14.002 25.025 1.00 0.31 N ATOM 1177 NH2 ARG A 85 9.092 14.495 24.508 1.00 31.42 N ATOM 0 HA ARG A 85 4.159 18.194 26.649 1.00 53.22 H new ATOM 0 HB2 ARG A 85 4.435 15.609 28.046 1.00 24.42 H new ATOM 0 HB3 ARG A 85 4.225 15.436 26.315 1.00 24.42 H new ATOM 0 HG2 ARG A 85 6.268 17.354 27.463 1.00 44.03 H new ATOM 0 HG3 ARG A 85 6.632 15.653 27.253 1.00 44.03 H new ATOM 0 HD2 ARG A 85 5.548 16.251 24.798 1.00 73.10 H new ATOM 0 HD3 ARG A 85 6.286 17.786 25.211 1.00 73.10 H new ATOM 0 HE ARG A 85 8.391 16.850 24.892 1.00 34.35 H new ATOM 0 HH11 ARG A 85 5.975 14.307 25.292 1.00 0.31 H new ATOM 0 HH12 ARG A 85 7.105 13.010 24.889 1.00 0.31 H new ATOM 0 HH21 ARG A 85 9.837 15.180 24.376 1.00 31.42 H new ATOM 0 HH22 ARG A 85 9.282 13.502 24.373 1.00 31.42 H new ATOM 1191 N ASP A 86 2.497 17.344 24.937 1.00 55.32 N ATOM 1192 CA ASP A 86 1.391 17.117 24.013 1.00 11.14 C ATOM 1193 C ASP A 86 1.714 15.981 23.048 1.00 31.32 C ATOM 1194 O ASP A 86 2.810 15.918 22.491 1.00 72.35 O ATOM 1195 CB ASP A 86 1.081 18.394 23.231 1.00 12.44 C ATOM 1196 CG ASP A 86 2.124 18.693 22.172 1.00 32.44 C ATOM 1197 OD1 ASP A 86 3.294 18.925 22.541 1.00 44.01 O ATOM 1198 OD2 ASP A 86 1.770 18.693 20.975 1.00 32.31 O ATOM 0 H ASP A 86 3.336 17.729 24.504 1.00 55.32 H new ATOM 0 HA ASP A 86 0.514 16.836 24.597 1.00 11.14 H new ATOM 0 HB2 ASP A 86 0.104 18.298 22.757 1.00 12.44 H new ATOM 0 HB3 ASP A 86 1.019 19.234 23.923 1.00 12.44 H new ATOM 1203 N LYS A 87 0.753 15.083 22.856 1.00 1.32 N ATOM 1204 CA LYS A 87 0.934 13.949 21.959 1.00 74.53 C ATOM 1205 C LYS A 87 -0.338 13.677 21.162 1.00 55.21 C ATOM 1206 O LYS A 87 -1.437 13.649 21.718 1.00 53.11 O ATOM 1207 CB LYS A 87 1.326 12.701 22.753 1.00 23.12 C ATOM 1208 CG LYS A 87 2.822 12.574 22.986 1.00 71.43 C ATOM 1209 CD LYS A 87 3.493 11.781 21.877 1.00 61.04 C ATOM 1210 CE LYS A 87 4.024 12.694 20.782 1.00 71.21 C ATOM 1211 NZ LYS A 87 5.121 12.051 20.007 1.00 70.30 N ATOM 0 H LYS A 87 -0.159 15.119 23.310 1.00 1.32 H new ATOM 0 HA LYS A 87 1.734 14.195 21.261 1.00 74.53 H new ATOM 0 HB2 LYS A 87 0.817 12.719 23.717 1.00 23.12 H new ATOM 0 HB3 LYS A 87 0.973 11.817 22.222 1.00 23.12 H new ATOM 0 HG2 LYS A 87 3.268 13.567 23.046 1.00 71.43 H new ATOM 0 HG3 LYS A 87 3.002 12.086 23.944 1.00 71.43 H new ATOM 0 HD2 LYS A 87 4.312 11.194 22.292 1.00 61.04 H new ATOM 0 HD3 LYS A 87 2.780 11.075 21.450 1.00 61.04 H new ATOM 0 HE2 LYS A 87 3.211 12.962 20.107 1.00 71.21 H new ATOM 0 HE3 LYS A 87 4.388 13.620 21.226 1.00 71.21 H new ATOM 0 HZ1 LYS A 87 5.456 12.705 19.271 1.00 70.30 H new ATOM 0 HZ2 LYS A 87 5.907 11.818 20.646 1.00 70.30 H new ATOM 0 HZ3 LYS A 87 4.767 11.180 19.562 1.00 70.30 H new ATOM 1225 N LEU A 88 -0.183 13.477 19.858 1.00 21.40 N ATOM 1226 CA LEU A 88 -1.319 13.206 18.985 1.00 75.54 C ATOM 1227 C LEU A 88 -1.319 11.751 18.525 1.00 24.15 C ATOM 1228 O LEU A 88 -0.283 11.216 18.129 1.00 21.55 O ATOM 1229 CB LEU A 88 -1.288 14.135 17.770 1.00 11.55 C ATOM 1230 CG LEU A 88 -2.180 15.375 17.851 1.00 4.23 C ATOM 1231 CD1 LEU A 88 -1.594 16.392 18.819 1.00 65.05 C ATOM 1232 CD2 LEU A 88 -2.362 15.992 16.472 1.00 21.21 C ATOM 0 H LEU A 88 0.719 13.497 19.382 1.00 21.40 H new ATOM 0 HA LEU A 88 -2.232 13.389 19.552 1.00 75.54 H new ATOM 0 HB2 LEU A 88 -0.260 14.461 17.613 1.00 11.55 H new ATOM 0 HB3 LEU A 88 -1.578 13.560 16.890 1.00 11.55 H new ATOM 0 HG LEU A 88 -3.158 15.071 18.223 1.00 4.23 H new ATOM 0 HD11 LEU A 88 -2.242 17.267 18.864 1.00 65.05 H new ATOM 0 HD12 LEU A 88 -1.516 15.947 19.811 1.00 65.05 H new ATOM 0 HD13 LEU A 88 -0.603 16.691 18.477 1.00 65.05 H new ATOM 0 HD21 LEU A 88 -2.999 16.873 16.549 1.00 21.21 H new ATOM 0 HD22 LEU A 88 -1.390 16.281 16.072 1.00 21.21 H new ATOM 0 HD23 LEU A 88 -2.827 15.265 15.806 1.00 21.21 H new ATOM 1244 N ILE A 89 -2.486 11.118 18.579 1.00 2.35 N ATOM 1245 CA ILE A 89 -2.620 9.727 18.166 1.00 62.00 C ATOM 1246 C ILE A 89 -3.519 9.602 16.941 1.00 71.21 C ATOM 1247 O ILE A 89 -4.446 10.392 16.754 1.00 65.23 O ATOM 1248 CB ILE A 89 -3.191 8.855 19.300 1.00 55.33 C ATOM 1249 CG1 ILE A 89 -2.409 9.086 20.594 1.00 11.31 C ATOM 1250 CG2 ILE A 89 -3.155 7.386 18.908 1.00 74.25 C ATOM 1251 CD1 ILE A 89 -3.000 10.167 21.473 1.00 63.24 C ATOM 0 H ILE A 89 -3.352 11.547 18.905 1.00 2.35 H new ATOM 0 HA ILE A 89 -1.619 9.374 17.917 1.00 62.00 H new ATOM 0 HB ILE A 89 -4.229 9.140 19.470 1.00 55.33 H new ATOM 0 HG12 ILE A 89 -2.369 8.153 21.156 1.00 11.31 H new ATOM 0 HG13 ILE A 89 -1.382 9.352 20.345 1.00 11.31 H new ATOM 0 HG21 ILE A 89 -3.562 6.783 19.720 1.00 74.25 H new ATOM 0 HG22 ILE A 89 -3.752 7.235 18.009 1.00 74.25 H new ATOM 0 HG23 ILE A 89 -2.125 7.086 18.714 1.00 74.25 H new ATOM 0 HD11 ILE A 89 -2.394 10.276 22.372 1.00 63.24 H new ATOM 0 HD12 ILE A 89 -3.015 11.111 20.928 1.00 63.24 H new ATOM 0 HD13 ILE A 89 -4.018 9.893 21.752 1.00 63.24 H new ATOM 1263 N LEU A 90 -3.241 8.604 16.110 1.00 74.53 N ATOM 1264 CA LEU A 90 -4.027 8.373 14.902 1.00 24.50 C ATOM 1265 C LEU A 90 -4.649 6.980 14.915 1.00 11.13 C ATOM 1266 O LEU A 90 -3.941 5.974 14.967 1.00 34.33 O ATOM 1267 CB LEU A 90 -3.149 8.540 13.660 1.00 75.40 C ATOM 1268 CG LEU A 90 -3.829 8.269 12.317 1.00 22.21 C ATOM 1269 CD1 LEU A 90 -4.705 9.445 11.915 1.00 5.31 C ATOM 1270 CD2 LEU A 90 -2.790 7.983 11.242 1.00 34.42 C ATOM 0 H LEU A 90 -2.478 7.942 16.250 1.00 74.53 H new ATOM 0 HA LEU A 90 -4.830 9.109 14.874 1.00 24.50 H new ATOM 0 HB2 LEU A 90 -2.760 9.558 13.649 1.00 75.40 H new ATOM 0 HB3 LEU A 90 -2.292 7.872 13.752 1.00 75.40 H new ATOM 0 HG LEU A 90 -4.464 7.390 12.424 1.00 22.21 H new ATOM 0 HD11 LEU A 90 -5.180 9.234 10.957 1.00 5.31 H new ATOM 0 HD12 LEU A 90 -5.472 9.604 12.673 1.00 5.31 H new ATOM 0 HD13 LEU A 90 -4.092 10.342 11.826 1.00 5.31 H new ATOM 0 HD21 LEU A 90 -3.291 7.792 10.293 1.00 34.42 H new ATOM 0 HD22 LEU A 90 -2.129 8.843 11.137 1.00 34.42 H new ATOM 0 HD23 LEU A 90 -2.205 7.108 11.525 1.00 34.42 H new ATOM 1282 N ILE A 91 -5.976 6.930 14.866 1.00 40.41 N ATOM 1283 CA ILE A 91 -6.693 5.661 14.869 1.00 50.41 C ATOM 1284 C ILE A 91 -7.446 5.453 13.560 1.00 74.44 C ATOM 1285 O ILE A 91 -8.283 6.270 13.176 1.00 61.13 O ATOM 1286 CB ILE A 91 -7.690 5.581 16.040 1.00 22.32 C ATOM 1287 CG1 ILE A 91 -6.997 5.948 17.354 1.00 13.50 C ATOM 1288 CG2 ILE A 91 -8.295 4.187 16.126 1.00 42.42 C ATOM 1289 CD1 ILE A 91 -7.171 7.400 17.743 1.00 30.10 C ATOM 0 H ILE A 91 -6.576 7.754 14.824 1.00 40.41 H new ATOM 0 HA ILE A 91 -5.946 4.876 14.985 1.00 50.41 H new ATOM 0 HB ILE A 91 -8.494 6.295 15.863 1.00 22.32 H new ATOM 0 HG12 ILE A 91 -7.390 5.317 18.151 1.00 13.50 H new ATOM 0 HG13 ILE A 91 -5.933 5.728 17.268 1.00 13.50 H new ATOM 0 HG21 ILE A 91 -8.998 4.146 16.958 1.00 42.42 H new ATOM 0 HG22 ILE A 91 -8.819 3.960 15.197 1.00 42.42 H new ATOM 0 HG23 ILE A 91 -7.502 3.456 16.284 1.00 42.42 H new ATOM 0 HD11 ILE A 91 -6.654 7.589 18.684 1.00 30.10 H new ATOM 0 HD12 ILE A 91 -6.753 8.038 16.964 1.00 30.10 H new ATOM 0 HD13 ILE A 91 -8.232 7.620 17.861 1.00 30.10 H new ATOM 1301 N SER A 92 -7.145 4.351 12.879 1.00 40.41 N ATOM 1302 CA SER A 92 -7.792 4.035 11.611 1.00 13.31 C ATOM 1303 C SER A 92 -8.651 2.781 11.738 1.00 73.24 C ATOM 1304 O SER A 92 -8.254 1.805 12.374 1.00 10.13 O ATOM 1305 CB SER A 92 -6.744 3.841 10.514 1.00 71.23 C ATOM 1306 OG SER A 92 -7.346 3.821 9.231 1.00 33.01 O ATOM 0 H SER A 92 -6.457 3.662 13.185 1.00 40.41 H new ATOM 0 HA SER A 92 -8.438 4.871 11.342 1.00 13.31 H new ATOM 0 HB2 SER A 92 -6.010 4.645 10.562 1.00 71.23 H new ATOM 0 HB3 SER A 92 -6.206 2.908 10.681 1.00 71.23 H new ATOM 0 HG SER A 92 -6.855 4.420 8.630 1.00 33.01 H new ATOM 1312 N TRP A 93 -9.830 2.815 11.127 1.00 51.01 N ATOM 1313 CA TRP A 93 -10.747 1.681 11.171 1.00 45.23 C ATOM 1314 C TRP A 93 -10.514 0.748 9.988 1.00 72.51 C ATOM 1315 O TRP A 93 -10.723 1.126 8.836 1.00 12.33 O ATOM 1316 CB TRP A 93 -12.196 2.170 11.173 1.00 2.33 C ATOM 1317 CG TRP A 93 -12.652 2.667 12.512 1.00 55.35 C ATOM 1318 CD1 TRP A 93 -13.440 2.003 13.407 1.00 33.44 C ATOM 1319 CD2 TRP A 93 -12.350 3.935 13.103 1.00 13.44 C ATOM 1320 NE1 TRP A 93 -13.646 2.781 14.521 1.00 51.33 N ATOM 1321 CE2 TRP A 93 -12.987 3.971 14.359 1.00 13.33 C ATOM 1322 CE3 TRP A 93 -11.602 5.043 12.696 1.00 52.11 C ATOM 1323 CZ2 TRP A 93 -12.898 5.072 15.207 1.00 35.14 C ATOM 1324 CZ3 TRP A 93 -11.515 6.135 13.539 1.00 72.33 C ATOM 1325 CH2 TRP A 93 -12.160 6.143 14.783 1.00 24.40 C ATOM 0 H TRP A 93 -10.174 3.615 10.595 1.00 51.01 H new ATOM 0 HA TRP A 93 -10.557 1.127 12.090 1.00 45.23 H new ATOM 0 HB2 TRP A 93 -12.303 2.970 10.440 1.00 2.33 H new ATOM 0 HB3 TRP A 93 -12.847 1.356 10.854 1.00 2.33 H new ATOM 0 HD1 TRP A 93 -13.843 1.012 13.261 1.00 33.44 H new ATOM 0 HE1 TRP A 93 -14.199 2.516 15.336 1.00 51.33 H new ATOM 0 HE3 TRP A 93 -11.101 5.046 11.739 1.00 52.11 H new ATOM 0 HZ2 TRP A 93 -13.394 5.080 16.166 1.00 35.14 H new ATOM 0 HZ3 TRP A 93 -10.940 6.997 13.234 1.00 72.33 H new ATOM 0 HH2 TRP A 93 -12.073 7.011 15.419 1.00 24.40 H new ATOM 1336 N ASN A 94 -10.081 -0.475 10.280 1.00 10.52 N ATOM 1337 CA ASN A 94 -9.820 -1.462 9.239 1.00 32.34 C ATOM 1338 C ASN A 94 -10.106 -2.873 9.744 1.00 31.25 C ATOM 1339 O ASN A 94 -9.200 -3.629 10.095 1.00 30.32 O ATOM 1340 CB ASN A 94 -8.369 -1.363 8.765 1.00 40.31 C ATOM 1341 CG ASN A 94 -8.008 -2.453 7.775 1.00 74.24 C ATOM 1342 OD1 ASN A 94 -6.951 -3.076 7.878 1.00 54.24 O ATOM 1343 ND2 ASN A 94 -8.888 -2.689 6.808 1.00 0.11 N ATOM 0 H ASN A 94 -9.904 -0.805 11.229 1.00 10.52 H new ATOM 0 HA ASN A 94 -10.484 -1.253 8.400 1.00 32.34 H new ATOM 0 HB2 ASN A 94 -8.206 -0.389 8.304 1.00 40.31 H new ATOM 0 HB3 ASN A 94 -7.704 -1.423 9.626 1.00 40.31 H new ATOM 0 HD21 ASN A 94 -8.700 -3.411 6.113 1.00 0.11 H new ATOM 0 HD22 ASN A 94 -9.752 -2.148 6.761 1.00 0.11 H new ATOM 1350 N PRO A 95 -11.396 -3.238 9.782 1.00 13.15 N ATOM 1351 CA PRO A 95 -11.832 -4.560 10.242 1.00 71.13 C ATOM 1352 C PRO A 95 -11.446 -5.668 9.268 1.00 30.20 C ATOM 1353 O PRO A 95 -11.659 -5.549 8.061 1.00 34.43 O ATOM 1354 CB PRO A 95 -13.355 -4.424 10.321 1.00 63.12 C ATOM 1355 CG PRO A 95 -13.689 -3.344 9.351 1.00 14.10 C ATOM 1356 CD PRO A 95 -12.529 -2.388 9.379 1.00 11.35 C ATOM 0 HA PRO A 95 -11.366 -4.837 11.188 1.00 71.13 H new ATOM 0 HB2 PRO A 95 -13.850 -5.359 10.059 1.00 63.12 H new ATOM 0 HB3 PRO A 95 -13.678 -4.164 11.329 1.00 63.12 H new ATOM 0 HG2 PRO A 95 -13.836 -3.750 8.350 1.00 14.10 H new ATOM 0 HG3 PRO A 95 -14.615 -2.842 9.630 1.00 14.10 H new ATOM 0 HD2 PRO A 95 -12.361 -1.931 8.404 1.00 11.35 H new ATOM 0 HD3 PRO A 95 -12.694 -1.576 10.087 1.00 11.35 H new ATOM 1364 N ASP A 96 -10.878 -6.745 9.800 1.00 43.15 N ATOM 1365 CA ASP A 96 -10.463 -7.876 8.977 1.00 13.50 C ATOM 1366 C ASP A 96 -11.646 -8.445 8.201 1.00 75.42 C ATOM 1367 O ASP A 96 -11.470 -9.099 7.172 1.00 13.35 O ATOM 1368 CB ASP A 96 -9.837 -8.965 9.849 1.00 62.14 C ATOM 1369 CG ASP A 96 -8.443 -8.599 10.321 1.00 55.22 C ATOM 1370 OD1 ASP A 96 -7.652 -8.093 9.498 1.00 44.10 O ATOM 1371 OD2 ASP A 96 -8.145 -8.817 11.513 1.00 32.34 O ATOM 0 H ASP A 96 -10.694 -6.859 10.797 1.00 43.15 H new ATOM 0 HA ASP A 96 -9.720 -7.522 8.263 1.00 13.50 H new ATOM 0 HB2 ASP A 96 -10.475 -9.145 10.714 1.00 62.14 H new ATOM 0 HB3 ASP A 96 -9.794 -9.897 9.286 1.00 62.14 H new ATOM 1376 N SER A 97 -12.852 -8.194 8.701 1.00 31.41 N ATOM 1377 CA SER A 97 -14.064 -8.687 8.057 1.00 14.44 C ATOM 1378 C SER A 97 -14.776 -7.564 7.309 1.00 52.23 C ATOM 1379 O SER A 97 -15.931 -7.704 6.909 1.00 51.13 O ATOM 1380 CB SER A 97 -15.006 -9.299 9.096 1.00 21.21 C ATOM 1381 OG SER A 97 -15.508 -10.549 8.655 1.00 24.13 O ATOM 0 H SER A 97 -13.016 -7.652 9.550 1.00 31.41 H new ATOM 0 HA SER A 97 -13.778 -9.455 7.339 1.00 14.44 H new ATOM 0 HB2 SER A 97 -14.477 -9.429 10.040 1.00 21.21 H new ATOM 0 HB3 SER A 97 -15.835 -8.617 9.286 1.00 21.21 H new ATOM 0 HG SER A 97 -16.106 -10.920 9.337 1.00 24.13 H new ATOM 1387 N GLY A 98 -14.077 -6.448 7.123 1.00 23.31 N ATOM 1388 CA GLY A 98 -14.657 -5.317 6.423 1.00 4.14 C ATOM 1389 C GLY A 98 -14.889 -5.602 4.953 1.00 41.22 C ATOM 1390 O GLY A 98 -15.805 -6.341 4.594 1.00 23.31 O ATOM 0 H GLY A 98 -13.119 -6.307 7.445 1.00 23.31 H new ATOM 0 HA2 GLY A 98 -15.604 -5.050 6.892 1.00 4.14 H new ATOM 0 HA3 GLY A 98 -13.998 -4.455 6.523 1.00 4.14 H new ATOM 1394 N ALA A 99 -14.058 -5.012 4.099 1.00 33.21 N ATOM 1395 CA ALA A 99 -14.178 -5.207 2.659 1.00 5.25 C ATOM 1396 C ALA A 99 -12.806 -5.368 2.012 1.00 53.42 C ATOM 1397 O ALA A 99 -11.779 -4.987 2.574 1.00 52.12 O ATOM 1398 CB ALA A 99 -14.928 -4.042 2.030 1.00 65.43 C ATOM 0 H ALA A 99 -13.295 -4.396 4.379 1.00 33.21 H new ATOM 0 HA ALA A 99 -14.742 -6.123 2.486 1.00 5.25 H new ATOM 0 HB1 ALA A 99 -15.010 -4.200 0.955 1.00 65.43 H new ATOM 0 HB2 ALA A 99 -15.925 -3.974 2.464 1.00 65.43 H new ATOM 0 HB3 ALA A 99 -14.386 -3.115 2.220 1.00 65.43 H new ATOM 1404 N PRO A 100 -12.787 -5.946 0.802 1.00 43.54 N ATOM 1405 CA PRO A 100 -11.547 -6.170 0.052 1.00 54.05 C ATOM 1406 C PRO A 100 -10.931 -4.869 -0.451 1.00 64.34 C ATOM 1407 O PRO A 100 -9.725 -4.654 -0.327 1.00 22.41 O ATOM 1408 CB PRO A 100 -11.998 -7.039 -1.126 1.00 3.43 C ATOM 1409 CG PRO A 100 -13.441 -6.716 -1.304 1.00 33.52 C ATOM 1410 CD PRO A 100 -13.973 -6.424 0.072 1.00 50.20 C ATOM 0 HA PRO A 100 -10.775 -6.630 0.668 1.00 54.05 H new ATOM 0 HB2 PRO A 100 -11.427 -6.812 -2.027 1.00 3.43 H new ATOM 0 HB3 PRO A 100 -11.853 -8.098 -0.915 1.00 3.43 H new ATOM 0 HG2 PRO A 100 -13.570 -5.857 -1.963 1.00 33.52 H new ATOM 0 HG3 PRO A 100 -13.974 -7.550 -1.760 1.00 33.52 H new ATOM 0 HD2 PRO A 100 -14.760 -5.670 0.047 1.00 50.20 H new ATOM 0 HD3 PRO A 100 -14.398 -7.314 0.536 1.00 50.20 H new ATOM 1418 N ARG A 101 -11.765 -4.005 -1.019 1.00 50.22 N ATOM 1419 CA ARG A 101 -11.301 -2.725 -1.542 1.00 22.24 C ATOM 1420 C ARG A 101 -10.851 -1.807 -0.409 1.00 51.31 C ATOM 1421 O ARG A 101 -9.806 -1.161 -0.496 1.00 50.11 O ATOM 1422 CB ARG A 101 -12.408 -2.049 -2.352 1.00 11.01 C ATOM 1423 CG ARG A 101 -12.823 -2.831 -3.587 1.00 71.13 C ATOM 1424 CD ARG A 101 -12.007 -2.424 -4.804 1.00 54.15 C ATOM 1425 NE ARG A 101 -10.870 -3.313 -5.024 1.00 21.35 N ATOM 1426 CZ ARG A 101 -10.026 -3.190 -6.042 1.00 73.22 C ATOM 1427 NH1 ARG A 101 -10.191 -2.220 -6.930 1.00 51.52 N ATOM 1428 NH2 ARG A 101 -9.015 -4.039 -6.174 1.00 3.23 N ATOM 0 H ARG A 101 -12.766 -4.168 -1.129 1.00 50.22 H new ATOM 0 HA ARG A 101 -10.448 -2.914 -2.194 1.00 22.24 H new ATOM 0 HB2 ARG A 101 -13.279 -1.907 -1.713 1.00 11.01 H new ATOM 0 HB3 ARG A 101 -12.071 -1.058 -2.656 1.00 11.01 H new ATOM 0 HG2 ARG A 101 -12.697 -3.898 -3.403 1.00 71.13 H new ATOM 0 HG3 ARG A 101 -13.882 -2.665 -3.785 1.00 71.13 H new ATOM 0 HD2 ARG A 101 -12.646 -2.428 -5.687 1.00 54.15 H new ATOM 0 HD3 ARG A 101 -11.649 -1.403 -4.675 1.00 54.15 H new ATOM 0 HE ARG A 101 -10.715 -4.071 -4.359 1.00 21.35 H new ATOM 0 HH11 ARG A 101 -10.968 -1.566 -6.832 1.00 51.52 H new ATOM 0 HH12 ARG A 101 -9.541 -2.128 -7.711 1.00 51.52 H new ATOM 0 HH21 ARG A 101 -8.885 -4.787 -5.493 1.00 3.23 H new ATOM 0 HH22 ARG A 101 -8.368 -3.943 -6.956 1.00 3.23 H new ATOM 1442 N THR A 102 -11.648 -1.752 0.654 1.00 63.41 N ATOM 1443 CA THR A 102 -11.333 -0.912 1.802 1.00 33.35 C ATOM 1444 C THR A 102 -10.041 -1.362 2.475 1.00 12.40 C ATOM 1445 O THR A 102 -9.196 -0.540 2.831 1.00 31.25 O ATOM 1446 CB THR A 102 -12.472 -0.930 2.840 1.00 63.01 C ATOM 1447 OG1 THR A 102 -12.711 -2.271 3.282 1.00 52.14 O ATOM 1448 CG2 THR A 102 -13.749 -0.349 2.252 1.00 3.41 C ATOM 0 H THR A 102 -12.516 -2.280 0.743 1.00 63.41 H new ATOM 0 HA THR A 102 -11.209 0.104 1.426 1.00 33.35 H new ATOM 0 HB THR A 102 -12.170 -0.317 3.689 1.00 63.01 H new ATOM 0 HG1 THR A 102 -13.515 -2.292 3.843 1.00 52.14 H new ATOM 0 HG21 THR A 102 -14.539 -0.372 3.003 1.00 3.41 H new ATOM 0 HG22 THR A 102 -13.572 0.681 1.944 1.00 3.41 H new ATOM 0 HG23 THR A 102 -14.053 -0.939 1.388 1.00 3.41 H new ATOM 1456 N LYS A 103 -9.893 -2.671 2.646 1.00 42.14 N ATOM 1457 CA LYS A 103 -8.702 -3.231 3.274 1.00 72.12 C ATOM 1458 C LYS A 103 -7.443 -2.820 2.517 1.00 72.41 C ATOM 1459 O LYS A 103 -6.455 -2.401 3.119 1.00 60.53 O ATOM 1460 CB LYS A 103 -8.801 -4.757 3.331 1.00 23.20 C ATOM 1461 CG LYS A 103 -7.496 -5.437 3.710 1.00 34.11 C ATOM 1462 CD LYS A 103 -7.024 -5.007 5.089 1.00 62.42 C ATOM 1463 CE LYS A 103 -5.742 -5.724 5.487 1.00 15.31 C ATOM 1464 NZ LYS A 103 -5.025 -5.010 6.580 1.00 62.34 N ATOM 0 H LYS A 103 -10.583 -3.365 2.358 1.00 42.14 H new ATOM 0 HA LYS A 103 -8.638 -2.839 4.289 1.00 72.12 H new ATOM 0 HB2 LYS A 103 -9.569 -5.036 4.052 1.00 23.20 H new ATOM 0 HB3 LYS A 103 -9.126 -5.128 2.359 1.00 23.20 H new ATOM 0 HG2 LYS A 103 -7.629 -6.519 3.691 1.00 34.11 H new ATOM 0 HG3 LYS A 103 -6.731 -5.197 2.971 1.00 34.11 H new ATOM 0 HD2 LYS A 103 -6.858 -3.930 5.099 1.00 62.42 H new ATOM 0 HD3 LYS A 103 -7.802 -5.216 5.823 1.00 62.42 H new ATOM 0 HE2 LYS A 103 -5.978 -6.738 5.809 1.00 15.31 H new ATOM 0 HE3 LYS A 103 -5.089 -5.809 4.619 1.00 15.31 H new ATOM 0 HZ1 LYS A 103 -4.685 -5.700 7.280 1.00 62.34 H new ATOM 0 HZ2 LYS A 103 -4.216 -4.491 6.183 1.00 62.34 H new ATOM 0 HZ3 LYS A 103 -5.673 -4.340 7.041 1.00 62.34 H new ATOM 1478 N MET A 104 -7.487 -2.942 1.194 1.00 33.22 N ATOM 1479 CA MET A 104 -6.350 -2.581 0.356 1.00 53.45 C ATOM 1480 C MET A 104 -6.167 -1.067 0.311 1.00 1.04 C ATOM 1481 O MET A 104 -5.044 -0.565 0.378 1.00 61.31 O ATOM 1482 CB MET A 104 -6.541 -3.124 -1.062 1.00 33.54 C ATOM 1483 CG MET A 104 -5.439 -4.074 -1.502 1.00 31.54 C ATOM 1484 SD MET A 104 -5.467 -5.636 -0.600 1.00 3.53 S ATOM 1485 CE MET A 104 -4.063 -5.420 0.492 1.00 34.44 C ATOM 0 H MET A 104 -8.297 -3.288 0.680 1.00 33.22 H new ATOM 0 HA MET A 104 -5.455 -3.026 0.791 1.00 53.45 H new ATOM 0 HB2 MET A 104 -7.499 -3.641 -1.118 1.00 33.54 H new ATOM 0 HB3 MET A 104 -6.588 -2.288 -1.759 1.00 33.54 H new ATOM 0 HG2 MET A 104 -5.541 -4.273 -2.569 1.00 31.54 H new ATOM 0 HG3 MET A 104 -4.471 -3.593 -1.358 1.00 31.54 H new ATOM 0 HE1 MET A 104 -3.554 -6.375 0.624 1.00 34.44 H new ATOM 0 HE2 MET A 104 -3.372 -4.698 0.058 1.00 34.44 H new ATOM 0 HE3 MET A 104 -4.408 -5.056 1.460 1.00 34.44 H new ATOM 1495 N LEU A 105 -7.276 -0.344 0.199 1.00 62.34 N ATOM 1496 CA LEU A 105 -7.237 1.113 0.145 1.00 12.13 C ATOM 1497 C LEU A 105 -6.505 1.683 1.356 1.00 65.04 C ATOM 1498 O LEU A 105 -5.887 2.745 1.277 1.00 41.23 O ATOM 1499 CB LEU A 105 -8.657 1.679 0.081 1.00 31.54 C ATOM 1500 CG LEU A 105 -9.122 2.173 -1.289 1.00 4.22 C ATOM 1501 CD1 LEU A 105 -9.159 1.026 -2.286 1.00 61.31 C ATOM 1502 CD2 LEU A 105 -10.488 2.834 -1.182 1.00 51.21 C ATOM 0 H LEU A 105 -8.213 -0.743 0.144 1.00 62.34 H new ATOM 0 HA LEU A 105 -6.695 1.404 -0.755 1.00 12.13 H new ATOM 0 HB2 LEU A 105 -9.349 0.909 0.421 1.00 31.54 H new ATOM 0 HB3 LEU A 105 -8.729 2.506 0.787 1.00 31.54 H new ATOM 0 HG LEU A 105 -8.409 2.915 -1.647 1.00 4.22 H new ATOM 0 HD11 LEU A 105 -9.492 1.397 -3.255 1.00 61.31 H new ATOM 0 HD12 LEU A 105 -8.162 0.598 -2.385 1.00 61.31 H new ATOM 0 HD13 LEU A 105 -9.850 0.260 -1.934 1.00 61.31 H new ATOM 0 HD21 LEU A 105 -10.803 3.180 -2.167 1.00 51.21 H new ATOM 0 HD22 LEU A 105 -11.212 2.114 -0.801 1.00 51.21 H new ATOM 0 HD23 LEU A 105 -10.429 3.683 -0.501 1.00 51.21 H new ATOM 1514 N TYR A 106 -6.576 0.969 2.474 1.00 42.34 N ATOM 1515 CA TYR A 106 -5.920 1.404 3.701 1.00 65.00 C ATOM 1516 C TYR A 106 -4.415 1.551 3.492 1.00 74.20 C ATOM 1517 O TYR A 106 -3.819 2.556 3.878 1.00 22.23 O ATOM 1518 CB TYR A 106 -6.194 0.410 4.831 1.00 71.24 C ATOM 1519 CG TYR A 106 -5.368 0.661 6.072 1.00 34.21 C ATOM 1520 CD1 TYR A 106 -5.672 1.709 6.932 1.00 23.11 C ATOM 1521 CD2 TYR A 106 -4.285 -0.151 6.386 1.00 73.34 C ATOM 1522 CE1 TYR A 106 -4.919 1.942 8.067 1.00 54.20 C ATOM 1523 CE2 TYR A 106 -3.528 0.074 7.519 1.00 33.42 C ATOM 1524 CZ TYR A 106 -3.849 1.122 8.356 1.00 31.23 C ATOM 1525 OH TYR A 106 -3.098 1.350 9.487 1.00 51.03 O ATOM 0 H TYR A 106 -7.081 0.087 2.556 1.00 42.34 H new ATOM 0 HA TYR A 106 -6.328 2.377 3.975 1.00 65.00 H new ATOM 0 HB2 TYR A 106 -7.251 0.454 5.093 1.00 71.24 H new ATOM 0 HB3 TYR A 106 -5.996 -0.600 4.471 1.00 71.24 H new ATOM 0 HD1 TYR A 106 -6.511 2.352 6.710 1.00 23.11 H new ATOM 0 HD2 TYR A 106 -4.031 -0.972 5.733 1.00 73.34 H new ATOM 0 HE1 TYR A 106 -5.167 2.762 8.724 1.00 54.20 H new ATOM 0 HE2 TYR A 106 -2.690 -0.567 7.748 1.00 33.42 H new ATOM 0 HH TYR A 106 -2.383 0.683 9.545 1.00 51.03 H new ATOM 1535 N SER A 107 -3.809 0.541 2.877 1.00 63.40 N ATOM 1536 CA SER A 107 -2.374 0.554 2.618 1.00 3.23 C ATOM 1537 C SER A 107 -2.016 1.627 1.594 1.00 74.21 C ATOM 1538 O SER A 107 -0.975 2.275 1.695 1.00 12.43 O ATOM 1539 CB SER A 107 -1.911 -0.817 2.121 1.00 43.50 C ATOM 1540 OG SER A 107 -1.287 -1.552 3.159 1.00 3.23 O ATOM 0 H SER A 107 -4.289 -0.297 2.549 1.00 63.40 H new ATOM 0 HA SER A 107 -1.863 0.785 3.553 1.00 3.23 H new ATOM 0 HB2 SER A 107 -2.765 -1.376 1.738 1.00 43.50 H new ATOM 0 HB3 SER A 107 -1.215 -0.691 1.292 1.00 43.50 H new ATOM 0 HG SER A 107 -1.002 -2.425 2.816 1.00 3.23 H new ATOM 1546 N SER A 108 -2.888 1.807 0.607 1.00 53.40 N ATOM 1547 CA SER A 108 -2.664 2.798 -0.439 1.00 53.22 C ATOM 1548 C SER A 108 -2.733 4.213 0.129 1.00 61.44 C ATOM 1549 O SER A 108 -2.012 5.107 -0.315 1.00 34.15 O ATOM 1550 CB SER A 108 -3.697 2.634 -1.556 1.00 41.10 C ATOM 1551 OG SER A 108 -4.810 3.487 -1.351 1.00 44.53 O ATOM 0 H SER A 108 -3.756 1.280 0.510 1.00 53.40 H new ATOM 0 HA SER A 108 -1.667 2.638 -0.849 1.00 53.22 H new ATOM 0 HB2 SER A 108 -3.236 2.858 -2.518 1.00 41.10 H new ATOM 0 HB3 SER A 108 -4.032 1.598 -1.597 1.00 41.10 H new ATOM 0 HG SER A 108 -5.229 3.277 -0.490 1.00 44.53 H new ATOM 1557 N SER A 109 -3.605 4.407 1.112 1.00 33.14 N ATOM 1558 CA SER A 109 -3.772 5.713 1.739 1.00 32.24 C ATOM 1559 C SER A 109 -2.731 5.927 2.834 1.00 33.22 C ATOM 1560 O SER A 109 -2.292 7.051 3.077 1.00 14.04 O ATOM 1561 CB SER A 109 -5.179 5.845 2.325 1.00 74.01 C ATOM 1562 OG SER A 109 -5.343 7.089 2.984 1.00 24.44 O ATOM 0 H SER A 109 -4.207 3.677 1.492 1.00 33.14 H new ATOM 0 HA SER A 109 -3.632 6.476 0.974 1.00 32.24 H new ATOM 0 HB2 SER A 109 -5.918 5.751 1.529 1.00 74.01 H new ATOM 0 HB3 SER A 109 -5.362 5.031 3.027 1.00 74.01 H new ATOM 0 HG SER A 109 -6.273 7.183 3.279 1.00 24.44 H new ATOM 1568 N ARG A 110 -2.341 4.840 3.491 1.00 31.44 N ATOM 1569 CA ARG A 110 -1.353 4.907 4.561 1.00 11.24 C ATOM 1570 C ARG A 110 -0.024 5.446 4.041 1.00 62.24 C ATOM 1571 O ARG A 110 0.650 6.223 4.717 1.00 23.10 O ATOM 1572 CB ARG A 110 -1.147 3.524 5.182 1.00 11.33 C ATOM 1573 CG ARG A 110 -1.698 3.402 6.594 1.00 53.15 C ATOM 1574 CD ARG A 110 -0.782 2.572 7.479 1.00 13.34 C ATOM 1575 NE ARG A 110 -0.129 3.383 8.504 1.00 54.35 N ATOM 1576 CZ ARG A 110 0.529 2.871 9.537 1.00 12.14 C ATOM 1577 NH1 ARG A 110 0.621 1.557 9.683 1.00 24.43 N ATOM 1578 NH2 ARG A 110 1.097 3.675 10.428 1.00 73.52 N ATOM 0 H ARG A 110 -2.694 3.902 3.301 1.00 31.44 H new ATOM 0 HA ARG A 110 -1.728 5.588 5.325 1.00 11.24 H new ATOM 0 HB2 ARG A 110 -1.624 2.776 4.549 1.00 11.33 H new ATOM 0 HB3 ARG A 110 -0.081 3.296 5.196 1.00 11.33 H new ATOM 0 HG2 ARG A 110 -1.820 4.396 7.025 1.00 53.15 H new ATOM 0 HG3 ARG A 110 -2.687 2.945 6.562 1.00 53.15 H new ATOM 0 HD2 ARG A 110 -1.359 1.780 7.956 1.00 13.34 H new ATOM 0 HD3 ARG A 110 -0.024 2.087 6.863 1.00 13.34 H new ATOM 0 HE ARG A 110 -0.182 4.398 8.421 1.00 54.35 H new ATOM 0 HH11 ARG A 110 0.186 0.936 9.001 1.00 24.43 H new ATOM 0 HH12 ARG A 110 1.127 1.166 10.478 1.00 24.43 H new ATOM 0 HH21 ARG A 110 1.028 4.687 10.319 1.00 73.52 H new ATOM 0 HH22 ARG A 110 1.602 3.281 11.221 1.00 73.52 H new ATOM 1592 N ASP A 111 0.347 5.027 2.836 1.00 52.24 N ATOM 1593 CA ASP A 111 1.595 5.468 2.224 1.00 60.34 C ATOM 1594 C ASP A 111 1.596 6.979 2.019 1.00 40.43 C ATOM 1595 O ASP A 111 2.599 7.648 2.265 1.00 10.34 O ATOM 1596 CB ASP A 111 1.810 4.759 0.885 1.00 15.12 C ATOM 1597 CG ASP A 111 3.250 4.831 0.416 1.00 35.35 C ATOM 1598 OD1 ASP A 111 4.125 4.259 1.100 1.00 55.42 O ATOM 1599 OD2 ASP A 111 3.502 5.459 -0.633 1.00 74.23 O ATOM 0 H ASP A 111 -0.199 4.383 2.264 1.00 52.24 H new ATOM 0 HA ASP A 111 2.412 5.211 2.898 1.00 60.34 H new ATOM 0 HB2 ASP A 111 1.513 3.714 0.979 1.00 15.12 H new ATOM 0 HB3 ASP A 111 1.163 5.208 0.132 1.00 15.12 H new ATOM 1604 N ALA A 112 0.465 7.511 1.565 1.00 25.30 N ATOM 1605 CA ALA A 112 0.336 8.943 1.328 1.00 73.01 C ATOM 1606 C ALA A 112 0.092 9.696 2.632 1.00 65.53 C ATOM 1607 O ALA A 112 0.371 10.891 2.732 1.00 52.34 O ATOM 1608 CB ALA A 112 -0.790 9.215 0.341 1.00 33.34 C ATOM 0 H ALA A 112 -0.374 6.971 1.354 1.00 25.30 H new ATOM 0 HA ALA A 112 1.273 9.301 0.902 1.00 73.01 H new ATOM 0 HB1 ALA A 112 -0.875 10.289 0.173 1.00 33.34 H new ATOM 0 HB2 ALA A 112 -0.574 8.716 -0.604 1.00 33.34 H new ATOM 0 HB3 ALA A 112 -1.728 8.835 0.746 1.00 33.34 H new ATOM 1614 N LEU A 113 -0.429 8.989 3.629 1.00 62.04 N ATOM 1615 CA LEU A 113 -0.710 9.591 4.927 1.00 34.23 C ATOM 1616 C LEU A 113 0.540 9.611 5.801 1.00 51.13 C ATOM 1617 O LEU A 113 0.651 10.417 6.725 1.00 64.21 O ATOM 1618 CB LEU A 113 -1.828 8.823 5.635 1.00 14.53 C ATOM 1619 CG LEU A 113 -3.228 9.432 5.536 1.00 44.32 C ATOM 1620 CD1 LEU A 113 -4.275 8.341 5.377 1.00 65.25 C ATOM 1621 CD2 LEU A 113 -3.526 10.286 6.760 1.00 71.41 C ATOM 0 H LEU A 113 -0.665 7.999 3.563 1.00 62.04 H new ATOM 0 HA LEU A 113 -1.031 10.619 4.761 1.00 34.23 H new ATOM 0 HB2 LEU A 113 -1.863 7.813 5.226 1.00 14.53 H new ATOM 0 HB3 LEU A 113 -1.567 8.731 6.689 1.00 14.53 H new ATOM 0 HG LEU A 113 -3.263 10.072 4.654 1.00 44.32 H new ATOM 0 HD11 LEU A 113 -5.264 8.793 5.308 1.00 65.25 H new ATOM 0 HD12 LEU A 113 -4.072 7.772 4.470 1.00 65.25 H new ATOM 0 HD13 LEU A 113 -4.240 7.675 6.239 1.00 65.25 H new ATOM 0 HD21 LEU A 113 -4.526 10.711 6.672 1.00 71.41 H new ATOM 0 HD22 LEU A 113 -3.472 9.668 7.657 1.00 71.41 H new ATOM 0 HD23 LEU A 113 -2.794 11.091 6.829 1.00 71.41 H new ATOM 1633 N VAL A 114 1.480 8.721 5.500 1.00 20.33 N ATOM 1634 CA VAL A 114 2.724 8.638 6.256 1.00 44.34 C ATOM 1635 C VAL A 114 3.433 9.988 6.296 1.00 62.52 C ATOM 1636 O VAL A 114 3.746 10.521 7.360 1.00 25.34 O ATOM 1637 CB VAL A 114 3.677 7.588 5.655 1.00 63.13 C ATOM 1638 CG1 VAL A 114 5.126 7.973 5.911 1.00 64.15 C ATOM 1639 CG2 VAL A 114 3.375 6.209 6.222 1.00 43.04 C ATOM 0 H VAL A 114 1.404 8.047 4.738 1.00 20.33 H new ATOM 0 HA VAL A 114 2.459 8.339 7.270 1.00 44.34 H new ATOM 0 HB VAL A 114 3.520 7.555 4.577 1.00 63.13 H new ATOM 0 HG11 VAL A 114 5.784 7.219 5.479 1.00 64.15 H new ATOM 0 HG12 VAL A 114 5.332 8.940 5.453 1.00 64.15 H new ATOM 0 HG13 VAL A 114 5.302 8.036 6.985 1.00 64.15 H new ATOM 0 HG21 VAL A 114 4.058 5.479 5.787 1.00 43.04 H new ATOM 0 HG22 VAL A 114 3.503 6.225 7.304 1.00 43.04 H new ATOM 0 HG23 VAL A 114 2.348 5.934 5.982 1.00 43.04 H new ATOM 1649 N PRO A 115 3.693 10.555 5.109 1.00 53.15 N ATOM 1650 CA PRO A 115 4.367 11.851 4.981 1.00 74.41 C ATOM 1651 C PRO A 115 3.493 13.008 5.453 1.00 30.43 C ATOM 1652 O PRO A 115 3.990 13.987 6.010 1.00 1.34 O ATOM 1653 CB PRO A 115 4.637 11.963 3.478 1.00 12.44 C ATOM 1654 CG PRO A 115 3.597 11.108 2.841 1.00 13.13 C ATOM 1655 CD PRO A 115 3.348 9.976 3.799 1.00 14.13 C ATOM 0 HA PRO A 115 5.266 11.906 5.595 1.00 74.41 H new ATOM 0 HB2 PRO A 115 4.562 12.996 3.138 1.00 12.44 H new ATOM 0 HB3 PRO A 115 5.640 11.617 3.229 1.00 12.44 H new ATOM 0 HG2 PRO A 115 2.683 11.674 2.660 1.00 13.13 H new ATOM 0 HG3 PRO A 115 3.937 10.734 1.875 1.00 13.13 H new ATOM 0 HD2 PRO A 115 2.310 9.644 3.767 1.00 14.13 H new ATOM 0 HD3 PRO A 115 3.967 9.110 3.567 1.00 14.13 H new ATOM 1663 N LEU A 116 2.189 12.889 5.228 1.00 22.53 N ATOM 1664 CA LEU A 116 1.245 13.925 5.632 1.00 43.02 C ATOM 1665 C LEU A 116 1.177 14.038 7.151 1.00 20.44 C ATOM 1666 O LEU A 116 1.188 15.138 7.705 1.00 32.30 O ATOM 1667 CB LEU A 116 -0.145 13.624 5.068 1.00 23.04 C ATOM 1668 CG LEU A 116 -0.975 14.837 4.646 1.00 63.32 C ATOM 1669 CD1 LEU A 116 -1.265 15.728 5.843 1.00 13.13 C ATOM 1670 CD2 LEU A 116 -0.257 15.621 3.557 1.00 73.34 C ATOM 0 H LEU A 116 1.761 12.085 4.768 1.00 22.53 H new ATOM 0 HA LEU A 116 1.595 14.877 5.231 1.00 43.02 H new ATOM 0 HB2 LEU A 116 -0.031 12.969 4.204 1.00 23.04 H new ATOM 0 HB3 LEU A 116 -0.707 13.068 5.818 1.00 23.04 H new ATOM 0 HG LEU A 116 -1.924 14.482 4.245 1.00 63.32 H new ATOM 0 HD11 LEU A 116 -1.857 16.586 5.523 1.00 13.13 H new ATOM 0 HD12 LEU A 116 -1.821 15.163 6.591 1.00 13.13 H new ATOM 0 HD13 LEU A 116 -0.326 16.075 6.274 1.00 13.13 H new ATOM 0 HD21 LEU A 116 -0.862 16.481 3.269 1.00 73.34 H new ATOM 0 HD22 LEU A 116 0.707 15.965 3.932 1.00 73.34 H new ATOM 0 HD23 LEU A 116 -0.101 14.980 2.690 1.00 73.34 H new ATOM 1682 N THR A 117 1.109 12.892 7.822 1.00 32.23 N ATOM 1683 CA THR A 117 1.040 12.861 9.278 1.00 41.33 C ATOM 1684 C THR A 117 2.219 12.096 9.868 1.00 72.42 C ATOM 1685 O THR A 117 2.043 11.039 10.473 1.00 33.14 O ATOM 1686 CB THR A 117 -0.272 12.217 9.765 1.00 64.02 C ATOM 1687 OG1 THR A 117 -0.456 10.945 9.134 1.00 31.32 O ATOM 1688 CG2 THR A 117 -1.461 13.116 9.462 1.00 21.14 C ATOM 0 H THR A 117 1.100 11.973 7.380 1.00 32.23 H new ATOM 0 HA THR A 117 1.076 13.896 9.618 1.00 41.33 H new ATOM 0 HB THR A 117 -0.206 12.081 10.844 1.00 64.02 H new ATOM 0 HG1 THR A 117 0.137 10.877 8.357 1.00 31.32 H new ATOM 0 HG21 THR A 117 -2.376 12.640 9.815 1.00 21.14 H new ATOM 0 HG22 THR A 117 -1.331 14.073 9.967 1.00 21.14 H new ATOM 0 HG23 THR A 117 -1.529 13.280 8.386 1.00 21.14 H new ATOM 1696 N GLN A 118 3.420 12.636 9.688 1.00 55.25 N ATOM 1697 CA GLN A 118 4.627 12.002 10.203 1.00 3.50 C ATOM 1698 C GLN A 118 4.871 12.396 11.656 1.00 10.31 C ATOM 1699 O GLN A 118 4.986 13.578 11.979 1.00 70.05 O ATOM 1700 CB GLN A 118 5.836 12.388 9.348 1.00 13.21 C ATOM 1701 CG GLN A 118 6.569 11.195 8.758 1.00 61.33 C ATOM 1702 CD GLN A 118 8.019 11.126 9.195 1.00 71.00 C ATOM 1703 OE1 GLN A 118 8.864 11.874 8.702 1.00 21.33 O ATOM 1704 NE2 GLN A 118 8.315 10.226 10.125 1.00 31.14 N ATOM 0 H GLN A 118 3.583 13.511 9.189 1.00 55.25 H new ATOM 0 HA GLN A 118 4.488 10.922 10.157 1.00 3.50 H new ATOM 0 HB2 GLN A 118 5.505 13.038 8.538 1.00 13.21 H new ATOM 0 HB3 GLN A 118 6.531 12.966 9.957 1.00 13.21 H new ATOM 0 HG2 GLN A 118 6.060 10.278 9.055 1.00 61.33 H new ATOM 0 HG3 GLN A 118 6.524 11.247 7.670 1.00 61.33 H new ATOM 0 HE21 GLN A 118 7.583 9.627 10.506 1.00 31.14 H new ATOM 0 HE22 GLN A 118 9.275 10.134 10.459 1.00 31.14 H new ATOM 1713 N GLY A 119 4.948 11.397 12.530 1.00 3.21 N ATOM 1714 CA GLY A 119 5.177 11.660 13.939 1.00 43.11 C ATOM 1715 C GLY A 119 4.140 11.002 14.827 1.00 4.25 C ATOM 1716 O GLY A 119 4.480 10.378 15.833 1.00 11.52 O ATOM 0 H GLY A 119 4.856 10.411 12.288 1.00 3.21 H new ATOM 0 HA2 GLY A 119 6.168 11.301 14.216 1.00 43.11 H new ATOM 0 HA3 GLY A 119 5.168 12.736 14.111 1.00 43.11 H new ATOM 1720 N PHE A 120 2.872 11.142 14.457 1.00 12.24 N ATOM 1721 CA PHE A 120 1.781 10.559 15.230 1.00 62.41 C ATOM 1722 C PHE A 120 1.768 9.039 15.090 1.00 54.35 C ATOM 1723 O PHE A 120 2.165 8.498 14.058 1.00 31.13 O ATOM 1724 CB PHE A 120 0.439 11.136 14.775 1.00 45.24 C ATOM 1725 CG PHE A 120 0.454 12.629 14.611 1.00 10.24 C ATOM 1726 CD1 PHE A 120 1.037 13.439 15.573 1.00 62.14 C ATOM 1727 CD2 PHE A 120 -0.116 13.223 13.497 1.00 53.01 C ATOM 1728 CE1 PHE A 120 1.053 14.813 15.425 1.00 14.23 C ATOM 1729 CE2 PHE A 120 -0.104 14.597 13.344 1.00 65.51 C ATOM 1730 CZ PHE A 120 0.480 15.393 14.310 1.00 65.31 C ATOM 0 H PHE A 120 2.574 11.654 13.627 1.00 12.24 H new ATOM 0 HA PHE A 120 1.938 10.809 16.279 1.00 62.41 H new ATOM 0 HB2 PHE A 120 0.158 10.677 13.827 1.00 45.24 H new ATOM 0 HB3 PHE A 120 -0.328 10.866 15.500 1.00 45.24 H new ATOM 0 HD1 PHE A 120 1.484 12.991 16.448 1.00 62.14 H new ATOM 0 HD2 PHE A 120 -0.575 12.606 12.739 1.00 53.01 H new ATOM 0 HE1 PHE A 120 1.513 15.433 16.180 1.00 14.23 H new ATOM 0 HE2 PHE A 120 -0.551 15.047 12.470 1.00 65.51 H new ATOM 0 HZ PHE A 120 0.489 16.467 14.194 1.00 65.31 H new ATOM 1740 N GLN A 121 1.308 8.359 16.135 1.00 61.45 N ATOM 1741 CA GLN A 121 1.244 6.902 16.128 1.00 31.14 C ATOM 1742 C GLN A 121 -0.036 6.416 15.455 1.00 4.23 C ATOM 1743 O GLN A 121 -1.125 6.530 16.015 1.00 31.42 O ATOM 1744 CB GLN A 121 1.319 6.361 17.557 1.00 5.03 C ATOM 1745 CG GLN A 121 2.477 6.930 18.363 1.00 73.44 C ATOM 1746 CD GLN A 121 2.729 6.160 19.644 1.00 4.32 C ATOM 1747 OE1 GLN A 121 3.244 5.042 19.619 1.00 34.33 O ATOM 1748 NE2 GLN A 121 2.369 6.757 20.774 1.00 14.12 N ATOM 0 H GLN A 121 0.975 8.792 16.996 1.00 61.45 H new ATOM 0 HA GLN A 121 2.096 6.529 15.560 1.00 31.14 H new ATOM 0 HB2 GLN A 121 0.384 6.585 18.071 1.00 5.03 H new ATOM 0 HB3 GLN A 121 1.411 5.275 17.521 1.00 5.03 H new ATOM 0 HG2 GLN A 121 3.380 6.918 17.753 1.00 73.44 H new ATOM 0 HG3 GLN A 121 2.269 7.972 18.605 1.00 73.44 H new ATOM 0 HE21 GLN A 121 1.945 7.684 20.748 1.00 14.12 H new ATOM 0 HE22 GLN A 121 2.516 6.288 21.668 1.00 14.12 H new ATOM 1757 N GLY A 122 0.105 5.875 14.249 1.00 31.51 N ATOM 1758 CA GLY A 122 -1.048 5.380 13.519 1.00 1.21 C ATOM 1759 C GLY A 122 -1.257 3.890 13.705 1.00 1.54 C ATOM 1760 O GLY A 122 -0.371 3.090 13.402 1.00 13.25 O ATOM 0 H GLY A 122 0.996 5.771 13.764 1.00 31.51 H new ATOM 0 HA2 GLY A 122 -1.940 5.913 13.850 1.00 1.21 H new ATOM 0 HA3 GLY A 122 -0.923 5.596 12.458 1.00 1.21 H new ATOM 1764 N ILE A 123 -2.430 3.517 14.206 1.00 4.34 N ATOM 1765 CA ILE A 123 -2.751 2.114 14.433 1.00 30.31 C ATOM 1766 C ILE A 123 -4.119 1.763 13.857 1.00 2.12 C ATOM 1767 O ILE A 123 -5.071 2.533 13.982 1.00 62.20 O ATOM 1768 CB ILE A 123 -2.734 1.768 15.934 1.00 72.43 C ATOM 1769 CG1 ILE A 123 -1.447 2.279 16.583 1.00 4.10 C ATOM 1770 CG2 ILE A 123 -2.874 0.266 16.132 1.00 23.34 C ATOM 1771 CD1 ILE A 123 -1.599 3.630 17.245 1.00 14.44 C ATOM 0 H ILE A 123 -3.173 4.167 14.462 1.00 4.34 H new ATOM 0 HA ILE A 123 -1.984 1.529 13.925 1.00 30.31 H new ATOM 0 HB ILE A 123 -3.580 2.259 16.415 1.00 72.43 H new ATOM 0 HG12 ILE A 123 -1.112 1.555 17.326 1.00 4.10 H new ATOM 0 HG13 ILE A 123 -0.667 2.341 15.824 1.00 4.10 H new ATOM 0 HG21 ILE A 123 -2.860 0.037 17.198 1.00 23.34 H new ATOM 0 HG22 ILE A 123 -3.816 -0.072 15.700 1.00 23.34 H new ATOM 0 HG23 ILE A 123 -2.046 -0.245 15.640 1.00 23.34 H new ATOM 0 HD11 ILE A 123 -0.647 3.929 17.684 1.00 14.44 H new ATOM 0 HD12 ILE A 123 -1.904 4.367 16.502 1.00 14.44 H new ATOM 0 HD13 ILE A 123 -2.356 3.569 18.027 1.00 14.44 H new ATOM 1783 N GLN A 124 -4.208 0.596 13.228 1.00 33.43 N ATOM 1784 CA GLN A 124 -5.460 0.143 12.634 1.00 35.42 C ATOM 1785 C GLN A 124 -6.167 -0.854 13.548 1.00 52.45 C ATOM 1786 O GLN A 124 -5.648 -1.935 13.823 1.00 41.33 O ATOM 1787 CB GLN A 124 -5.200 -0.495 11.269 1.00 71.35 C ATOM 1788 CG GLN A 124 -4.111 -1.556 11.290 1.00 12.10 C ATOM 1789 CD GLN A 124 -4.548 -2.854 10.641 1.00 71.23 C ATOM 1790 OE1 GLN A 124 -5.168 -3.704 11.281 1.00 64.21 O ATOM 1791 NE2 GLN A 124 -4.227 -3.014 9.362 1.00 31.32 N ATOM 0 H GLN A 124 -3.429 -0.053 13.117 1.00 33.43 H new ATOM 0 HA GLN A 124 -6.106 1.011 12.504 1.00 35.42 H new ATOM 0 HB2 GLN A 124 -6.125 -0.943 10.905 1.00 71.35 H new ATOM 0 HB3 GLN A 124 -4.922 0.285 10.560 1.00 71.35 H new ATOM 0 HG2 GLN A 124 -3.229 -1.176 10.775 1.00 12.10 H new ATOM 0 HG3 GLN A 124 -3.819 -1.751 12.322 1.00 12.10 H new ATOM 0 HE21 GLN A 124 -3.712 -2.284 8.870 1.00 31.32 H new ATOM 0 HE22 GLN A 124 -4.495 -3.867 8.872 1.00 31.32 H new ATOM 1800 N ALA A 125 -7.354 -0.481 14.015 1.00 75.44 N ATOM 1801 CA ALA A 125 -8.133 -1.343 14.896 1.00 50.14 C ATOM 1802 C ALA A 125 -9.629 -1.149 14.672 1.00 41.22 C ATOM 1803 O ALA A 125 -10.118 -0.021 14.625 1.00 3.14 O ATOM 1804 CB ALA A 125 -7.775 -1.072 16.350 1.00 75.34 C ATOM 0 H ALA A 125 -7.797 0.412 13.798 1.00 75.44 H new ATOM 0 HA ALA A 125 -7.889 -2.379 14.660 1.00 50.14 H new ATOM 0 HB1 ALA A 125 -8.364 -1.722 16.997 1.00 75.34 H new ATOM 0 HB2 ALA A 125 -6.714 -1.269 16.506 1.00 75.34 H new ATOM 0 HB3 ALA A 125 -7.990 -0.031 16.590 1.00 75.34 H new ATOM 1810 N ASN A 126 -10.350 -2.256 14.533 1.00 74.31 N ATOM 1811 CA ASN A 126 -11.791 -2.207 14.312 1.00 32.24 C ATOM 1812 C ASN A 126 -12.549 -2.420 15.619 1.00 31.13 C ATOM 1813 O ASN A 126 -11.987 -2.901 16.604 1.00 50.44 O ATOM 1814 CB ASN A 126 -12.208 -3.266 13.290 1.00 70.31 C ATOM 1815 CG ASN A 126 -12.134 -4.673 13.852 1.00 51.05 C ATOM 1816 OD1 ASN A 126 -11.057 -5.262 13.942 1.00 44.53 O ATOM 1817 ND2 ASN A 126 -13.283 -5.219 14.232 1.00 12.03 N ATOM 0 H ASN A 126 -9.961 -3.198 14.569 1.00 74.31 H new ATOM 0 HA ASN A 126 -12.040 -1.219 13.924 1.00 32.24 H new ATOM 0 HB2 ASN A 126 -13.226 -3.064 12.956 1.00 70.31 H new ATOM 0 HB3 ASN A 126 -11.565 -3.194 12.413 1.00 70.31 H new ATOM 0 HD21 ASN A 126 -13.296 -6.164 14.617 1.00 12.03 H new ATOM 0 HD22 ASN A 126 -14.153 -4.694 14.139 1.00 12.03 H new ATOM 1824 N ASP A 127 -13.828 -2.060 15.621 1.00 43.33 N ATOM 1825 CA ASP A 127 -14.664 -2.213 16.806 1.00 41.44 C ATOM 1826 C ASP A 127 -14.153 -1.340 17.948 1.00 42.14 C ATOM 1827 O ASP A 127 -13.376 -0.410 17.732 1.00 60.23 O ATOM 1828 CB ASP A 127 -14.702 -3.677 17.244 1.00 65.41 C ATOM 1829 CG ASP A 127 -16.074 -4.101 17.730 1.00 64.21 C ATOM 1830 OD1 ASP A 127 -16.952 -4.353 16.879 1.00 31.33 O ATOM 1831 OD2 ASP A 127 -16.269 -4.180 18.961 1.00 12.01 O ATOM 0 H ASP A 127 -14.308 -1.660 14.815 1.00 43.33 H new ATOM 0 HA ASP A 127 -15.674 -1.892 16.552 1.00 41.44 H new ATOM 0 HB2 ASP A 127 -14.404 -4.311 16.409 1.00 65.41 H new ATOM 0 HB3 ASP A 127 -13.974 -3.834 18.039 1.00 65.41 H new ATOM 1836 N ALA A 128 -14.595 -1.646 19.163 1.00 53.31 N ATOM 1837 CA ALA A 128 -14.182 -0.890 20.339 1.00 70.11 C ATOM 1838 C ALA A 128 -12.662 -0.796 20.425 1.00 34.52 C ATOM 1839 O ALA A 128 -12.121 0.141 21.011 1.00 10.00 O ATOM 1840 CB ALA A 128 -14.746 -1.527 21.600 1.00 0.14 C ATOM 0 H ALA A 128 -15.239 -2.412 19.359 1.00 53.31 H new ATOM 0 HA ALA A 128 -14.578 0.122 20.248 1.00 70.11 H new ATOM 0 HB1 ALA A 128 -14.430 -0.952 22.471 1.00 0.14 H new ATOM 0 HB2 ALA A 128 -15.835 -1.536 21.547 1.00 0.14 H new ATOM 0 HB3 ALA A 128 -14.378 -2.549 21.687 1.00 0.14 H new ATOM 1846 N SER A 129 -11.980 -1.774 19.839 1.00 64.45 N ATOM 1847 CA SER A 129 -10.522 -1.804 19.853 1.00 22.43 C ATOM 1848 C SER A 129 -9.946 -0.558 19.187 1.00 31.42 C ATOM 1849 O SER A 129 -8.812 -0.164 19.457 1.00 73.33 O ATOM 1850 CB SER A 129 -10.009 -3.059 19.144 1.00 52.05 C ATOM 1851 OG SER A 129 -9.172 -3.821 19.996 1.00 45.33 O ATOM 0 H SER A 129 -12.413 -2.556 19.348 1.00 64.45 H new ATOM 0 HA SER A 129 -10.194 -1.823 20.892 1.00 22.43 H new ATOM 0 HB2 SER A 129 -10.853 -3.668 18.819 1.00 52.05 H new ATOM 0 HB3 SER A 129 -9.458 -2.774 18.248 1.00 52.05 H new ATOM 0 HG SER A 129 -8.859 -4.618 19.520 1.00 45.33 H new ATOM 1857 N GLY A 130 -10.738 0.058 18.315 1.00 64.05 N ATOM 1858 CA GLY A 130 -10.291 1.253 17.623 1.00 64.35 C ATOM 1859 C GLY A 130 -10.979 2.506 18.125 1.00 33.14 C ATOM 1860 O GLY A 130 -11.303 3.402 17.344 1.00 21.41 O ATOM 0 H GLY A 130 -11.681 -0.249 18.075 1.00 64.05 H new ATOM 0 HA2 GLY A 130 -9.213 1.359 17.748 1.00 64.35 H new ATOM 0 HA3 GLY A 130 -10.479 1.142 16.555 1.00 64.35 H new ATOM 1864 N LEU A 131 -11.206 2.570 19.433 1.00 51.33 N ATOM 1865 CA LEU A 131 -11.863 3.723 20.039 1.00 21.14 C ATOM 1866 C LEU A 131 -11.905 3.589 21.558 1.00 22.32 C ATOM 1867 O LEU A 131 -12.854 4.033 22.205 1.00 62.23 O ATOM 1868 CB LEU A 131 -13.283 3.873 19.490 1.00 4.40 C ATOM 1869 CG LEU A 131 -14.178 2.638 19.596 1.00 43.21 C ATOM 1870 CD1 LEU A 131 -15.207 2.818 20.701 1.00 51.02 C ATOM 1871 CD2 LEU A 131 -14.863 2.361 18.266 1.00 72.31 C ATOM 0 H LEU A 131 -10.945 1.838 20.093 1.00 51.33 H new ATOM 0 HA LEU A 131 -11.286 4.613 19.786 1.00 21.14 H new ATOM 0 HB2 LEU A 131 -13.769 4.695 20.015 1.00 4.40 H new ATOM 0 HB3 LEU A 131 -13.217 4.160 18.441 1.00 4.40 H new ATOM 0 HG LEU A 131 -13.554 1.780 19.846 1.00 43.21 H new ATOM 0 HD11 LEU A 131 -15.835 1.929 20.762 1.00 51.02 H new ATOM 0 HD12 LEU A 131 -14.697 2.967 21.653 1.00 51.02 H new ATOM 0 HD13 LEU A 131 -15.828 3.687 20.482 1.00 51.02 H new ATOM 0 HD21 LEU A 131 -15.496 1.479 18.360 1.00 72.31 H new ATOM 0 HD22 LEU A 131 -15.475 3.219 17.986 1.00 72.31 H new ATOM 0 HD23 LEU A 131 -14.109 2.187 17.498 1.00 72.31 H new ATOM 1883 N ASP A 132 -10.869 2.976 22.121 1.00 35.14 N ATOM 1884 CA ASP A 132 -10.786 2.786 23.565 1.00 41.20 C ATOM 1885 C ASP A 132 -9.856 3.818 24.196 1.00 63.33 C ATOM 1886 O ASP A 132 -8.662 3.857 23.897 1.00 1.11 O ATOM 1887 CB ASP A 132 -10.295 1.374 23.888 1.00 74.13 C ATOM 1888 CG ASP A 132 -11.097 0.722 24.997 1.00 74.23 C ATOM 1889 OD1 ASP A 132 -11.166 1.303 26.099 1.00 12.54 O ATOM 1890 OD2 ASP A 132 -11.656 -0.371 24.762 1.00 4.32 O ATOM 0 H ASP A 132 -10.076 2.602 21.600 1.00 35.14 H new ATOM 0 HA ASP A 132 -11.784 2.919 23.982 1.00 41.20 H new ATOM 0 HB2 ASP A 132 -10.354 0.758 22.991 1.00 74.13 H new ATOM 0 HB3 ASP A 132 -9.245 1.415 24.179 1.00 74.13 H new ATOM 1895 N PHE A 133 -10.411 4.652 25.069 1.00 43.05 N ATOM 1896 CA PHE A 133 -9.631 5.686 25.740 1.00 34.40 C ATOM 1897 C PHE A 133 -8.389 5.090 26.397 1.00 75.13 C ATOM 1898 O PHE A 133 -7.299 5.653 26.309 1.00 23.51 O ATOM 1899 CB PHE A 133 -10.486 6.397 26.791 1.00 73.11 C ATOM 1900 CG PHE A 133 -11.787 6.920 26.252 1.00 71.43 C ATOM 1901 CD1 PHE A 133 -11.812 7.718 25.119 1.00 32.43 C ATOM 1902 CD2 PHE A 133 -12.985 6.613 26.878 1.00 43.35 C ATOM 1903 CE1 PHE A 133 -13.007 8.200 24.620 1.00 15.02 C ATOM 1904 CE2 PHE A 133 -14.183 7.092 26.383 1.00 50.32 C ATOM 1905 CZ PHE A 133 -14.194 7.888 25.254 1.00 73.34 C ATOM 0 H PHE A 133 -11.397 4.632 25.328 1.00 43.05 H new ATOM 0 HA PHE A 133 -9.312 6.410 24.990 1.00 34.40 H new ATOM 0 HB2 PHE A 133 -10.692 5.706 27.608 1.00 73.11 H new ATOM 0 HB3 PHE A 133 -9.916 7.226 27.211 1.00 73.11 H new ATOM 0 HD1 PHE A 133 -10.887 7.966 24.620 1.00 32.43 H new ATOM 0 HD2 PHE A 133 -12.982 5.993 27.762 1.00 43.35 H new ATOM 0 HE1 PHE A 133 -13.013 8.820 23.736 1.00 15.02 H new ATOM 0 HE2 PHE A 133 -15.110 6.844 26.878 1.00 50.32 H new ATOM 0 HZ PHE A 133 -15.129 8.266 24.868 1.00 73.34 H new ATOM 1915 N GLU A 134 -8.565 3.948 27.055 1.00 52.23 N ATOM 1916 CA GLU A 134 -7.459 3.277 27.727 1.00 12.15 C ATOM 1917 C GLU A 134 -6.394 2.845 26.724 1.00 4.21 C ATOM 1918 O GLU A 134 -5.201 2.864 27.024 1.00 5.14 O ATOM 1919 CB GLU A 134 -7.968 2.060 28.503 1.00 1.33 C ATOM 1920 CG GLU A 134 -7.678 2.124 29.993 1.00 24.44 C ATOM 1921 CD GLU A 134 -8.132 0.878 30.730 1.00 52.43 C ATOM 1922 OE1 GLU A 134 -7.405 -0.136 30.687 1.00 51.23 O ATOM 1923 OE2 GLU A 134 -9.216 0.919 31.349 1.00 22.15 O ATOM 0 H GLU A 134 -9.462 3.469 27.137 1.00 52.23 H new ATOM 0 HA GLU A 134 -7.010 3.983 28.426 1.00 12.15 H new ATOM 0 HB2 GLU A 134 -9.044 1.969 28.354 1.00 1.33 H new ATOM 0 HB3 GLU A 134 -7.512 1.160 28.091 1.00 1.33 H new ATOM 0 HG2 GLU A 134 -6.608 2.262 30.145 1.00 24.44 H new ATOM 0 HG3 GLU A 134 -8.176 2.995 30.419 1.00 24.44 H new ATOM 1930 N GLU A 135 -6.835 2.456 25.532 1.00 22.10 N ATOM 1931 CA GLU A 135 -5.919 2.018 24.485 1.00 31.21 C ATOM 1932 C GLU A 135 -5.077 3.184 23.976 1.00 52.23 C ATOM 1933 O GLU A 135 -3.863 3.062 23.813 1.00 3.21 O ATOM 1934 CB GLU A 135 -6.697 1.391 23.326 1.00 42.31 C ATOM 1935 CG GLU A 135 -5.808 0.759 22.268 1.00 30.00 C ATOM 1936 CD GLU A 135 -5.876 -0.756 22.278 1.00 11.23 C ATOM 1937 OE1 GLU A 135 -5.305 -1.368 23.205 1.00 62.43 O ATOM 1938 OE2 GLU A 135 -6.500 -1.328 21.361 1.00 60.53 O ATOM 0 H GLU A 135 -7.820 2.435 25.267 1.00 22.10 H new ATOM 0 HA GLU A 135 -5.251 1.270 24.911 1.00 31.21 H new ATOM 0 HB2 GLU A 135 -7.373 0.632 23.721 1.00 42.31 H new ATOM 0 HB3 GLU A 135 -7.316 2.157 22.858 1.00 42.31 H new ATOM 0 HG2 GLU A 135 -6.103 1.126 21.285 1.00 30.00 H new ATOM 0 HG3 GLU A 135 -4.777 1.074 22.430 1.00 30.00 H new ATOM 1945 N ILE A 136 -5.731 4.313 23.725 1.00 14.34 N ATOM 1946 CA ILE A 136 -5.044 5.501 23.235 1.00 2.31 C ATOM 1947 C ILE A 136 -4.030 6.010 24.255 1.00 72.14 C ATOM 1948 O ILE A 136 -2.885 6.306 23.912 1.00 14.25 O ATOM 1949 CB ILE A 136 -6.037 6.632 22.908 1.00 71.13 C ATOM 1950 CG1 ILE A 136 -7.025 6.176 21.832 1.00 52.40 C ATOM 1951 CG2 ILE A 136 -5.291 7.878 22.456 1.00 42.23 C ATOM 1952 CD1 ILE A 136 -8.309 6.977 21.813 1.00 62.51 C ATOM 0 H ILE A 136 -6.736 4.430 23.853 1.00 14.34 H new ATOM 0 HA ILE A 136 -4.524 5.210 22.322 1.00 2.31 H new ATOM 0 HB ILE A 136 -6.598 6.876 23.810 1.00 71.13 H new ATOM 0 HG12 ILE A 136 -6.546 6.249 20.856 1.00 52.40 H new ATOM 0 HG13 ILE A 136 -7.264 5.125 21.992 1.00 52.40 H new ATOM 0 HG21 ILE A 136 -6.007 8.668 22.229 1.00 42.23 H new ATOM 0 HG22 ILE A 136 -4.623 8.211 23.251 1.00 42.23 H new ATOM 0 HG23 ILE A 136 -4.708 7.649 21.564 1.00 42.23 H new ATOM 0 HD11 ILE A 136 -8.962 6.599 21.026 1.00 62.51 H new ATOM 0 HD12 ILE A 136 -8.810 6.884 22.776 1.00 62.51 H new ATOM 0 HD13 ILE A 136 -8.081 8.026 21.623 1.00 62.51 H new ATOM 1964 N SER A 137 -4.459 6.107 25.509 1.00 25.21 N ATOM 1965 CA SER A 137 -3.589 6.581 26.579 1.00 0.43 C ATOM 1966 C SER A 137 -2.403 5.641 26.773 1.00 34.12 C ATOM 1967 O SER A 137 -1.276 6.083 26.997 1.00 54.11 O ATOM 1968 CB SER A 137 -4.375 6.706 27.886 1.00 3.01 C ATOM 1969 OG SER A 137 -5.337 7.743 27.806 1.00 71.05 O ATOM 0 H SER A 137 -5.403 5.864 25.809 1.00 25.21 H new ATOM 0 HA SER A 137 -3.209 7.563 26.296 1.00 0.43 H new ATOM 0 HB2 SER A 137 -4.872 5.761 28.107 1.00 3.01 H new ATOM 0 HB3 SER A 137 -3.689 6.905 28.709 1.00 3.01 H new ATOM 0 HG SER A 137 -6.141 7.409 27.356 1.00 71.05 H new ATOM 1975 N ARG A 138 -2.667 4.341 26.686 1.00 43.23 N ATOM 1976 CA ARG A 138 -1.623 3.337 26.853 1.00 41.24 C ATOM 1977 C ARG A 138 -0.603 3.420 25.721 1.00 40.04 C ATOM 1978 O ARG A 138 0.594 3.224 25.933 1.00 51.51 O ATOM 1979 CB ARG A 138 -2.236 1.936 26.900 1.00 42.42 C ATOM 1980 CG ARG A 138 -1.204 0.820 26.919 1.00 40.55 C ATOM 1981 CD ARG A 138 -0.336 0.885 28.166 1.00 75.22 C ATOM 1982 NE ARG A 138 -1.136 0.933 29.387 1.00 72.41 N ATOM 1983 CZ ARG A 138 -0.646 1.273 30.574 1.00 51.54 C ATOM 1984 NH1 ARG A 138 0.634 1.595 30.698 1.00 1.22 N ATOM 1985 NH2 ARG A 138 -1.437 1.293 31.639 1.00 52.54 N ATOM 0 H ARG A 138 -3.594 3.959 26.501 1.00 43.23 H new ATOM 0 HA ARG A 138 -1.111 3.534 27.795 1.00 41.24 H new ATOM 0 HB2 ARG A 138 -2.865 1.853 27.787 1.00 42.42 H new ATOM 0 HB3 ARG A 138 -2.886 1.804 26.035 1.00 42.42 H new ATOM 0 HG2 ARG A 138 -1.709 -0.145 26.876 1.00 40.55 H new ATOM 0 HG3 ARG A 138 -0.574 0.890 26.032 1.00 40.55 H new ATOM 0 HD2 ARG A 138 0.321 0.015 28.197 1.00 75.22 H new ATOM 0 HD3 ARG A 138 0.304 1.766 28.117 1.00 75.22 H new ATOM 0 HE ARG A 138 -2.125 0.692 29.325 1.00 72.41 H new ATOM 0 HH11 ARG A 138 1.245 1.582 29.881 1.00 1.22 H new ATOM 0 HH12 ARG A 138 1.008 1.856 31.610 1.00 1.22 H new ATOM 0 HH21 ARG A 138 -2.423 1.047 31.547 1.00 52.54 H new ATOM 0 HH22 ARG A 138 -1.059 1.554 32.550 1.00 52.54 H new ATOM 1999 N LYS A 139 -1.085 3.711 24.517 1.00 30.40 N ATOM 2000 CA LYS A 139 -0.217 3.820 23.351 1.00 40.34 C ATOM 2001 C LYS A 139 0.697 5.036 23.465 1.00 24.23 C ATOM 2002 O LYS A 139 1.907 4.937 23.257 1.00 53.31 O ATOM 2003 CB LYS A 139 -1.054 3.917 22.073 1.00 14.54 C ATOM 2004 CG LYS A 139 -0.939 2.697 21.176 1.00 12.33 C ATOM 2005 CD LYS A 139 0.496 2.463 20.735 1.00 11.01 C ATOM 2006 CE LYS A 139 0.565 1.994 19.290 1.00 62.20 C ATOM 2007 NZ LYS A 139 1.862 1.328 18.985 1.00 73.14 N ATOM 0 H LYS A 139 -2.073 3.876 24.324 1.00 30.40 H new ATOM 0 HA LYS A 139 0.402 2.924 23.306 1.00 40.34 H new ATOM 0 HB2 LYS A 139 -2.100 4.061 22.344 1.00 14.54 H new ATOM 0 HB3 LYS A 139 -0.745 4.800 21.513 1.00 14.54 H new ATOM 0 HG2 LYS A 139 -1.305 1.818 21.707 1.00 12.33 H new ATOM 0 HG3 LYS A 139 -1.573 2.828 20.299 1.00 12.33 H new ATOM 0 HD2 LYS A 139 1.067 3.385 20.847 1.00 11.01 H new ATOM 0 HD3 LYS A 139 0.960 1.719 21.383 1.00 11.01 H new ATOM 0 HE2 LYS A 139 -0.254 1.302 19.093 1.00 62.20 H new ATOM 0 HE3 LYS A 139 0.429 2.846 18.624 1.00 62.20 H new ATOM 0 HZ1 LYS A 139 2.043 1.372 17.962 1.00 73.14 H new ATOM 0 HZ2 LYS A 139 2.629 1.812 19.493 1.00 73.14 H new ATOM 0 HZ3 LYS A 139 1.821 0.334 19.287 1.00 73.14 H new ATOM 2021 N VAL A 140 0.112 6.182 23.799 1.00 22.45 N ATOM 2022 CA VAL A 140 0.875 7.416 23.945 1.00 72.34 C ATOM 2023 C VAL A 140 1.807 7.347 25.149 1.00 41.31 C ATOM 2024 O VAL A 140 2.932 7.845 25.106 1.00 24.14 O ATOM 2025 CB VAL A 140 -0.054 8.635 24.097 1.00 70.11 C ATOM 2026 CG1 VAL A 140 -0.964 8.466 25.304 1.00 70.41 C ATOM 2027 CG2 VAL A 140 0.761 9.914 24.209 1.00 40.54 C ATOM 0 H VAL A 140 -0.888 6.281 23.974 1.00 22.45 H new ATOM 0 HA VAL A 140 1.468 7.531 23.037 1.00 72.34 H new ATOM 0 HB VAL A 140 -0.680 8.706 23.208 1.00 70.11 H new ATOM 0 HG11 VAL A 140 -1.613 9.337 25.395 1.00 70.41 H new ATOM 0 HG12 VAL A 140 -1.573 7.571 25.178 1.00 70.41 H new ATOM 0 HG13 VAL A 140 -0.359 8.369 26.205 1.00 70.41 H new ATOM 0 HG21 VAL A 140 0.089 10.766 24.316 1.00 40.54 H new ATOM 0 HG22 VAL A 140 1.413 9.855 25.080 1.00 40.54 H new ATOM 0 HG23 VAL A 140 1.366 10.040 23.311 1.00 40.54 H new ATOM 2037 N LYS A 141 1.332 6.727 26.223 1.00 32.15 N ATOM 2038 CA LYS A 141 2.122 6.590 27.441 1.00 3.50 C ATOM 2039 C LYS A 141 3.261 5.595 27.242 1.00 34.20 C ATOM 2040 O LYS A 141 4.351 5.767 27.787 1.00 51.12 O ATOM 2041 CB LYS A 141 1.234 6.140 28.603 1.00 73.03 C ATOM 2042 CG LYS A 141 1.945 6.132 29.945 1.00 72.02 C ATOM 2043 CD LYS A 141 1.021 5.678 31.063 1.00 62.14 C ATOM 2044 CE LYS A 141 1.601 6.001 32.431 1.00 65.20 C ATOM 2045 NZ LYS A 141 0.982 5.176 33.505 1.00 53.20 N ATOM 0 H LYS A 141 0.402 6.311 26.275 1.00 32.15 H new ATOM 0 HA LYS A 141 2.551 7.564 27.677 1.00 3.50 H new ATOM 0 HB2 LYS A 141 0.368 6.799 28.664 1.00 73.03 H new ATOM 0 HB3 LYS A 141 0.858 5.138 28.395 1.00 73.03 H new ATOM 0 HG2 LYS A 141 2.810 5.471 29.896 1.00 72.02 H new ATOM 0 HG3 LYS A 141 2.320 7.131 30.165 1.00 72.02 H new ATOM 0 HD2 LYS A 141 0.051 6.163 30.954 1.00 62.14 H new ATOM 0 HD3 LYS A 141 0.851 4.604 30.983 1.00 62.14 H new ATOM 0 HE2 LYS A 141 2.678 5.832 32.418 1.00 65.20 H new ATOM 0 HE3 LYS A 141 1.447 7.058 32.650 1.00 65.20 H new ATOM 0 HZ1 LYS A 141 1.404 5.426 34.422 1.00 53.20 H new ATOM 0 HZ2 LYS A 141 -0.042 5.356 33.535 1.00 53.20 H new ATOM 0 HZ3 LYS A 141 1.151 4.169 33.310 1.00 53.20 H new ATOM 2059 N SER A 142 3.000 4.554 26.457 1.00 1.12 N ATOM 2060 CA SER A 142 4.002 3.530 26.188 1.00 24.23 C ATOM 2061 C SER A 142 5.044 4.036 25.195 1.00 11.30 C ATOM 2062 O SER A 142 6.212 3.655 25.256 1.00 40.43 O ATOM 2063 CB SER A 142 3.336 2.264 25.645 1.00 40.40 C ATOM 2064 OG SER A 142 2.605 1.597 26.659 1.00 4.14 O ATOM 0 H SER A 142 2.103 4.398 25.997 1.00 1.12 H new ATOM 0 HA SER A 142 4.504 3.294 27.126 1.00 24.23 H new ATOM 0 HB2 SER A 142 2.669 2.524 24.823 1.00 40.40 H new ATOM 0 HB3 SER A 142 4.095 1.595 25.240 1.00 40.40 H new ATOM 0 HG SER A 142 1.657 1.837 26.591 1.00 4.14 H new ATOM 2070 N ASN A 143 4.610 4.898 24.281 1.00 63.14 N ATOM 2071 CA ASN A 143 5.504 5.457 23.273 1.00 41.21 C ATOM 2072 C ASN A 143 6.213 4.349 22.500 1.00 42.42 C ATOM 2073 O ASN A 143 7.316 4.543 21.989 1.00 43.42 O ATOM 2074 CB ASN A 143 6.535 6.377 23.930 1.00 65.31 C ATOM 2075 CG ASN A 143 5.918 7.661 24.448 1.00 40.42 C ATOM 2076 OD1 ASN A 143 5.360 8.448 23.682 1.00 30.52 O ATOM 2077 ND2 ASN A 143 6.016 7.880 25.754 1.00 51.21 N ATOM 0 H ASN A 143 3.646 5.224 24.218 1.00 63.14 H new ATOM 0 HA ASN A 143 4.904 6.037 22.572 1.00 41.21 H new ATOM 0 HB2 ASN A 143 7.015 5.850 24.754 1.00 65.31 H new ATOM 0 HB3 ASN A 143 7.315 6.618 23.208 1.00 65.31 H new ATOM 0 HD21 ASN A 143 5.620 8.728 26.160 1.00 51.21 H new ATOM 0 HD22 ASN A 143 6.487 7.200 26.351 1.00 51.21 H new ATOM 2084 N ARG A 144 5.572 3.188 22.418 1.00 13.41 N ATOM 2085 CA ARG A 144 6.141 2.049 21.708 1.00 52.41 C ATOM 2086 C ARG A 144 5.194 1.562 20.615 1.00 21.10 C ATOM 2087 O ARG A 144 4.332 2.307 20.150 1.00 75.12 O ATOM 2088 CB ARG A 144 6.440 0.910 22.684 1.00 13.22 C ATOM 2089 CG ARG A 144 7.912 0.785 23.042 1.00 74.23 C ATOM 2090 CD ARG A 144 8.193 -0.502 23.801 1.00 32.32 C ATOM 2091 NE ARG A 144 8.284 -1.655 22.909 1.00 21.24 N ATOM 2092 CZ ARG A 144 9.315 -1.880 22.103 1.00 61.43 C ATOM 2093 NH1 ARG A 144 10.337 -1.036 22.076 1.00 23.43 N ATOM 2094 NH2 ARG A 144 9.325 -2.952 21.320 1.00 23.24 N ATOM 0 H ARG A 144 4.658 3.011 22.835 1.00 13.41 H new ATOM 0 HA ARG A 144 7.072 2.371 21.241 1.00 52.41 H new ATOM 0 HB2 ARG A 144 5.865 1.065 23.597 1.00 13.22 H new ATOM 0 HB3 ARG A 144 6.100 -0.029 22.248 1.00 13.22 H new ATOM 0 HG2 ARG A 144 8.512 0.811 22.133 1.00 74.23 H new ATOM 0 HG3 ARG A 144 8.214 1.639 23.648 1.00 74.23 H new ATOM 0 HD2 ARG A 144 9.125 -0.399 24.356 1.00 32.32 H new ATOM 0 HD3 ARG A 144 7.403 -0.671 24.533 1.00 32.32 H new ATOM 0 HE ARG A 144 7.514 -2.324 22.905 1.00 21.24 H new ATOM 0 HH11 ARG A 144 10.333 -0.211 22.676 1.00 23.43 H new ATOM 0 HH12 ARG A 144 11.127 -1.212 21.456 1.00 23.43 H new ATOM 0 HH21 ARG A 144 8.540 -3.603 21.337 1.00 23.24 H new ATOM 0 HH22 ARG A 144 10.117 -3.124 20.701 1.00 23.24 H new