USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=22 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 92 SER OG : rot -93:sc= 1.26 USER MOD Set 1.2: A 106 TYR OH : rot -166:sc= 0.342 USER MOD Set 2.1: A 20 CYS SG : rot 150:sc= -0.238 USER MOD Set 2.2: A 71 TYR OH : rot 180:sc= -1.61! USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 77:sc= 0.564 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 29 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.34) USER MOD Single : A 30 LYS NZ :NH3+ 146:sc= -0.0387 (180deg=-0.293) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= -0.796 USER MOD Single : A 34 TYR OH : rot 72:sc= 0.647 USER MOD Single : A 37 MET CE :methyl 172:sc= -2.5 (180deg=-2.67) USER MOD Single : A 38 HIS : no HD1:sc= -1.68 K(o=-1.7,f=-4.1) USER MOD Single : A 42 GLN : amide:sc= -0.509 K(o=-0.51,f=-5.5!) 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= 0.803 USER MOD Single : A 56 ASN : amide:sc= -0.0119 X(o=-0.012,f=0) USER MOD Single : A 59 GLN : amide:sc= -2.25 K(o=-2.3,f=-1.1) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.5 X(o=-0.5,f=-0.64) USER MOD Single : A 70 CYS SG : rot -160:sc= -0.177 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -0.904 K(o=-0.9,f=-3) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 160:sc= -3.34! USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot -71:sc= 1.19 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.207 USER MOD Single : A 117 THR OG1 : rot -77:sc= 1.26 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= -1.41 K(o=-1.4,f=-0.43) USER MOD Single : A 124 GLN : amide:sc= -2.31 X(o=-2.3,f=-2.7) USER MOD Single : A 126 ASN : amide:sc= -1.93 K(o=-1.9,f=-1.2) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -75:sc= 0.656 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -5.020 6.382 -3.191 1.00 44.12 N ATOM 64 CA VAL A 14 -5.656 7.277 -2.233 1.00 15.42 C ATOM 65 C VAL A 14 -4.667 8.310 -1.704 1.00 32.43 C ATOM 66 O VAL A 14 -3.831 8.004 -0.853 1.00 51.43 O ATOM 67 CB VAL A 14 -6.252 6.497 -1.046 1.00 4.14 C ATOM 68 CG1 VAL A 14 -6.631 7.446 0.081 1.00 52.12 C ATOM 69 CG2 VAL A 14 -7.454 5.681 -1.494 1.00 73.13 C ATOM 0 HA VAL A 14 -6.460 7.787 -2.763 1.00 15.42 H new ATOM 0 HB VAL A 14 -5.495 5.809 -0.670 1.00 4.14 H new ATOM 0 HG11 VAL A 14 -7.050 6.877 0.911 1.00 52.12 H new ATOM 0 HG12 VAL A 14 -5.744 7.981 0.420 1.00 52.12 H new ATOM 0 HG13 VAL A 14 -7.371 8.161 -0.279 1.00 52.12 H new ATOM 0 HG21 VAL A 14 -7.862 5.137 -0.642 1.00 73.13 H new ATOM 0 HG22 VAL A 14 -8.216 6.347 -1.898 1.00 73.13 H new ATOM 0 HG23 VAL A 14 -7.147 4.973 -2.264 1.00 73.13 H new ATOM 79 N SER A 15 -4.769 9.533 -2.212 1.00 44.43 N ATOM 80 CA SER A 15 -3.880 10.611 -1.793 1.00 53.34 C ATOM 81 C SER A 15 -4.565 11.514 -0.772 1.00 34.23 C ATOM 82 O SER A 15 -5.735 11.867 -0.923 1.00 71.35 O ATOM 83 CB SER A 15 -3.438 11.436 -3.004 1.00 33.01 C ATOM 84 OG SER A 15 -2.030 11.593 -3.027 1.00 52.51 O ATOM 0 H SER A 15 -5.458 9.803 -2.914 1.00 44.43 H new ATOM 0 HA SER A 15 -3.002 10.164 -1.326 1.00 53.34 H new ATOM 0 HB2 SER A 15 -3.768 10.947 -3.921 1.00 33.01 H new ATOM 0 HB3 SER A 15 -3.916 12.415 -2.975 1.00 33.01 H new ATOM 0 HG SER A 15 -1.773 12.122 -3.811 1.00 52.51 H new ATOM 90 N VAL A 16 -3.828 11.884 0.270 1.00 22.13 N ATOM 91 CA VAL A 16 -4.362 12.746 1.318 1.00 52.14 C ATOM 92 C VAL A 16 -4.498 14.184 0.830 1.00 43.11 C ATOM 93 O VAL A 16 -3.523 14.798 0.396 1.00 20.43 O ATOM 94 CB VAL A 16 -3.470 12.723 2.573 1.00 11.20 C ATOM 95 CG1 VAL A 16 -2.039 13.099 2.218 1.00 34.34 C ATOM 96 CG2 VAL A 16 -4.026 13.656 3.638 1.00 33.24 C ATOM 0 H VAL A 16 -2.859 11.600 0.411 1.00 22.13 H new ATOM 0 HA VAL A 16 -5.348 12.358 1.576 1.00 52.14 H new ATOM 0 HB VAL A 16 -3.465 11.710 2.976 1.00 11.20 H new ATOM 0 HG11 VAL A 16 -1.423 13.077 3.117 1.00 34.34 H new ATOM 0 HG12 VAL A 16 -1.645 12.388 1.492 1.00 34.34 H new ATOM 0 HG13 VAL A 16 -2.022 14.101 1.790 1.00 34.34 H new ATOM 0 HG21 VAL A 16 -3.384 13.628 4.518 1.00 33.24 H new ATOM 0 HG22 VAL A 16 -4.062 14.673 3.248 1.00 33.24 H new ATOM 0 HG23 VAL A 16 -5.031 13.337 3.912 1.00 33.24 H new ATOM 106 N ALA A 17 -5.713 14.716 0.904 1.00 12.32 N ATOM 107 CA ALA A 17 -5.976 16.084 0.473 1.00 71.53 C ATOM 108 C ALA A 17 -5.290 17.090 1.390 1.00 14.31 C ATOM 109 O ALA A 17 -5.057 16.814 2.567 1.00 73.31 O ATOM 110 CB ALA A 17 -7.475 16.344 0.427 1.00 64.51 C ATOM 0 H ALA A 17 -6.531 14.221 1.258 1.00 12.32 H new ATOM 0 HA ALA A 17 -5.566 16.208 -0.529 1.00 71.53 H new ATOM 0 HB1 ALA A 17 -7.657 17.369 0.104 1.00 64.51 H new ATOM 0 HB2 ALA A 17 -7.943 15.654 -0.275 1.00 64.51 H new ATOM 0 HB3 ALA A 17 -7.901 16.196 1.419 1.00 64.51 H new ATOM 116 N ASP A 18 -4.969 18.258 0.844 1.00 32.11 N ATOM 117 CA ASP A 18 -4.310 19.306 1.614 1.00 50.50 C ATOM 118 C ASP A 18 -5.152 19.705 2.822 1.00 73.21 C ATOM 119 O ASP A 18 -4.622 20.143 3.842 1.00 32.43 O ATOM 120 CB ASP A 18 -4.050 20.529 0.733 1.00 61.05 C ATOM 121 CG ASP A 18 -2.860 20.337 -0.187 1.00 5.34 C ATOM 122 OD1 ASP A 18 -2.213 19.271 -0.107 1.00 13.44 O ATOM 123 OD2 ASP A 18 -2.575 21.253 -0.987 1.00 23.35 O ATOM 0 H ASP A 18 -5.155 18.503 -0.129 1.00 32.11 H new ATOM 0 HA ASP A 18 -3.357 18.915 1.971 1.00 50.50 H new ATOM 0 HB2 ASP A 18 -4.937 20.738 0.136 1.00 61.05 H new ATOM 0 HB3 ASP A 18 -3.879 21.400 1.366 1.00 61.05 H new ATOM 128 N GLU A 19 -6.467 19.551 2.697 1.00 22.53 N ATOM 129 CA GLU A 19 -7.382 19.896 3.779 1.00 42.33 C ATOM 130 C GLU A 19 -7.062 19.097 5.038 1.00 31.35 C ATOM 131 O GLU A 19 -7.053 19.638 6.145 1.00 55.13 O ATOM 132 CB GLU A 19 -8.829 19.641 3.353 1.00 12.22 C ATOM 133 CG GLU A 19 -9.086 18.216 2.892 1.00 10.40 C ATOM 134 CD GLU A 19 -10.071 18.144 1.741 1.00 10.24 C ATOM 135 OE1 GLU A 19 -9.724 18.604 0.633 1.00 35.42 O ATOM 136 OE2 GLU A 19 -11.189 17.628 1.950 1.00 61.42 O ATOM 0 H GLU A 19 -6.922 19.190 1.858 1.00 22.53 H new ATOM 0 HA GLU A 19 -7.258 20.956 4.002 1.00 42.33 H new ATOM 0 HB2 GLU A 19 -9.490 19.868 4.189 1.00 12.22 H new ATOM 0 HB3 GLU A 19 -9.088 20.327 2.546 1.00 12.22 H new ATOM 0 HG2 GLU A 19 -8.143 17.761 2.588 1.00 10.40 H new ATOM 0 HG3 GLU A 19 -9.467 17.631 3.729 1.00 10.40 H new ATOM 143 N CYS A 20 -6.801 17.806 4.862 1.00 4.33 N ATOM 144 CA CYS A 20 -6.482 16.931 5.984 1.00 24.34 C ATOM 145 C CYS A 20 -5.154 17.326 6.622 1.00 1.24 C ATOM 146 O CYS A 20 -5.026 17.358 7.846 1.00 31.25 O ATOM 147 CB CYS A 20 -6.425 15.474 5.522 1.00 40.14 C ATOM 148 SG CYS A 20 -7.877 14.940 4.586 1.00 33.24 S ATOM 0 H CYS A 20 -6.804 17.343 3.953 1.00 4.33 H new ATOM 0 HA CYS A 20 -7.269 17.038 6.730 1.00 24.34 H new ATOM 0 HB2 CYS A 20 -5.537 15.334 4.906 1.00 40.14 H new ATOM 0 HB3 CYS A 20 -6.312 14.831 6.395 1.00 40.14 H new ATOM 0 HG CYS A 20 -7.530 14.022 3.734 1.00 33.24 H new ATOM 154 N VAL A 21 -4.167 17.626 5.784 1.00 25.04 N ATOM 155 CA VAL A 21 -2.848 18.019 6.266 1.00 23.10 C ATOM 156 C VAL A 21 -2.932 19.257 7.151 1.00 54.40 C ATOM 157 O VAL A 21 -2.426 19.269 8.273 1.00 24.24 O ATOM 158 CB VAL A 21 -1.885 18.301 5.098 1.00 44.23 C ATOM 159 CG1 VAL A 21 -0.473 18.536 5.614 1.00 71.23 C ATOM 160 CG2 VAL A 21 -1.912 17.156 4.097 1.00 64.21 C ATOM 0 H VAL A 21 -4.256 17.604 4.768 1.00 25.04 H new ATOM 0 HA VAL A 21 -2.463 17.184 6.851 1.00 23.10 H new ATOM 0 HB VAL A 21 -2.215 19.206 4.589 1.00 44.23 H new ATOM 0 HG11 VAL A 21 0.193 18.734 4.774 1.00 71.23 H new ATOM 0 HG12 VAL A 21 -0.470 19.392 6.289 1.00 71.23 H new ATOM 0 HG13 VAL A 21 -0.129 17.651 6.149 1.00 71.23 H new ATOM 0 HG21 VAL A 21 -1.226 17.372 3.278 1.00 64.21 H new ATOM 0 HG22 VAL A 21 -1.608 16.233 4.591 1.00 64.21 H new ATOM 0 HG23 VAL A 21 -2.922 17.041 3.703 1.00 64.21 H new ATOM 170 N THR A 22 -3.577 20.301 6.639 1.00 53.22 N ATOM 171 CA THR A 22 -3.728 21.546 7.382 1.00 75.13 C ATOM 172 C THR A 22 -4.536 21.331 8.657 1.00 70.34 C ATOM 173 O THR A 22 -4.208 21.876 9.710 1.00 41.12 O ATOM 174 CB THR A 22 -4.416 22.629 6.529 1.00 4.10 C ATOM 175 OG1 THR A 22 -3.897 22.604 5.195 1.00 43.54 O ATOM 176 CG2 THR A 22 -4.206 24.009 7.135 1.00 64.42 C ATOM 0 H THR A 22 -4.003 20.309 5.712 1.00 53.22 H new ATOM 0 HA THR A 22 -2.724 21.882 7.643 1.00 75.13 H new ATOM 0 HB THR A 22 -5.485 22.418 6.506 1.00 4.10 H new ATOM 0 HG1 THR A 22 -4.282 21.845 4.708 1.00 43.54 H new ATOM 0 HG21 THR A 22 -4.701 24.757 6.516 1.00 64.42 H new ATOM 0 HG22 THR A 22 -4.628 24.033 8.140 1.00 64.42 H new ATOM 0 HG23 THR A 22 -3.139 24.226 7.184 1.00 64.42 H new ATOM 184 N ALA A 23 -5.593 20.532 8.554 1.00 32.21 N ATOM 185 CA ALA A 23 -6.446 20.243 9.700 1.00 20.53 C ATOM 186 C ALA A 23 -5.643 19.626 10.840 1.00 22.14 C ATOM 187 O ALA A 23 -5.801 20.006 12.001 1.00 4.14 O ATOM 188 CB ALA A 23 -7.583 19.317 9.292 1.00 3.11 C ATOM 0 H ALA A 23 -5.879 20.074 7.689 1.00 32.21 H new ATOM 0 HA ALA A 23 -6.867 21.184 10.054 1.00 20.53 H new ATOM 0 HB1 ALA A 23 -8.212 19.110 10.158 1.00 3.11 H new ATOM 0 HB2 ALA A 23 -8.180 19.795 8.516 1.00 3.11 H new ATOM 0 HB3 ALA A 23 -7.172 18.382 8.910 1.00 3.11 H new ATOM 194 N LEU A 24 -4.782 18.672 10.503 1.00 42.10 N ATOM 195 CA LEU A 24 -3.954 18.002 11.499 1.00 24.33 C ATOM 196 C LEU A 24 -2.905 18.954 12.065 1.00 24.52 C ATOM 197 O LEU A 24 -2.633 18.951 13.265 1.00 65.41 O ATOM 198 CB LEU A 24 -3.270 16.779 10.884 1.00 13.10 C ATOM 199 CG LEU A 24 -4.188 15.615 10.510 1.00 71.32 C ATOM 200 CD1 LEU A 24 -3.466 14.638 9.595 1.00 44.44 C ATOM 201 CD2 LEU A 24 -4.688 14.906 11.760 1.00 2.34 C ATOM 0 H LEU A 24 -4.639 18.345 9.547 1.00 42.10 H new ATOM 0 HA LEU A 24 -4.601 17.677 12.314 1.00 24.33 H new ATOM 0 HB2 LEU A 24 -2.737 17.098 9.988 1.00 13.10 H new ATOM 0 HB3 LEU A 24 -2.522 16.414 11.587 1.00 13.10 H new ATOM 0 HG LEU A 24 -5.049 16.015 9.974 1.00 71.32 H new ATOM 0 HD11 LEU A 24 -4.135 13.816 9.340 1.00 44.44 H new ATOM 0 HD12 LEU A 24 -3.158 15.152 8.684 1.00 44.44 H new ATOM 0 HD13 LEU A 24 -2.586 14.245 10.104 1.00 44.44 H new ATOM 0 HD21 LEU A 24 -5.340 14.081 11.474 1.00 2.34 H new ATOM 0 HD22 LEU A 24 -3.839 14.519 12.323 1.00 2.34 H new ATOM 0 HD23 LEU A 24 -5.244 15.610 12.380 1.00 2.34 H new ATOM 213 N ASN A 25 -2.321 19.769 11.193 1.00 65.42 N ATOM 214 CA ASN A 25 -1.302 20.728 11.606 1.00 74.40 C ATOM 215 C ASN A 25 -1.845 21.671 12.675 1.00 35.43 C ATOM 216 O ASN A 25 -1.192 21.918 13.689 1.00 50.41 O ATOM 217 CB ASN A 25 -0.812 21.533 10.401 1.00 1.12 C ATOM 218 CG ASN A 25 0.613 21.187 10.016 1.00 62.45 C ATOM 219 OD1 ASN A 25 1.546 21.392 10.793 1.00 53.04 O ATOM 220 ND2 ASN A 25 0.788 20.658 8.810 1.00 51.32 N ATOM 0 H ASN A 25 -2.536 19.785 10.196 1.00 65.42 H new ATOM 0 HA ASN A 25 -0.465 20.172 12.028 1.00 74.40 H new ATOM 0 HB2 ASN A 25 -1.470 21.348 9.552 1.00 1.12 H new ATOM 0 HB3 ASN A 25 -0.876 22.597 10.628 1.00 1.12 H new ATOM 0 HD21 ASN A 25 1.725 20.404 8.495 1.00 51.32 H new ATOM 0 HD22 ASN A 25 -0.014 20.506 8.199 1.00 51.32 H new ATOM 227 N ASP A 26 -3.044 22.193 12.442 1.00 35.30 N ATOM 228 CA ASP A 26 -3.677 23.107 13.386 1.00 41.34 C ATOM 229 C ASP A 26 -4.145 22.364 14.633 1.00 64.43 C ATOM 230 O ASP A 26 -4.056 22.881 15.747 1.00 23.00 O ATOM 231 CB ASP A 26 -4.860 23.817 12.726 1.00 75.42 C ATOM 232 CG ASP A 26 -4.588 24.172 11.277 1.00 34.42 C ATOM 233 OD1 ASP A 26 -3.455 24.600 10.975 1.00 72.34 O ATOM 234 OD2 ASP A 26 -5.509 24.022 10.446 1.00 1.23 O ATOM 0 H ASP A 26 -3.597 21.999 11.607 1.00 35.30 H new ATOM 0 HA ASP A 26 -2.938 23.850 13.685 1.00 41.34 H new ATOM 0 HB2 ASP A 26 -5.741 23.177 12.781 1.00 75.42 H new ATOM 0 HB3 ASP A 26 -5.091 24.725 13.282 1.00 75.42 H new ATOM 239 N LEU A 27 -4.644 21.148 14.438 1.00 43.00 N ATOM 240 CA LEU A 27 -5.127 20.333 15.547 1.00 61.40 C ATOM 241 C LEU A 27 -4.035 20.134 16.593 1.00 64.31 C ATOM 242 O LEU A 27 -4.284 20.243 17.794 1.00 60.54 O ATOM 243 CB LEU A 27 -5.611 18.975 15.035 1.00 54.25 C ATOM 244 CG LEU A 27 -6.416 18.132 16.025 1.00 43.13 C ATOM 245 CD1 LEU A 27 -7.907 18.347 15.821 1.00 53.33 C ATOM 246 CD2 LEU A 27 -6.063 16.659 15.880 1.00 21.14 C ATOM 0 H LEU A 27 -4.725 20.705 13.523 1.00 43.00 H new ATOM 0 HA LEU A 27 -5.961 20.857 16.014 1.00 61.40 H new ATOM 0 HB2 LEU A 27 -6.223 19.141 14.148 1.00 54.25 H new ATOM 0 HB3 LEU A 27 -4.742 18.398 14.719 1.00 54.25 H new ATOM 0 HG LEU A 27 -6.160 18.449 17.036 1.00 43.13 H new ATOM 0 HD11 LEU A 27 -8.463 17.739 16.534 1.00 53.33 H new ATOM 0 HD12 LEU A 27 -8.147 19.399 15.976 1.00 53.33 H new ATOM 0 HD13 LEU A 27 -8.181 18.058 14.806 1.00 53.33 H new ATOM 0 HD21 LEU A 27 -6.645 16.074 16.592 1.00 21.14 H new ATOM 0 HD22 LEU A 27 -6.291 16.328 14.867 1.00 21.14 H new ATOM 0 HD23 LEU A 27 -5.000 16.518 16.078 1.00 21.14 H new ATOM 258 N ARG A 28 -2.824 19.844 16.129 1.00 64.35 N ATOM 259 CA ARG A 28 -1.693 19.631 17.024 1.00 62.22 C ATOM 260 C ARG A 28 -1.375 20.900 17.809 1.00 24.10 C ATOM 261 O ARG A 28 -0.789 20.843 18.891 1.00 64.14 O ATOM 262 CB ARG A 28 -0.463 19.188 16.230 1.00 63.33 C ATOM 263 CG ARG A 28 0.389 20.343 15.730 1.00 13.52 C ATOM 264 CD ARG A 28 1.509 20.672 16.705 1.00 54.40 C ATOM 265 NE ARG A 28 2.778 20.073 16.303 1.00 60.42 N ATOM 266 CZ ARG A 28 3.944 20.378 16.861 1.00 63.44 C ATOM 267 NH1 ARG A 28 4.002 21.270 17.839 1.00 14.14 N ATOM 268 NH2 ARG A 28 5.057 19.789 16.440 1.00 74.12 N ATOM 0 H ARG A 28 -2.601 19.751 15.138 1.00 64.35 H new ATOM 0 HA ARG A 28 -1.963 18.846 17.730 1.00 62.22 H new ATOM 0 HB2 ARG A 28 0.150 18.541 16.857 1.00 63.33 H new ATOM 0 HB3 ARG A 28 -0.787 18.591 15.377 1.00 63.33 H new ATOM 0 HG2 ARG A 28 0.814 20.090 14.759 1.00 13.52 H new ATOM 0 HG3 ARG A 28 -0.238 21.223 15.584 1.00 13.52 H new ATOM 0 HD2 ARG A 28 1.624 21.754 16.773 1.00 54.40 H new ATOM 0 HD3 ARG A 28 1.240 20.317 17.700 1.00 54.40 H new ATOM 0 HE ARG A 28 2.769 19.382 15.552 1.00 60.42 H new ATOM 0 HH11 ARG A 28 3.149 21.725 18.166 1.00 14.14 H new ATOM 0 HH12 ARG A 28 4.899 21.502 18.265 1.00 14.14 H new ATOM 0 HH21 ARG A 28 5.017 19.102 15.687 1.00 74.12 H new ATOM 0 HH22 ARG A 28 5.952 20.024 16.869 1.00 74.12 H new ATOM 282 N HIS A 29 -1.764 22.045 17.257 1.00 73.41 N ATOM 283 CA HIS A 29 -1.521 23.328 17.906 1.00 43.25 C ATOM 284 C HIS A 29 -2.738 23.769 18.713 1.00 21.51 C ATOM 285 O HIS A 29 -2.894 24.949 19.027 1.00 31.44 O ATOM 286 CB HIS A 29 -1.173 24.392 16.864 1.00 51.01 C ATOM 287 CG HIS A 29 0.127 25.087 17.129 1.00 53.45 C ATOM 288 ND1 HIS A 29 0.587 25.364 18.398 1.00 1.44 N ATOM 289 CD2 HIS A 29 1.067 25.561 16.277 1.00 32.15 C ATOM 290 CE1 HIS A 29 1.753 25.980 18.317 1.00 22.11 C ATOM 291 NE2 HIS A 29 2.067 26.111 17.041 1.00 60.12 N ATOM 0 H HIS A 29 -2.249 22.110 16.362 1.00 73.41 H new ATOM 0 HA HIS A 29 -0.679 23.208 18.588 1.00 43.25 H new ATOM 0 HB2 HIS A 29 -1.132 23.925 15.880 1.00 51.01 H new ATOM 0 HB3 HIS A 29 -1.972 25.133 16.832 1.00 51.01 H new ATOM 0 HD2 HIS A 29 1.036 25.515 15.198 1.00 32.15 H new ATOM 0 HE1 HIS A 29 2.348 26.319 19.152 1.00 22.11 H new ATOM 0 HE2 HIS A 29 2.915 26.550 16.681 1.00 60.12 H new ATOM 299 N LYS A 30 -3.599 22.812 19.046 1.00 44.53 N ATOM 300 CA LYS A 30 -4.802 23.100 19.817 1.00 51.20 C ATOM 301 C LYS A 30 -5.719 24.055 19.059 1.00 4.41 C ATOM 302 O LYS A 30 -6.219 25.029 19.622 1.00 53.43 O ATOM 303 CB LYS A 30 -4.431 23.702 21.174 1.00 31.23 C ATOM 304 CG LYS A 30 -3.364 22.916 21.917 1.00 75.31 C ATOM 305 CD LYS A 30 -3.290 23.321 23.379 1.00 3.44 C ATOM 306 CE LYS A 30 -4.333 22.595 24.213 1.00 35.45 C ATOM 307 NZ LYS A 30 -4.035 21.140 24.331 1.00 11.43 N ATOM 0 H LYS A 30 -3.485 21.830 18.793 1.00 44.53 H new ATOM 0 HA LYS A 30 -5.335 22.162 19.976 1.00 51.20 H new ATOM 0 HB2 LYS A 30 -4.081 24.723 21.025 1.00 31.23 H new ATOM 0 HB3 LYS A 30 -5.326 23.759 21.794 1.00 31.23 H new ATOM 0 HG2 LYS A 30 -3.579 21.850 21.844 1.00 75.31 H new ATOM 0 HG3 LYS A 30 -2.396 23.079 21.444 1.00 75.31 H new ATOM 0 HD2 LYS A 30 -2.295 23.103 23.768 1.00 3.44 H new ATOM 0 HD3 LYS A 30 -3.437 24.397 23.467 1.00 3.44 H new ATOM 0 HE2 LYS A 30 -4.376 23.039 25.208 1.00 35.45 H new ATOM 0 HE3 LYS A 30 -5.316 22.729 23.762 1.00 35.45 H new ATOM 0 HZ1 LYS A 30 -4.338 20.798 25.265 1.00 11.43 H new ATOM 0 HZ2 LYS A 30 -4.546 20.620 23.590 1.00 11.43 H new ATOM 0 HZ3 LYS A 30 -3.013 20.985 24.220 1.00 11.43 H new ATOM 321 N LYS A 31 -5.936 23.770 17.780 1.00 64.32 N ATOM 322 CA LYS A 31 -6.794 24.601 16.945 1.00 52.14 C ATOM 323 C LYS A 31 -8.262 24.411 17.315 1.00 42.34 C ATOM 324 O LYS A 31 -8.973 25.378 17.589 1.00 45.11 O ATOM 325 CB LYS A 31 -6.582 24.265 15.467 1.00 53.54 C ATOM 326 CG LYS A 31 -7.523 25.008 14.533 1.00 31.14 C ATOM 327 CD LYS A 31 -8.335 24.048 13.681 1.00 74.43 C ATOM 328 CE LYS A 31 -8.463 24.545 12.249 1.00 64.31 C ATOM 329 NZ LYS A 31 -9.465 25.640 12.129 1.00 63.42 N ATOM 0 H LYS A 31 -5.529 22.968 17.298 1.00 64.32 H new ATOM 0 HA LYS A 31 -6.526 25.644 17.116 1.00 52.14 H new ATOM 0 HB2 LYS A 31 -5.553 24.499 15.194 1.00 53.54 H new ATOM 0 HB3 LYS A 31 -6.714 23.192 15.324 1.00 53.54 H new ATOM 0 HG2 LYS A 31 -8.196 25.636 15.117 1.00 31.14 H new ATOM 0 HG3 LYS A 31 -6.948 25.671 13.887 1.00 31.14 H new ATOM 0 HD2 LYS A 31 -7.861 23.066 13.686 1.00 74.43 H new ATOM 0 HD3 LYS A 31 -9.327 23.925 14.115 1.00 74.43 H new ATOM 0 HE2 LYS A 31 -7.493 24.900 11.900 1.00 64.31 H new ATOM 0 HE3 LYS A 31 -8.751 23.717 11.602 1.00 64.31 H new ATOM 0 HZ1 LYS A 31 -9.523 25.951 11.138 1.00 63.42 H new ATOM 0 HZ2 LYS A 31 -10.396 25.294 12.438 1.00 63.42 H new ATOM 0 HZ3 LYS A 31 -9.177 26.441 12.727 1.00 63.42 H new ATOM 343 N SER A 32 -8.709 23.159 17.321 1.00 4.54 N ATOM 344 CA SER A 32 -10.092 22.844 17.656 1.00 74.43 C ATOM 345 C SER A 32 -10.158 21.793 18.760 1.00 72.32 C ATOM 346 O SER A 32 -10.418 22.111 19.920 1.00 11.22 O ATOM 347 CB SER A 32 -10.838 22.345 16.416 1.00 24.21 C ATOM 348 OG SER A 32 -9.943 22.112 15.342 1.00 24.55 O ATOM 0 H SER A 32 -8.133 22.347 17.098 1.00 4.54 H new ATOM 0 HA SER A 32 -10.569 23.755 18.017 1.00 74.43 H new ATOM 0 HB2 SER A 32 -11.372 21.425 16.655 1.00 24.21 H new ATOM 0 HB3 SER A 32 -11.586 23.080 16.117 1.00 24.21 H new ATOM 0 HG SER A 32 -10.444 21.792 14.562 1.00 24.55 H new ATOM 354 N ARG A 33 -9.921 20.539 18.389 1.00 20.32 N ATOM 355 CA ARG A 33 -9.954 19.440 19.347 1.00 73.23 C ATOM 356 C ARG A 33 -9.676 18.108 18.656 1.00 73.02 C ATOM 357 O ARG A 33 -8.678 17.446 18.940 1.00 20.13 O ATOM 358 CB ARG A 33 -11.312 19.388 20.049 1.00 13.33 C ATOM 359 CG ARG A 33 -11.214 19.394 21.566 1.00 21.10 C ATOM 360 CD ARG A 33 -10.486 18.162 22.082 1.00 41.44 C ATOM 361 NE ARG A 33 -11.092 17.640 23.304 1.00 44.05 N ATOM 362 CZ ARG A 33 -10.865 16.418 23.771 1.00 32.44 C ATOM 363 NH1 ARG A 33 -10.051 15.596 23.123 1.00 1.32 N ATOM 364 NH2 ARG A 33 -11.454 16.015 24.890 1.00 23.34 N ATOM 0 H ARG A 33 -9.704 20.259 17.433 1.00 20.32 H new ATOM 0 HA ARG A 33 -9.175 19.615 20.089 1.00 73.23 H new ATOM 0 HB2 ARG A 33 -11.910 20.241 19.729 1.00 13.33 H new ATOM 0 HB3 ARG A 33 -11.842 18.490 19.731 1.00 13.33 H new ATOM 0 HG2 ARG A 33 -10.690 20.292 21.894 1.00 21.10 H new ATOM 0 HG3 ARG A 33 -12.215 19.434 21.996 1.00 21.10 H new ATOM 0 HD2 ARG A 33 -10.494 17.388 21.314 1.00 41.44 H new ATOM 0 HD3 ARG A 33 -9.442 18.411 22.273 1.00 41.44 H new ATOM 0 HE ARG A 33 -11.724 18.247 23.827 1.00 44.05 H new ATOM 0 HH11 ARG A 33 -9.597 15.902 22.262 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -9.879 14.658 23.485 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.081 16.644 25.391 1.00 23.34 H new ATOM 0 HH22 ARG A 33 -11.280 15.076 25.249 1.00 23.34 H new ATOM 378 N TYR A 34 -10.566 17.722 17.748 1.00 64.31 N ATOM 379 CA TYR A 34 -10.418 16.468 17.019 1.00 61.25 C ATOM 380 C TYR A 34 -10.873 16.623 15.571 1.00 73.23 C ATOM 381 O TYR A 34 -11.804 17.374 15.277 1.00 22.51 O ATOM 382 CB TYR A 34 -11.220 15.359 17.701 1.00 32.22 C ATOM 383 CG TYR A 34 -12.305 15.874 18.620 1.00 25.15 C ATOM 384 CD1 TYR A 34 -13.372 16.610 18.123 1.00 55.44 C ATOM 385 CD2 TYR A 34 -12.261 15.625 19.987 1.00 42.33 C ATOM 386 CE1 TYR A 34 -14.365 17.084 18.959 1.00 72.24 C ATOM 387 CE2 TYR A 34 -13.250 16.093 20.830 1.00 42.41 C ATOM 388 CZ TYR A 34 -14.300 16.822 20.311 1.00 3.33 C ATOM 389 OH TYR A 34 -15.286 17.292 21.148 1.00 31.42 O ATOM 0 H TYR A 34 -11.397 18.259 17.500 1.00 64.31 H new ATOM 0 HA TYR A 34 -9.362 16.198 17.023 1.00 61.25 H new ATOM 0 HB2 TYR A 34 -11.672 14.727 16.937 1.00 32.22 H new ATOM 0 HB3 TYR A 34 -10.539 14.729 18.274 1.00 32.22 H new ATOM 0 HD1 TYR A 34 -13.427 16.816 17.064 1.00 55.44 H new ATOM 0 HD2 TYR A 34 -11.440 15.056 20.397 1.00 42.33 H new ATOM 0 HE1 TYR A 34 -15.187 17.656 18.556 1.00 72.24 H new ATOM 0 HE2 TYR A 34 -13.202 15.889 21.890 1.00 42.41 H new ATOM 0 HH TYR A 34 -16.111 16.785 20.998 1.00 31.42 H new ATOM 399 N VAL A 35 -10.210 15.906 14.669 1.00 52.23 N ATOM 400 CA VAL A 35 -10.546 15.961 13.251 1.00 14.30 C ATOM 401 C VAL A 35 -10.623 14.563 12.650 1.00 61.45 C ATOM 402 O VAL A 35 -9.668 13.789 12.729 1.00 33.22 O ATOM 403 CB VAL A 35 -9.517 16.792 12.462 1.00 61.00 C ATOM 404 CG1 VAL A 35 -9.597 18.258 12.859 1.00 41.34 C ATOM 405 CG2 VAL A 35 -8.113 16.248 12.681 1.00 34.30 C ATOM 0 H VAL A 35 -9.437 15.280 14.895 1.00 52.23 H new ATOM 0 HA VAL A 35 -11.522 16.440 13.175 1.00 14.30 H new ATOM 0 HB VAL A 35 -9.751 16.715 11.400 1.00 61.00 H new ATOM 0 HG11 VAL A 35 -8.863 18.829 12.291 1.00 41.34 H new ATOM 0 HG12 VAL A 35 -10.596 18.639 12.646 1.00 41.34 H new ATOM 0 HG13 VAL A 35 -9.390 18.358 13.924 1.00 41.34 H new ATOM 0 HG21 VAL A 35 -7.399 16.847 12.116 1.00 34.30 H new ATOM 0 HG22 VAL A 35 -7.866 16.294 13.742 1.00 34.30 H new ATOM 0 HG23 VAL A 35 -8.067 15.213 12.342 1.00 34.30 H new ATOM 415 N ILE A 36 -11.764 14.245 12.048 1.00 50.04 N ATOM 416 CA ILE A 36 -11.964 12.940 11.431 1.00 73.41 C ATOM 417 C ILE A 36 -12.056 13.057 9.913 1.00 23.22 C ATOM 418 O ILE A 36 -12.785 13.898 9.388 1.00 32.54 O ATOM 419 CB ILE A 36 -13.240 12.257 11.959 1.00 23.05 C ATOM 420 CG1 ILE A 36 -13.359 12.451 13.473 1.00 45.15 C ATOM 421 CG2 ILE A 36 -13.232 10.777 11.609 1.00 72.41 C ATOM 422 CD1 ILE A 36 -14.590 11.806 14.070 1.00 64.04 C ATOM 0 H ILE A 36 -12.564 14.873 11.974 1.00 50.04 H new ATOM 0 HA ILE A 36 -11.099 12.331 11.695 1.00 73.41 H new ATOM 0 HB ILE A 36 -14.105 12.718 11.483 1.00 23.05 H new ATOM 0 HG12 ILE A 36 -12.473 12.038 13.955 1.00 45.15 H new ATOM 0 HG13 ILE A 36 -13.374 13.518 13.694 1.00 45.15 H new ATOM 0 HG21 ILE A 36 -14.140 10.308 11.989 1.00 72.41 H new ATOM 0 HG22 ILE A 36 -13.189 10.659 10.526 1.00 72.41 H new ATOM 0 HG23 ILE A 36 -12.362 10.301 12.061 1.00 72.41 H new ATOM 0 HD11 ILE A 36 -14.609 11.984 15.145 1.00 64.04 H new ATOM 0 HD12 ILE A 36 -15.483 12.236 13.615 1.00 64.04 H new ATOM 0 HD13 ILE A 36 -14.567 10.733 13.880 1.00 64.04 H new ATOM 434 N MET A 37 -11.311 12.206 9.214 1.00 54.53 N ATOM 435 CA MET A 37 -11.311 12.213 7.755 1.00 21.24 C ATOM 436 C MET A 37 -11.488 10.801 7.206 1.00 52.04 C ATOM 437 O MET A 37 -11.181 9.818 7.881 1.00 43.03 O ATOM 438 CB MET A 37 -10.009 12.819 7.227 1.00 33.31 C ATOM 439 CG MET A 37 -9.904 14.319 7.447 1.00 54.24 C ATOM 440 SD MET A 37 -8.387 14.792 8.298 1.00 50.31 S ATOM 441 CE MET A 37 -8.551 13.867 9.822 1.00 34.35 C ATOM 0 H MET A 37 -10.701 11.504 9.633 1.00 54.53 H new ATOM 0 HA MET A 37 -12.149 12.823 7.418 1.00 21.24 H new ATOM 0 HB2 MET A 37 -9.166 12.329 7.714 1.00 33.31 H new ATOM 0 HB3 MET A 37 -9.927 12.610 6.160 1.00 33.31 H new ATOM 0 HG2 MET A 37 -9.949 14.827 6.484 1.00 54.24 H new ATOM 0 HG3 MET A 37 -10.762 14.658 8.027 1.00 54.24 H new ATOM 0 HE1 MET A 37 -7.626 13.942 10.394 1.00 34.35 H new ATOM 0 HE2 MET A 37 -9.374 14.275 10.408 1.00 34.35 H new ATOM 0 HE3 MET A 37 -8.752 12.821 9.593 1.00 34.35 H new ATOM 451 N HIS A 38 -11.986 10.707 5.977 1.00 50.44 N ATOM 452 CA HIS A 38 -12.204 9.415 5.336 1.00 3.04 C ATOM 453 C HIS A 38 -11.776 9.455 3.872 1.00 15.23 C ATOM 454 O HIS A 38 -11.536 10.527 3.315 1.00 25.35 O ATOM 455 CB HIS A 38 -13.675 9.013 5.439 1.00 32.55 C ATOM 456 CG HIS A 38 -14.557 9.709 4.449 1.00 33.34 C ATOM 457 ND1 HIS A 38 -14.501 11.066 4.215 1.00 44.31 N ATOM 458 CD2 HIS A 38 -15.521 9.227 3.630 1.00 63.23 C ATOM 459 CE1 HIS A 38 -15.392 11.390 3.295 1.00 31.32 C ATOM 460 NE2 HIS A 38 -16.024 10.291 2.923 1.00 12.22 N ATOM 0 H HIS A 38 -12.246 11.510 5.405 1.00 50.44 H new ATOM 0 HA HIS A 38 -11.595 8.673 5.853 1.00 3.04 H new ATOM 0 HB2 HIS A 38 -13.760 7.936 5.294 1.00 32.55 H new ATOM 0 HB3 HIS A 38 -14.032 9.228 6.446 1.00 32.55 H new ATOM 0 HD2 HIS A 38 -15.836 8.197 3.548 1.00 63.23 H new ATOM 0 HE1 HIS A 38 -15.573 12.384 2.912 1.00 31.32 H new ATOM 0 HE2 HIS A 38 -16.765 10.241 2.224 1.00 12.22 H new ATOM 468 N ILE A 39 -11.684 8.282 3.256 1.00 71.15 N ATOM 469 CA ILE A 39 -11.286 8.184 1.857 1.00 52.03 C ATOM 470 C ILE A 39 -12.486 8.352 0.931 1.00 72.12 C ATOM 471 O ILE A 39 -13.510 7.689 1.097 1.00 20.32 O ATOM 472 CB ILE A 39 -10.606 6.835 1.558 1.00 73.21 C ATOM 473 CG1 ILE A 39 -9.515 6.549 2.592 1.00 35.50 C ATOM 474 CG2 ILE A 39 -10.024 6.835 0.152 1.00 32.23 C ATOM 475 CD1 ILE A 39 -8.804 5.232 2.372 1.00 75.34 C ATOM 0 H ILE A 39 -11.879 7.386 3.703 1.00 71.15 H new ATOM 0 HA ILE A 39 -10.574 8.989 1.675 1.00 52.03 H new ATOM 0 HB ILE A 39 -11.355 6.046 1.620 1.00 73.21 H new ATOM 0 HG12 ILE A 39 -8.783 7.356 2.568 1.00 35.50 H new ATOM 0 HG13 ILE A 39 -9.960 6.551 3.587 1.00 35.50 H new ATOM 0 HG21 ILE A 39 -9.547 5.875 -0.044 1.00 32.23 H new ATOM 0 HG22 ILE A 39 -10.822 6.998 -0.572 1.00 32.23 H new ATOM 0 HG23 ILE A 39 -9.286 7.632 0.064 1.00 32.23 H new ATOM 0 HD11 ILE A 39 -8.044 5.096 3.142 1.00 75.34 H new ATOM 0 HD12 ILE A 39 -9.525 4.416 2.425 1.00 75.34 H new ATOM 0 HD13 ILE A 39 -8.330 5.234 1.391 1.00 75.34 H new ATOM 487 N VAL A 40 -12.352 9.242 -0.047 1.00 13.30 N ATOM 488 CA VAL A 40 -13.424 9.496 -1.002 1.00 72.23 C ATOM 489 C VAL A 40 -13.034 9.034 -2.402 1.00 5.52 C ATOM 490 O VAL A 40 -11.972 9.395 -2.912 1.00 34.33 O ATOM 491 CB VAL A 40 -13.791 10.991 -1.050 1.00 74.22 C ATOM 492 CG1 VAL A 40 -14.941 11.228 -2.018 1.00 30.34 C ATOM 493 CG2 VAL A 40 -14.141 11.498 0.341 1.00 40.13 C ATOM 0 H VAL A 40 -11.511 9.799 -0.199 1.00 13.30 H new ATOM 0 HA VAL A 40 -14.290 8.928 -0.663 1.00 72.23 H new ATOM 0 HB VAL A 40 -12.926 11.549 -1.408 1.00 74.22 H new ATOM 0 HG11 VAL A 40 -15.186 12.290 -2.039 1.00 30.34 H new ATOM 0 HG12 VAL A 40 -14.649 10.904 -3.017 1.00 30.34 H new ATOM 0 HG13 VAL A 40 -15.813 10.660 -1.693 1.00 30.34 H new ATOM 0 HG21 VAL A 40 -14.398 12.556 0.289 1.00 40.13 H new ATOM 0 HG22 VAL A 40 -14.991 10.937 0.729 1.00 40.13 H new ATOM 0 HG23 VAL A 40 -13.285 11.365 1.003 1.00 40.13 H new ATOM 503 N ASP A 41 -13.898 8.236 -3.018 1.00 41.02 N ATOM 504 CA ASP A 41 -13.644 7.726 -4.361 1.00 35.13 C ATOM 505 C ASP A 41 -12.401 6.843 -4.381 1.00 22.34 C ATOM 506 O ASP A 41 -11.851 6.554 -5.443 1.00 3.21 O ATOM 507 CB ASP A 41 -13.479 8.884 -5.346 1.00 61.44 C ATOM 508 CG ASP A 41 -14.576 8.915 -6.392 1.00 51.01 C ATOM 509 OD1 ASP A 41 -14.719 7.919 -7.132 1.00 10.15 O ATOM 510 OD2 ASP A 41 -15.291 9.936 -6.472 1.00 33.02 O ATOM 0 H ASP A 41 -14.780 7.928 -2.610 1.00 41.02 H new ATOM 0 HA ASP A 41 -14.500 7.123 -4.662 1.00 35.13 H new ATOM 0 HB2 ASP A 41 -13.477 9.826 -4.798 1.00 61.44 H new ATOM 0 HB3 ASP A 41 -12.511 8.801 -5.841 1.00 61.44 H new ATOM 515 N GLN A 42 -11.964 6.418 -3.199 1.00 44.34 N ATOM 516 CA GLN A 42 -10.784 5.570 -3.082 1.00 62.30 C ATOM 517 C GLN A 42 -9.619 6.143 -3.882 1.00 2.31 C ATOM 518 O GLN A 42 -8.783 5.403 -4.400 1.00 22.30 O ATOM 519 CB GLN A 42 -11.099 4.152 -3.563 1.00 52.30 C ATOM 520 CG GLN A 42 -12.419 3.611 -3.037 1.00 63.11 C ATOM 521 CD GLN A 42 -12.520 2.103 -3.156 1.00 61.04 C ATOM 522 OE1 GLN A 42 -11.900 1.495 -4.029 1.00 72.24 O ATOM 523 NE2 GLN A 42 -13.304 1.491 -2.277 1.00 21.42 N ATOM 0 H GLN A 42 -12.409 6.647 -2.310 1.00 44.34 H new ATOM 0 HA GLN A 42 -10.497 5.535 -2.031 1.00 62.30 H new ATOM 0 HB2 GLN A 42 -11.121 4.143 -4.653 1.00 52.30 H new ATOM 0 HB3 GLN A 42 -10.294 3.485 -3.255 1.00 52.30 H new ATOM 0 HG2 GLN A 42 -12.534 3.898 -1.992 1.00 63.11 H new ATOM 0 HG3 GLN A 42 -13.241 4.071 -3.586 1.00 63.11 H new ATOM 0 HE21 GLN A 42 -13.799 2.035 -1.570 1.00 21.42 H new ATOM 0 HE22 GLN A 42 -13.411 0.477 -2.308 1.00 21.42 H new ATOM 532 N LYS A 43 -9.570 7.468 -3.979 1.00 63.42 N ATOM 533 CA LYS A 43 -8.507 8.142 -4.715 1.00 51.21 C ATOM 534 C LYS A 43 -8.103 9.439 -4.021 1.00 22.23 C ATOM 535 O LYS A 43 -6.919 9.763 -3.932 1.00 42.51 O ATOM 536 CB LYS A 43 -8.958 8.438 -6.147 1.00 75.43 C ATOM 537 CG LYS A 43 -7.853 8.987 -7.032 1.00 71.13 C ATOM 538 CD LYS A 43 -8.147 10.411 -7.472 1.00 41.32 C ATOM 539 CE LYS A 43 -7.299 10.811 -8.670 1.00 75.24 C ATOM 540 NZ LYS A 43 -7.902 11.946 -9.422 1.00 52.13 N ATOM 0 H LYS A 43 -10.254 8.096 -3.557 1.00 63.42 H new ATOM 0 HA LYS A 43 -7.642 7.479 -4.742 1.00 51.21 H new ATOM 0 HB2 LYS A 43 -9.348 7.523 -6.593 1.00 75.43 H new ATOM 0 HB3 LYS A 43 -9.779 9.154 -6.120 1.00 75.43 H new ATOM 0 HG2 LYS A 43 -6.906 8.960 -6.492 1.00 71.13 H new ATOM 0 HG3 LYS A 43 -7.738 8.350 -7.909 1.00 71.13 H new ATOM 0 HD2 LYS A 43 -9.203 10.504 -7.725 1.00 41.32 H new ATOM 0 HD3 LYS A 43 -7.956 11.095 -6.645 1.00 41.32 H new ATOM 0 HE2 LYS A 43 -6.301 11.089 -8.332 1.00 75.24 H new ATOM 0 HE3 LYS A 43 -7.183 9.955 -9.335 1.00 75.24 H new ATOM 0 HZ1 LYS A 43 -7.294 12.189 -10.231 1.00 52.13 H new ATOM 0 HZ2 LYS A 43 -8.844 11.672 -9.767 1.00 52.13 H new ATOM 0 HZ3 LYS A 43 -7.989 12.771 -8.795 1.00 52.13 H new ATOM 554 N SER A 44 -9.094 10.175 -3.529 1.00 1.24 N ATOM 555 CA SER A 44 -8.841 11.438 -2.844 1.00 32.41 C ATOM 556 C SER A 44 -9.481 11.442 -1.459 1.00 25.23 C ATOM 557 O SER A 44 -10.673 11.173 -1.313 1.00 73.10 O ATOM 558 CB SER A 44 -9.380 12.607 -3.670 1.00 42.13 C ATOM 559 OG SER A 44 -10.352 12.168 -4.603 1.00 32.44 O ATOM 0 H SER A 44 -10.079 9.919 -3.592 1.00 1.24 H new ATOM 0 HA SER A 44 -7.763 11.551 -2.728 1.00 32.41 H new ATOM 0 HB2 SER A 44 -9.819 13.353 -3.007 1.00 42.13 H new ATOM 0 HB3 SER A 44 -8.559 13.093 -4.197 1.00 42.13 H new ATOM 0 HG SER A 44 -10.682 12.934 -5.117 1.00 32.44 H new ATOM 565 N ILE A 45 -8.678 11.749 -0.445 1.00 35.22 N ATOM 566 CA ILE A 45 -9.165 11.789 0.928 1.00 13.25 C ATOM 567 C ILE A 45 -9.867 13.111 1.224 1.00 23.54 C ATOM 568 O ILE A 45 -9.341 14.184 0.930 1.00 70.51 O ATOM 569 CB ILE A 45 -8.019 11.592 1.938 1.00 11.01 C ATOM 570 CG1 ILE A 45 -7.225 10.328 1.601 1.00 35.14 C ATOM 571 CG2 ILE A 45 -8.568 11.518 3.355 1.00 73.51 C ATOM 572 CD1 ILE A 45 -6.071 10.071 2.544 1.00 64.52 C ATOM 0 H ILE A 45 -7.688 11.973 -0.549 1.00 35.22 H new ATOM 0 HA ILE A 45 -9.877 10.970 1.034 1.00 13.25 H new ATOM 0 HB ILE A 45 -7.347 12.448 1.875 1.00 11.01 H new ATOM 0 HG12 ILE A 45 -7.897 9.470 1.620 1.00 35.14 H new ATOM 0 HG13 ILE A 45 -6.841 10.410 0.584 1.00 35.14 H new ATOM 0 HG21 ILE A 45 -7.746 11.379 4.057 1.00 73.51 H new ATOM 0 HG22 ILE A 45 -9.093 12.444 3.590 1.00 73.51 H new ATOM 0 HG23 ILE A 45 -9.259 10.679 3.434 1.00 73.51 H new ATOM 0 HD11 ILE A 45 -5.553 9.160 2.245 1.00 64.52 H new ATOM 0 HD12 ILE A 45 -5.377 10.911 2.508 1.00 64.52 H new ATOM 0 HD13 ILE A 45 -6.450 9.957 3.560 1.00 64.52 H new ATOM 584 N ALA A 46 -11.056 13.024 1.810 1.00 14.33 N ATOM 585 CA ALA A 46 -11.829 14.213 2.150 1.00 5.01 C ATOM 586 C ALA A 46 -12.305 14.163 3.598 1.00 44.11 C ATOM 587 O ALA A 46 -12.263 13.113 4.240 1.00 51.41 O ATOM 588 CB ALA A 46 -13.014 14.360 1.207 1.00 22.35 C ATOM 0 H ALA A 46 -11.505 12.143 2.059 1.00 14.33 H new ATOM 0 HA ALA A 46 -11.180 15.082 2.038 1.00 5.01 H new ATOM 0 HB1 ALA A 46 -13.582 15.252 1.473 1.00 22.35 H new ATOM 0 HB2 ALA A 46 -12.654 14.451 0.182 1.00 22.35 H new ATOM 0 HB3 ALA A 46 -13.656 13.483 1.290 1.00 22.35 H new ATOM 594 N VAL A 47 -12.756 15.305 4.107 1.00 32.13 N ATOM 595 CA VAL A 47 -13.241 15.391 5.480 1.00 43.02 C ATOM 596 C VAL A 47 -14.651 14.824 5.601 1.00 3.44 C ATOM 597 O VAL A 47 -15.504 15.062 4.746 1.00 3.31 O ATOM 598 CB VAL A 47 -13.238 16.846 5.985 1.00 35.14 C ATOM 599 CG1 VAL A 47 -11.851 17.455 5.853 1.00 11.31 C ATOM 600 CG2 VAL A 47 -14.268 17.673 5.230 1.00 5.53 C ATOM 0 H VAL A 47 -12.796 16.183 3.590 1.00 32.13 H new ATOM 0 HA VAL A 47 -12.562 14.800 6.094 1.00 43.02 H new ATOM 0 HB VAL A 47 -13.508 16.847 7.041 1.00 35.14 H new ATOM 0 HG11 VAL A 47 -11.869 18.483 6.215 1.00 11.31 H new ATOM 0 HG12 VAL A 47 -11.141 16.875 6.443 1.00 11.31 H new ATOM 0 HG13 VAL A 47 -11.547 17.444 4.806 1.00 11.31 H new ATOM 0 HG21 VAL A 47 -14.253 18.698 5.599 1.00 5.53 H new ATOM 0 HG22 VAL A 47 -14.031 17.667 4.166 1.00 5.53 H new ATOM 0 HG23 VAL A 47 -15.260 17.247 5.383 1.00 5.53 H new ATOM 610 N LYS A 48 -14.890 14.073 6.671 1.00 52.11 N ATOM 611 CA LYS A 48 -16.198 13.473 6.907 1.00 24.45 C ATOM 612 C LYS A 48 -16.928 14.188 8.040 1.00 62.41 C ATOM 613 O LYS A 48 -18.086 14.580 7.896 1.00 51.41 O ATOM 614 CB LYS A 48 -16.046 11.987 7.242 1.00 74.12 C ATOM 615 CG LYS A 48 -17.333 11.337 7.719 1.00 35.22 C ATOM 616 CD LYS A 48 -18.441 11.470 6.688 1.00 73.43 C ATOM 617 CE LYS A 48 -19.124 10.135 6.428 1.00 12.55 C ATOM 618 NZ LYS A 48 -20.571 10.304 6.120 1.00 72.14 N ATOM 0 H LYS A 48 -14.195 13.865 7.388 1.00 52.11 H new ATOM 0 HA LYS A 48 -16.788 13.576 5.996 1.00 24.45 H new ATOM 0 HB2 LYS A 48 -15.688 11.459 6.359 1.00 74.12 H new ATOM 0 HB3 LYS A 48 -15.284 11.873 8.013 1.00 74.12 H new ATOM 0 HG2 LYS A 48 -17.153 10.282 7.927 1.00 35.22 H new ATOM 0 HG3 LYS A 48 -17.649 11.797 8.655 1.00 35.22 H new ATOM 0 HD2 LYS A 48 -19.177 12.195 7.035 1.00 73.43 H new ATOM 0 HD3 LYS A 48 -18.028 11.856 5.756 1.00 73.43 H new ATOM 0 HE2 LYS A 48 -18.632 9.631 5.596 1.00 12.55 H new ATOM 0 HE3 LYS A 48 -19.011 9.493 7.301 1.00 12.55 H new ATOM 0 HZ1 LYS A 48 -21.001 9.372 5.949 1.00 72.14 H new ATOM 0 HZ2 LYS A 48 -21.046 10.762 6.924 1.00 72.14 H new ATOM 0 HZ3 LYS A 48 -20.679 10.896 5.272 1.00 72.14 H new ATOM 632 N THR A 49 -16.243 14.355 9.167 1.00 1.10 N ATOM 633 CA THR A 49 -16.826 15.023 10.324 1.00 71.03 C ATOM 634 C THR A 49 -15.745 15.495 11.289 1.00 42.31 C ATOM 635 O THR A 49 -15.112 14.688 11.970 1.00 61.23 O ATOM 636 CB THR A 49 -17.800 14.096 11.075 1.00 13.54 C ATOM 637 OG1 THR A 49 -18.874 13.710 10.211 1.00 73.21 O ATOM 638 CG2 THR A 49 -18.360 14.787 12.310 1.00 22.11 C ATOM 0 H THR A 49 -15.284 14.037 9.303 1.00 1.10 H new ATOM 0 HA THR A 49 -17.375 15.886 9.948 1.00 71.03 H new ATOM 0 HB THR A 49 -17.252 13.209 11.391 1.00 13.54 H new ATOM 0 HG1 THR A 49 -18.866 14.272 9.408 1.00 73.21 H new ATOM 0 HG21 THR A 49 -19.045 14.113 12.824 1.00 22.11 H new ATOM 0 HG22 THR A 49 -17.542 15.054 12.980 1.00 22.11 H new ATOM 0 HG23 THR A 49 -18.894 15.689 12.012 1.00 22.11 H new ATOM 646 N ILE A 50 -15.539 16.807 11.343 1.00 23.22 N ATOM 647 CA ILE A 50 -14.535 17.386 12.227 1.00 23.32 C ATOM 648 C ILE A 50 -15.187 18.110 13.400 1.00 22.21 C ATOM 649 O ILE A 50 -16.228 18.748 13.248 1.00 21.43 O ATOM 650 CB ILE A 50 -13.622 18.371 11.474 1.00 50.15 C ATOM 651 CG1 ILE A 50 -12.841 17.641 10.379 1.00 41.32 C ATOM 652 CG2 ILE A 50 -12.671 19.059 12.442 1.00 61.53 C ATOM 653 CD1 ILE A 50 -12.111 18.571 9.435 1.00 3.33 C ATOM 0 H ILE A 50 -16.054 17.488 10.785 1.00 23.22 H new ATOM 0 HA ILE A 50 -13.932 16.560 12.603 1.00 23.32 H new ATOM 0 HB ILE A 50 -14.244 19.133 11.004 1.00 50.15 H new ATOM 0 HG12 ILE A 50 -12.120 16.970 10.845 1.00 41.32 H new ATOM 0 HG13 ILE A 50 -13.529 17.021 9.805 1.00 41.32 H new ATOM 0 HG21 ILE A 50 -12.032 19.752 11.894 1.00 61.53 H new ATOM 0 HG22 ILE A 50 -13.246 19.608 13.188 1.00 61.53 H new ATOM 0 HG23 ILE A 50 -12.053 18.311 12.938 1.00 61.53 H new ATOM 0 HD11 ILE A 50 -11.579 17.985 8.685 1.00 3.33 H new ATOM 0 HD12 ILE A 50 -12.829 19.226 8.941 1.00 3.33 H new ATOM 0 HD13 ILE A 50 -11.398 19.174 9.997 1.00 3.33 H new ATOM 665 N GLY A 51 -14.565 18.008 14.571 1.00 34.22 N ATOM 666 CA GLY A 51 -15.099 18.659 15.753 1.00 4.32 C ATOM 667 C GLY A 51 -14.437 19.996 16.027 1.00 73.51 C ATOM 668 O GLY A 51 -13.693 20.509 15.192 1.00 22.34 O ATOM 0 H GLY A 51 -13.701 17.487 14.722 1.00 34.22 H new ATOM 0 HA2 GLY A 51 -16.172 18.807 15.629 1.00 4.32 H new ATOM 0 HA3 GLY A 51 -14.964 18.007 16.616 1.00 4.32 H new ATOM 672 N GLU A 52 -14.711 20.561 17.199 1.00 60.33 N ATOM 673 CA GLU A 52 -14.138 21.847 17.578 1.00 74.01 C ATOM 674 C GLU A 52 -14.610 22.264 18.968 1.00 23.32 C ATOM 675 O GLU A 52 -15.189 23.336 19.143 1.00 23.13 O ATOM 676 CB GLU A 52 -14.518 22.920 16.556 1.00 42.53 C ATOM 677 CG GLU A 52 -15.988 22.905 16.174 1.00 15.03 C ATOM 678 CD GLU A 52 -16.342 23.985 15.171 1.00 53.24 C ATOM 679 OE1 GLU A 52 -16.179 23.744 13.956 1.00 1.24 O ATOM 680 OE2 GLU A 52 -16.783 25.072 15.600 1.00 30.12 O ATOM 0 H GLU A 52 -15.325 20.149 17.901 1.00 60.33 H new ATOM 0 HA GLU A 52 -13.053 21.741 17.598 1.00 74.01 H new ATOM 0 HB2 GLU A 52 -14.267 23.900 16.961 1.00 42.53 H new ATOM 0 HB3 GLU A 52 -13.917 22.783 15.657 1.00 42.53 H new ATOM 0 HG2 GLU A 52 -16.241 21.930 15.757 1.00 15.03 H new ATOM 0 HG3 GLU A 52 -16.594 23.035 17.071 1.00 15.03 H new ATOM 687 N ARG A 53 -14.358 21.408 19.953 1.00 23.21 N ATOM 688 CA ARG A 53 -14.757 21.685 21.327 1.00 13.44 C ATOM 689 C ARG A 53 -16.276 21.775 21.444 1.00 31.35 C ATOM 690 O ARG A 53 -16.802 22.434 22.340 1.00 52.00 O ATOM 691 CB ARG A 53 -14.120 22.989 21.813 1.00 32.30 C ATOM 692 CG ARG A 53 -12.633 23.087 21.516 1.00 22.03 C ATOM 693 CD ARG A 53 -12.056 24.412 21.991 1.00 74.15 C ATOM 694 NE ARG A 53 -11.773 25.315 20.878 1.00 23.23 N ATOM 695 CZ ARG A 53 -11.555 26.617 21.026 1.00 70.12 C ATOM 696 NH1 ARG A 53 -11.588 27.165 22.233 1.00 41.35 N ATOM 697 NH2 ARG A 53 -11.303 27.373 19.965 1.00 52.10 N ATOM 0 H ARG A 53 -13.879 20.517 19.825 1.00 23.21 H new ATOM 0 HA ARG A 53 -14.409 20.863 21.953 1.00 13.44 H new ATOM 0 HB2 ARG A 53 -14.632 23.830 21.345 1.00 32.30 H new ATOM 0 HB3 ARG A 53 -14.274 23.080 22.888 1.00 32.30 H new ATOM 0 HG2 ARG A 53 -12.109 22.265 22.003 1.00 22.03 H new ATOM 0 HG3 ARG A 53 -12.467 22.980 20.444 1.00 22.03 H new ATOM 0 HD2 ARG A 53 -12.758 24.889 22.675 1.00 74.15 H new ATOM 0 HD3 ARG A 53 -11.139 24.228 22.551 1.00 74.15 H new ATOM 0 HE ARG A 53 -11.741 24.925 19.936 1.00 23.23 H new ATOM 0 HH11 ARG A 53 -11.781 26.587 23.051 1.00 41.35 H new ATOM 0 HH12 ARG A 53 -11.420 28.165 22.344 1.00 41.35 H new ATOM 0 HH21 ARG A 53 -11.277 26.954 19.035 1.00 52.10 H new ATOM 0 HH22 ARG A 53 -11.136 28.373 20.079 1.00 52.10 H new ATOM 711 N GLY A 54 -16.975 21.106 20.532 1.00 14.31 N ATOM 712 CA GLY A 54 -18.426 21.124 20.550 1.00 33.22 C ATOM 713 C GLY A 54 -19.029 19.853 19.984 1.00 44.21 C ATOM 714 O GLY A 54 -20.210 19.817 19.643 1.00 53.14 O ATOM 0 H GLY A 54 -16.562 20.552 19.781 1.00 14.31 H new ATOM 0 HA2 GLY A 54 -18.772 21.262 21.574 1.00 33.22 H new ATOM 0 HA3 GLY A 54 -18.783 21.979 19.976 1.00 33.22 H new ATOM 718 N ALA A 55 -18.214 18.808 19.882 1.00 2.22 N ATOM 719 CA ALA A 55 -18.673 17.530 19.354 1.00 72.14 C ATOM 720 C ALA A 55 -18.869 16.512 20.472 1.00 75.01 C ATOM 721 O ALA A 55 -17.989 16.317 21.308 1.00 4.43 O ATOM 722 CB ALA A 55 -17.688 17.000 18.322 1.00 3.53 C ATOM 0 H ALA A 55 -17.232 18.822 20.158 1.00 2.22 H new ATOM 0 HA ALA A 55 -19.637 17.690 18.871 1.00 72.14 H new ATOM 0 HB1 ALA A 55 -18.044 16.045 17.936 1.00 3.53 H new ATOM 0 HB2 ALA A 55 -17.601 17.713 17.502 1.00 3.53 H new ATOM 0 HB3 ALA A 55 -16.712 16.862 18.788 1.00 3.53 H new ATOM 728 N ASN A 56 -20.031 15.866 20.480 1.00 22.33 N ATOM 729 CA ASN A 56 -20.343 14.868 21.497 1.00 0.24 C ATOM 730 C ASN A 56 -20.033 13.462 20.993 1.00 31.13 C ATOM 731 O ASN A 56 -19.781 13.258 19.806 1.00 53.05 O ATOM 732 CB ASN A 56 -21.816 14.964 21.901 1.00 43.51 C ATOM 733 CG ASN A 56 -22.008 15.688 23.220 1.00 43.33 C ATOM 734 OD1 ASN A 56 -22.689 15.194 24.118 1.00 11.31 O ATOM 735 ND2 ASN A 56 -21.406 16.866 23.341 1.00 31.21 N ATOM 0 H ASN A 56 -20.771 16.016 19.794 1.00 22.33 H new ATOM 0 HA ASN A 56 -19.720 15.068 22.369 1.00 0.24 H new ATOM 0 HB2 ASN A 56 -22.371 15.484 21.120 1.00 43.51 H new ATOM 0 HB3 ASN A 56 -22.235 13.961 21.976 1.00 43.51 H new ATOM 0 HD21 ASN A 56 -21.499 17.400 24.205 1.00 31.21 H new ATOM 0 HD22 ASN A 56 -20.851 17.237 22.570 1.00 31.21 H new ATOM 742 N PHE A 57 -20.054 12.495 21.904 1.00 32.34 N ATOM 743 CA PHE A 57 -19.775 11.107 21.553 1.00 53.21 C ATOM 744 C PHE A 57 -20.902 10.524 20.705 1.00 21.10 C ATOM 745 O PHE A 57 -20.670 9.671 19.848 1.00 55.12 O ATOM 746 CB PHE A 57 -19.586 10.267 22.817 1.00 21.34 C ATOM 747 CG PHE A 57 -18.166 9.829 23.039 1.00 13.13 C ATOM 748 CD1 PHE A 57 -17.159 10.764 23.218 1.00 72.13 C ATOM 749 CD2 PHE A 57 -17.839 8.483 23.070 1.00 51.10 C ATOM 750 CE1 PHE A 57 -15.852 10.364 23.421 1.00 31.33 C ATOM 751 CE2 PHE A 57 -16.534 8.077 23.274 1.00 64.04 C ATOM 752 CZ PHE A 57 -15.539 9.019 23.450 1.00 31.35 C ATOM 0 H PHE A 57 -20.261 12.647 22.891 1.00 32.34 H new ATOM 0 HA PHE A 57 -18.855 11.084 20.969 1.00 53.21 H new ATOM 0 HB2 PHE A 57 -19.919 10.844 23.680 1.00 21.34 H new ATOM 0 HB3 PHE A 57 -20.224 9.386 22.757 1.00 21.34 H new ATOM 0 HD1 PHE A 57 -17.398 11.817 23.199 1.00 72.13 H new ATOM 0 HD2 PHE A 57 -18.613 7.742 22.933 1.00 51.10 H new ATOM 0 HE1 PHE A 57 -15.076 11.103 23.557 1.00 31.33 H new ATOM 0 HE2 PHE A 57 -16.292 7.025 23.296 1.00 64.04 H new ATOM 0 HZ PHE A 57 -14.518 8.704 23.610 1.00 31.35 H new ATOM 762 N ASP A 58 -22.121 10.990 20.951 1.00 33.33 N ATOM 763 CA ASP A 58 -23.285 10.516 20.211 1.00 61.40 C ATOM 764 C ASP A 58 -23.133 10.800 18.720 1.00 70.11 C ATOM 765 O ASP A 58 -23.373 9.928 17.885 1.00 14.12 O ATOM 766 CB ASP A 58 -24.558 11.177 20.742 1.00 61.42 C ATOM 767 CG ASP A 58 -25.115 10.466 21.960 1.00 62.35 C ATOM 768 OD1 ASP A 58 -24.406 10.404 22.986 1.00 34.44 O ATOM 769 OD2 ASP A 58 -26.259 9.972 21.886 1.00 14.20 O ATOM 0 H ASP A 58 -22.329 11.696 21.657 1.00 33.33 H new ATOM 0 HA ASP A 58 -23.360 9.438 20.351 1.00 61.40 H new ATOM 0 HB2 ASP A 58 -24.346 12.215 20.997 1.00 61.42 H new ATOM 0 HB3 ASP A 58 -25.313 11.190 19.956 1.00 61.42 H new ATOM 774 N GLN A 59 -22.734 12.025 18.394 1.00 61.01 N ATOM 775 CA GLN A 59 -22.552 12.424 17.003 1.00 32.12 C ATOM 776 C GLN A 59 -21.310 11.770 16.407 1.00 31.22 C ATOM 777 O GLN A 59 -21.259 11.486 15.210 1.00 0.31 O ATOM 778 CB GLN A 59 -22.442 13.946 16.897 1.00 32.14 C ATOM 779 CG GLN A 59 -21.263 14.525 17.662 1.00 13.35 C ATOM 780 CD GLN A 59 -21.037 15.994 17.361 1.00 22.31 C ATOM 781 OE1 GLN A 59 -20.208 16.346 16.521 1.00 14.41 O ATOM 782 NE2 GLN A 59 -21.774 16.860 18.047 1.00 71.43 N ATOM 0 H GLN A 59 -22.531 12.758 19.073 1.00 61.01 H new ATOM 0 HA GLN A 59 -23.423 12.090 16.439 1.00 32.12 H new ATOM 0 HB2 GLN A 59 -22.354 14.223 15.847 1.00 32.14 H new ATOM 0 HB3 GLN A 59 -23.362 14.395 17.270 1.00 32.14 H new ATOM 0 HG2 GLN A 59 -21.431 14.399 18.731 1.00 13.35 H new ATOM 0 HG3 GLN A 59 -20.362 13.964 17.413 1.00 13.35 H new ATOM 0 HE21 GLN A 59 -22.449 16.524 18.734 1.00 71.43 H new ATOM 0 HE22 GLN A 59 -21.665 17.861 17.887 1.00 71.43 H new ATOM 791 N PHE A 60 -20.310 11.533 17.250 1.00 51.04 N ATOM 792 CA PHE A 60 -19.067 10.913 16.806 1.00 41.43 C ATOM 793 C PHE A 60 -19.317 9.497 16.297 1.00 63.31 C ATOM 794 O PHE A 60 -18.886 9.134 15.202 1.00 51.33 O ATOM 795 CB PHE A 60 -18.050 10.885 17.949 1.00 41.05 C ATOM 796 CG PHE A 60 -16.862 10.008 17.673 1.00 75.43 C ATOM 797 CD1 PHE A 60 -16.052 10.242 16.574 1.00 62.24 C ATOM 798 CD2 PHE A 60 -16.557 8.949 18.513 1.00 64.04 C ATOM 799 CE1 PHE A 60 -14.959 9.435 16.317 1.00 11.31 C ATOM 800 CE2 PHE A 60 -15.465 8.139 18.261 1.00 2.34 C ATOM 801 CZ PHE A 60 -14.665 8.384 17.163 1.00 65.43 C ATOM 0 H PHE A 60 -20.336 11.761 18.244 1.00 51.04 H new ATOM 0 HA PHE A 60 -18.665 11.509 15.986 1.00 41.43 H new ATOM 0 HB2 PHE A 60 -17.705 11.901 18.142 1.00 41.05 H new ATOM 0 HB3 PHE A 60 -18.545 10.538 18.856 1.00 41.05 H new ATOM 0 HD1 PHE A 60 -16.277 11.064 15.910 1.00 62.24 H new ATOM 0 HD2 PHE A 60 -17.179 8.754 19.374 1.00 64.04 H new ATOM 0 HE1 PHE A 60 -14.336 9.626 15.456 1.00 11.31 H new ATOM 0 HE2 PHE A 60 -15.238 7.316 18.922 1.00 2.34 H new ATOM 0 HZ PHE A 60 -13.810 7.754 16.966 1.00 65.43 H new ATOM 811 N ILE A 61 -20.014 8.701 17.100 1.00 34.40 N ATOM 812 CA ILE A 61 -20.322 7.324 16.732 1.00 51.34 C ATOM 813 C ILE A 61 -21.391 7.272 15.646 1.00 74.14 C ATOM 814 O ILE A 61 -21.323 6.448 14.734 1.00 55.31 O ATOM 815 CB ILE A 61 -20.801 6.510 17.948 1.00 71.44 C ATOM 816 CG1 ILE A 61 -19.732 6.509 19.042 1.00 42.30 C ATOM 817 CG2 ILE A 61 -21.141 5.086 17.531 1.00 42.30 C ATOM 818 CD1 ILE A 61 -20.132 5.734 20.278 1.00 71.14 C ATOM 0 H ILE A 61 -20.376 8.986 18.010 1.00 34.40 H new ATOM 0 HA ILE A 61 -19.400 6.885 16.352 1.00 51.34 H new ATOM 0 HB ILE A 61 -21.702 6.977 18.347 1.00 71.44 H new ATOM 0 HG12 ILE A 61 -18.812 6.085 18.639 1.00 42.30 H new ATOM 0 HG13 ILE A 61 -19.512 7.539 19.324 1.00 42.30 H new ATOM 0 HG21 ILE A 61 -21.478 4.523 18.401 1.00 42.30 H new ATOM 0 HG22 ILE A 61 -21.933 5.105 16.782 1.00 42.30 H new ATOM 0 HG23 ILE A 61 -20.256 4.609 17.111 1.00 42.30 H new ATOM 0 HD11 ILE A 61 -19.326 5.777 21.011 1.00 71.14 H new ATOM 0 HD12 ILE A 61 -21.034 6.171 20.705 1.00 71.14 H new ATOM 0 HD13 ILE A 61 -20.324 4.695 20.010 1.00 71.14 H new ATOM 830 N GLU A 62 -22.377 8.158 15.750 1.00 42.14 N ATOM 831 CA GLU A 62 -23.460 8.213 14.775 1.00 30.10 C ATOM 832 C GLU A 62 -22.918 8.482 13.374 1.00 14.21 C ATOM 833 O GLU A 62 -23.379 7.896 12.395 1.00 33.55 O ATOM 834 CB GLU A 62 -24.469 9.297 15.161 1.00 63.22 C ATOM 835 CG GLU A 62 -25.736 9.276 14.322 1.00 25.31 C ATOM 836 CD GLU A 62 -25.792 10.414 13.321 1.00 23.45 C ATOM 837 OE1 GLU A 62 -24.938 10.444 12.411 1.00 42.35 O ATOM 838 OE2 GLU A 62 -26.689 11.273 13.449 1.00 24.11 O ATOM 0 H GLU A 62 -22.448 8.847 16.499 1.00 42.14 H new ATOM 0 HA GLU A 62 -23.961 7.245 14.772 1.00 30.10 H new ATOM 0 HB2 GLU A 62 -24.736 9.175 16.211 1.00 63.22 H new ATOM 0 HB3 GLU A 62 -23.995 10.274 15.064 1.00 63.22 H new ATOM 0 HG2 GLU A 62 -25.800 8.326 13.791 1.00 25.31 H new ATOM 0 HG3 GLU A 62 -26.604 9.332 14.979 1.00 25.31 H new ATOM 845 N ALA A 63 -21.937 9.374 13.287 1.00 53.51 N ATOM 846 CA ALA A 63 -21.331 9.721 12.007 1.00 14.12 C ATOM 847 C ALA A 63 -20.369 8.633 11.543 1.00 52.13 C ATOM 848 O ALA A 63 -20.475 8.135 10.421 1.00 12.35 O ATOM 849 CB ALA A 63 -20.611 11.057 12.109 1.00 1.32 C ATOM 0 H ALA A 63 -21.545 9.870 14.088 1.00 53.51 H new ATOM 0 HA ALA A 63 -22.127 9.806 11.267 1.00 14.12 H new ATOM 0 HB1 ALA A 63 -20.163 11.303 11.146 1.00 1.32 H new ATOM 0 HB2 ALA A 63 -21.323 11.834 12.388 1.00 1.32 H new ATOM 0 HB3 ALA A 63 -19.830 10.992 12.866 1.00 1.32 H new ATOM 855 N ILE A 64 -19.431 8.270 12.411 1.00 72.53 N ATOM 856 CA ILE A 64 -18.451 7.240 12.088 1.00 2.24 C ATOM 857 C ILE A 64 -19.116 5.877 11.934 1.00 22.41 C ATOM 858 O ILE A 64 -20.060 5.550 12.653 1.00 13.22 O ATOM 859 CB ILE A 64 -17.357 7.146 13.169 1.00 53.20 C ATOM 860 CG1 ILE A 64 -16.627 8.484 13.304 1.00 20.22 C ATOM 861 CG2 ILE A 64 -16.376 6.032 12.834 1.00 15.45 C ATOM 862 CD1 ILE A 64 -15.851 8.877 12.066 1.00 32.54 C ATOM 0 H ILE A 64 -19.329 8.673 13.342 1.00 72.53 H new ATOM 0 HA ILE A 64 -17.992 7.526 11.142 1.00 2.24 H new ATOM 0 HB ILE A 64 -17.829 6.913 14.124 1.00 53.20 H new ATOM 0 HG12 ILE A 64 -17.354 9.264 13.530 1.00 20.22 H new ATOM 0 HG13 ILE A 64 -15.942 8.431 14.151 1.00 20.22 H new ATOM 0 HG21 ILE A 64 -15.609 5.978 13.607 1.00 15.45 H new ATOM 0 HG22 ILE A 64 -16.908 5.082 12.783 1.00 15.45 H new ATOM 0 HG23 ILE A 64 -15.907 6.237 11.871 1.00 15.45 H new ATOM 0 HD11 ILE A 64 -15.359 9.835 12.234 1.00 32.54 H new ATOM 0 HD12 ILE A 64 -15.100 8.117 11.851 1.00 32.54 H new ATOM 0 HD13 ILE A 64 -16.534 8.962 11.221 1.00 32.54 H new ATOM 874 N ASP A 65 -18.615 5.084 10.993 1.00 34.20 N ATOM 875 CA ASP A 65 -19.159 3.753 10.746 1.00 42.33 C ATOM 876 C ASP A 65 -18.040 2.722 10.631 1.00 54.21 C ATOM 877 O ASP A 65 -16.944 3.029 10.162 1.00 20.12 O ATOM 878 CB ASP A 65 -20.003 3.753 9.470 1.00 22.32 C ATOM 879 CG ASP A 65 -21.480 3.945 9.753 1.00 22.21 C ATOM 880 OD1 ASP A 65 -21.991 3.309 10.699 1.00 63.42 O ATOM 881 OD2 ASP A 65 -22.125 4.732 9.029 1.00 24.15 O ATOM 0 H ASP A 65 -17.834 5.339 10.389 1.00 34.20 H new ATOM 0 HA ASP A 65 -19.792 3.483 11.591 1.00 42.33 H new ATOM 0 HB2 ASP A 65 -19.657 4.547 8.809 1.00 22.32 H new ATOM 0 HB3 ASP A 65 -19.857 2.811 8.941 1.00 22.32 H new ATOM 886 N LYS A 66 -18.324 1.498 11.063 1.00 55.21 N ATOM 887 CA LYS A 66 -17.344 0.421 11.009 1.00 22.51 C ATOM 888 C LYS A 66 -17.401 -0.301 9.666 1.00 11.32 C ATOM 889 O LYS A 66 -18.158 -1.255 9.496 1.00 61.41 O ATOM 890 CB LYS A 66 -17.587 -0.575 12.146 1.00 61.25 C ATOM 891 CG LYS A 66 -16.661 -1.779 12.108 1.00 53.11 C ATOM 892 CD LYS A 66 -17.417 -3.053 11.772 1.00 74.43 C ATOM 893 CE LYS A 66 -16.686 -4.286 12.281 1.00 70.14 C ATOM 894 NZ LYS A 66 -17.626 -5.395 12.603 1.00 31.03 N ATOM 0 H LYS A 66 -19.226 1.227 11.455 1.00 55.21 H new ATOM 0 HA LYS A 66 -16.353 0.860 11.124 1.00 22.51 H new ATOM 0 HB2 LYS A 66 -17.463 -0.062 13.100 1.00 61.25 H new ATOM 0 HB3 LYS A 66 -18.620 -0.920 12.101 1.00 61.25 H new ATOM 0 HG2 LYS A 66 -15.878 -1.614 11.368 1.00 53.11 H new ATOM 0 HG3 LYS A 66 -16.168 -1.891 13.074 1.00 53.11 H new ATOM 0 HD2 LYS A 66 -18.414 -3.012 12.211 1.00 74.43 H new ATOM 0 HD3 LYS A 66 -17.547 -3.126 10.692 1.00 74.43 H new ATOM 0 HE2 LYS A 66 -15.973 -4.622 11.528 1.00 70.14 H new ATOM 0 HE3 LYS A 66 -16.112 -4.026 13.171 1.00 70.14 H new ATOM 0 HZ1 LYS A 66 -17.089 -6.217 12.946 1.00 31.03 H new ATOM 0 HZ2 LYS A 66 -18.291 -5.084 13.340 1.00 31.03 H new ATOM 0 HZ3 LYS A 66 -18.156 -5.660 11.748 1.00 31.03 H new ATOM 908 N ASN A 67 -16.595 0.162 8.716 1.00 2.03 N ATOM 909 CA ASN A 67 -16.554 -0.440 7.389 1.00 64.14 C ATOM 910 C ASN A 67 -15.534 0.268 6.502 1.00 52.15 C ATOM 911 O ASN A 67 -14.452 -0.257 6.240 1.00 4.43 O ATOM 912 CB ASN A 67 -17.937 -0.386 6.738 1.00 13.01 C ATOM 913 CG ASN A 67 -18.604 -1.747 6.683 1.00 11.12 C ATOM 914 OD1 ASN A 67 -18.001 -2.729 6.250 1.00 52.24 O ATOM 915 ND2 ASN A 67 -19.855 -1.811 7.124 1.00 52.23 N ATOM 0 H ASN A 67 -15.962 0.952 8.841 1.00 2.03 H new ATOM 0 HA ASN A 67 -16.253 -1.482 7.499 1.00 64.14 H new ATOM 0 HB2 ASN A 67 -18.571 0.304 7.295 1.00 13.01 H new ATOM 0 HB3 ASN A 67 -17.844 0.011 5.727 1.00 13.01 H new ATOM 0 HD21 ASN A 67 -20.355 -2.700 7.112 1.00 52.23 H new ATOM 0 HD22 ASN A 67 -20.316 -0.971 7.474 1.00 52.23 H new ATOM 922 N VAL A 68 -15.888 1.464 6.041 1.00 21.03 N ATOM 923 CA VAL A 68 -15.004 2.246 5.185 1.00 60.30 C ATOM 924 C VAL A 68 -13.797 2.758 5.963 1.00 52.21 C ATOM 925 O VAL A 68 -13.839 2.928 7.182 1.00 72.43 O ATOM 926 CB VAL A 68 -15.744 3.443 4.559 1.00 65.11 C ATOM 927 CG1 VAL A 68 -16.742 2.967 3.515 1.00 41.24 C ATOM 928 CG2 VAL A 68 -16.437 4.263 5.636 1.00 4.24 C ATOM 0 H VAL A 68 -16.781 1.912 6.246 1.00 21.03 H new ATOM 0 HA VAL A 68 -14.664 1.582 4.390 1.00 60.30 H new ATOM 0 HB VAL A 68 -15.013 4.081 4.063 1.00 65.11 H new ATOM 0 HG11 VAL A 68 -17.255 3.826 3.084 1.00 41.24 H new ATOM 0 HG12 VAL A 68 -16.216 2.426 2.728 1.00 41.24 H new ATOM 0 HG13 VAL A 68 -17.472 2.306 3.984 1.00 41.24 H new ATOM 0 HG21 VAL A 68 -16.955 5.105 5.176 1.00 4.24 H new ATOM 0 HG22 VAL A 68 -17.158 3.637 6.162 1.00 4.24 H new ATOM 0 HG23 VAL A 68 -15.696 4.636 6.343 1.00 4.24 H new ATOM 938 N PRO A 69 -12.694 3.012 5.244 1.00 41.24 N ATOM 939 CA PRO A 69 -11.454 3.510 5.846 1.00 43.54 C ATOM 940 C PRO A 69 -11.584 4.949 6.336 1.00 71.45 C ATOM 941 O PRO A 69 -11.924 5.848 5.566 1.00 74.00 O ATOM 942 CB PRO A 69 -10.444 3.426 4.699 1.00 64.24 C ATOM 943 CG PRO A 69 -11.269 3.507 3.461 1.00 45.13 C ATOM 944 CD PRO A 69 -12.573 2.833 3.787 1.00 5.10 C ATOM 0 HA PRO A 69 -11.169 2.934 6.727 1.00 43.54 H new ATOM 0 HB2 PRO A 69 -9.722 4.241 4.747 1.00 64.24 H new ATOM 0 HB3 PRO A 69 -9.878 2.495 4.737 1.00 64.24 H new ATOM 0 HG2 PRO A 69 -11.429 4.544 3.166 1.00 45.13 H new ATOM 0 HG3 PRO A 69 -10.771 3.011 2.627 1.00 45.13 H new ATOM 0 HD2 PRO A 69 -13.407 3.292 3.255 1.00 5.10 H new ATOM 0 HD3 PRO A 69 -12.560 1.779 3.511 1.00 5.10 H new ATOM 952 N CYS A 70 -11.311 5.159 7.618 1.00 33.54 N ATOM 953 CA CYS A 70 -11.399 6.489 8.211 1.00 24.50 C ATOM 954 C CYS A 70 -10.493 6.600 9.433 1.00 64.11 C ATOM 955 O CYS A 70 -10.318 5.636 10.179 1.00 13.11 O ATOM 956 CB CYS A 70 -12.844 6.801 8.602 1.00 4.42 C ATOM 957 SG CYS A 70 -13.447 5.852 10.018 1.00 51.21 S ATOM 0 H CYS A 70 -11.027 4.426 8.268 1.00 33.54 H new ATOM 0 HA CYS A 70 -11.067 7.214 7.468 1.00 24.50 H new ATOM 0 HB2 CYS A 70 -12.926 7.864 8.829 1.00 4.42 H new ATOM 0 HB3 CYS A 70 -13.491 6.607 7.746 1.00 4.42 H new ATOM 0 HG CYS A 70 -14.747 5.853 10.019 1.00 51.21 H new ATOM 963 N TYR A 71 -9.917 7.781 9.630 1.00 20.42 N ATOM 964 CA TYR A 71 -9.025 8.017 10.759 1.00 31.12 C ATOM 965 C TYR A 71 -9.438 9.269 11.526 1.00 3.45 C ATOM 966 O TYR A 71 -9.801 10.284 10.932 1.00 64.23 O ATOM 967 CB TYR A 71 -7.581 8.155 10.275 1.00 23.41 C ATOM 968 CG TYR A 71 -7.415 9.131 9.133 1.00 54.50 C ATOM 969 CD1 TYR A 71 -7.664 8.746 7.821 1.00 11.35 C ATOM 970 CD2 TYR A 71 -7.011 10.440 9.366 1.00 53.52 C ATOM 971 CE1 TYR A 71 -7.513 9.635 6.775 1.00 15.41 C ATOM 972 CE2 TYR A 71 -6.860 11.337 8.326 1.00 65.14 C ATOM 973 CZ TYR A 71 -7.111 10.929 7.032 1.00 13.51 C ATOM 974 OH TYR A 71 -6.962 11.819 5.993 1.00 65.44 O ATOM 0 H TYR A 71 -10.052 8.589 9.023 1.00 20.42 H new ATOM 0 HA TYR A 71 -9.096 7.161 11.430 1.00 31.12 H new ATOM 0 HB2 TYR A 71 -6.956 8.475 11.109 1.00 23.41 H new ATOM 0 HB3 TYR A 71 -7.217 7.177 9.961 1.00 23.41 H new ATOM 0 HD1 TYR A 71 -7.981 7.734 7.616 1.00 11.35 H new ATOM 0 HD2 TYR A 71 -6.812 10.762 10.377 1.00 53.52 H new ATOM 0 HE1 TYR A 71 -7.709 9.319 5.761 1.00 15.41 H new ATOM 0 HE2 TYR A 71 -6.547 12.351 8.525 1.00 65.14 H new ATOM 0 HH TYR A 71 -6.675 12.687 6.345 1.00 65.44 H new ATOM 984 N ALA A 72 -9.378 9.190 12.852 1.00 72.12 N ATOM 985 CA ALA A 72 -9.743 10.317 13.702 1.00 64.42 C ATOM 986 C ALA A 72 -8.593 10.700 14.628 1.00 73.31 C ATOM 987 O ALA A 72 -8.139 9.890 15.436 1.00 45.43 O ATOM 988 CB ALA A 72 -10.988 9.986 14.511 1.00 23.03 C ATOM 0 H ALA A 72 -9.080 8.357 13.360 1.00 72.12 H new ATOM 0 HA ALA A 72 -9.958 11.171 13.060 1.00 64.42 H new ATOM 0 HB1 ALA A 72 -11.249 10.836 15.141 1.00 23.03 H new ATOM 0 HB2 ALA A 72 -11.814 9.768 13.834 1.00 23.03 H new ATOM 0 HB3 ALA A 72 -10.794 9.116 15.138 1.00 23.03 H new ATOM 994 N ALA A 73 -8.128 11.938 14.504 1.00 3.35 N ATOM 995 CA ALA A 73 -7.032 12.429 15.332 1.00 73.44 C ATOM 996 C ALA A 73 -7.536 13.412 16.383 1.00 23.41 C ATOM 997 O ALA A 73 -7.995 14.506 16.055 1.00 23.02 O ATOM 998 CB ALA A 73 -5.967 13.081 14.464 1.00 43.35 C ATOM 0 H ALA A 73 -8.492 12.620 13.839 1.00 3.35 H new ATOM 0 HA ALA A 73 -6.591 11.578 15.851 1.00 73.44 H new ATOM 0 HB1 ALA A 73 -5.155 13.443 15.095 1.00 43.35 H new ATOM 0 HB2 ALA A 73 -5.578 12.350 13.755 1.00 43.35 H new ATOM 0 HB3 ALA A 73 -6.404 13.918 13.919 1.00 43.35 H new ATOM 1004 N PHE A 74 -7.448 13.014 17.648 1.00 5.22 N ATOM 1005 CA PHE A 74 -7.896 13.860 18.748 1.00 0.02 C ATOM 1006 C PHE A 74 -6.728 14.238 19.654 1.00 11.35 C ATOM 1007 O PHE A 74 -5.851 13.419 19.929 1.00 11.24 O ATOM 1008 CB PHE A 74 -8.977 13.145 19.562 1.00 64.23 C ATOM 1009 CG PHE A 74 -8.482 11.911 20.262 1.00 40.33 C ATOM 1010 CD1 PHE A 74 -8.316 10.724 19.567 1.00 74.10 C ATOM 1011 CD2 PHE A 74 -8.182 11.939 21.614 1.00 11.30 C ATOM 1012 CE1 PHE A 74 -7.862 9.587 20.209 1.00 52.41 C ATOM 1013 CE2 PHE A 74 -7.727 10.806 22.261 1.00 31.13 C ATOM 1014 CZ PHE A 74 -7.566 9.629 21.557 1.00 30.34 C ATOM 0 H PHE A 74 -7.071 12.111 17.937 1.00 5.22 H new ATOM 0 HA PHE A 74 -8.314 14.773 18.324 1.00 0.02 H new ATOM 0 HB2 PHE A 74 -9.380 13.836 20.302 1.00 64.23 H new ATOM 0 HB3 PHE A 74 -9.799 12.873 18.900 1.00 64.23 H new ATOM 0 HD1 PHE A 74 -8.544 10.687 18.512 1.00 74.10 H new ATOM 0 HD2 PHE A 74 -8.305 12.857 22.169 1.00 11.30 H new ATOM 0 HE1 PHE A 74 -7.739 8.667 19.657 1.00 52.41 H new ATOM 0 HE2 PHE A 74 -7.498 10.841 23.316 1.00 31.13 H new ATOM 0 HZ PHE A 74 -7.209 8.743 22.060 1.00 30.34 H new ATOM 1024 N ASP A 75 -6.724 15.484 20.115 1.00 41.44 N ATOM 1025 CA ASP A 75 -5.665 15.973 20.990 1.00 22.43 C ATOM 1026 C ASP A 75 -6.014 15.726 22.455 1.00 64.33 C ATOM 1027 O ASP A 75 -7.070 16.142 22.931 1.00 73.53 O ATOM 1028 CB ASP A 75 -5.426 17.465 20.755 1.00 71.25 C ATOM 1029 CG ASP A 75 -4.369 18.035 21.679 1.00 4.11 C ATOM 1030 OD1 ASP A 75 -4.706 18.363 22.836 1.00 0.02 O ATOM 1031 OD2 ASP A 75 -3.203 18.153 21.246 1.00 35.20 O ATOM 0 H ASP A 75 -7.443 16.174 19.897 1.00 41.44 H new ATOM 0 HA ASP A 75 -4.752 15.426 20.754 1.00 22.43 H new ATOM 0 HB2 ASP A 75 -5.123 17.623 19.720 1.00 71.25 H new ATOM 0 HB3 ASP A 75 -6.361 18.007 20.899 1.00 71.25 H new ATOM 1036 N PHE A 76 -5.119 15.046 23.164 1.00 31.32 N ATOM 1037 CA PHE A 76 -5.333 14.741 24.574 1.00 12.32 C ATOM 1038 C PHE A 76 -4.174 15.255 25.424 1.00 72.15 C ATOM 1039 O PHE A 76 -3.180 15.754 24.898 1.00 61.24 O ATOM 1040 CB PHE A 76 -5.497 13.233 24.773 1.00 2.12 C ATOM 1041 CG PHE A 76 -6.455 12.874 25.873 1.00 71.15 C ATOM 1042 CD1 PHE A 76 -7.805 13.164 25.755 1.00 2.14 C ATOM 1043 CD2 PHE A 76 -6.006 12.247 27.023 1.00 20.54 C ATOM 1044 CE1 PHE A 76 -8.689 12.835 26.765 1.00 34.40 C ATOM 1045 CE2 PHE A 76 -6.886 11.914 28.036 1.00 1.31 C ATOM 1046 CZ PHE A 76 -8.229 12.210 27.907 1.00 20.24 C ATOM 0 H PHE A 76 -4.239 14.696 22.785 1.00 31.32 H new ATOM 0 HA PHE A 76 -6.246 15.244 24.894 1.00 12.32 H new ATOM 0 HB2 PHE A 76 -5.843 12.787 23.841 1.00 2.12 H new ATOM 0 HB3 PHE A 76 -4.523 12.796 24.993 1.00 2.12 H new ATOM 0 HD1 PHE A 76 -8.170 13.653 24.864 1.00 2.14 H new ATOM 0 HD2 PHE A 76 -4.957 12.015 27.130 1.00 20.54 H new ATOM 0 HE1 PHE A 76 -9.739 13.067 26.661 1.00 34.40 H new ATOM 0 HE2 PHE A 76 -6.524 11.423 28.927 1.00 1.31 H new ATOM 0 HZ PHE A 76 -8.918 11.953 28.698 1.00 20.24 H new ATOM 1056 N GLU A 77 -4.312 15.129 26.740 1.00 65.02 N ATOM 1057 CA GLU A 77 -3.277 15.582 27.662 1.00 64.31 C ATOM 1058 C GLU A 77 -2.636 14.400 28.384 1.00 61.44 C ATOM 1059 O GLU A 77 -3.293 13.394 28.656 1.00 42.43 O ATOM 1060 CB GLU A 77 -3.864 16.559 28.682 1.00 3.04 C ATOM 1061 CG GLU A 77 -5.218 16.133 29.225 1.00 65.44 C ATOM 1062 CD GLU A 77 -5.675 16.989 30.389 1.00 35.34 C ATOM 1063 OE1 GLU A 77 -4.994 16.979 31.436 1.00 40.00 O ATOM 1064 OE2 GLU A 77 -6.715 17.668 30.255 1.00 63.31 O ATOM 0 H GLU A 77 -5.129 14.718 27.191 1.00 65.02 H new ATOM 0 HA GLU A 77 -2.508 16.092 27.082 1.00 64.31 H new ATOM 0 HB2 GLU A 77 -3.166 16.666 29.513 1.00 3.04 H new ATOM 0 HB3 GLU A 77 -3.961 17.541 28.218 1.00 3.04 H new ATOM 0 HG2 GLU A 77 -5.958 16.186 28.427 1.00 65.44 H new ATOM 0 HG3 GLU A 77 -5.166 15.092 29.543 1.00 65.44 H new ATOM 1167 N ARG A 85 1.664 18.189 29.669 1.00 32.05 N ATOM 1168 CA ARG A 85 2.155 17.719 28.380 1.00 42.12 C ATOM 1169 C ARG A 85 1.000 17.478 27.413 1.00 73.21 C ATOM 1170 O ARG A 85 -0.106 17.127 27.826 1.00 3.21 O ATOM 1171 CB ARG A 85 2.964 16.433 28.556 1.00 31.42 C ATOM 1172 CG ARG A 85 4.354 16.499 27.946 1.00 25.10 C ATOM 1173 CD ARG A 85 4.458 15.633 26.700 1.00 21.24 C ATOM 1174 NE ARG A 85 5.821 15.586 26.178 1.00 41.31 N ATOM 1175 CZ ARG A 85 6.391 16.591 25.522 1.00 24.20 C ATOM 1176 NH1 ARG A 85 5.720 17.714 25.310 1.00 41.42 N ATOM 1177 NH2 ARG A 85 7.636 16.473 25.077 1.00 31.23 N ATOM 0 HA ARG A 85 2.801 18.492 27.962 1.00 42.12 H new ATOM 0 HB2 ARG A 85 3.054 16.213 29.620 1.00 31.42 H new ATOM 0 HB3 ARG A 85 2.417 15.605 28.104 1.00 31.42 H new ATOM 0 HG2 ARG A 85 4.593 17.532 27.693 1.00 25.10 H new ATOM 0 HG3 ARG A 85 5.090 16.172 28.680 1.00 25.10 H new ATOM 0 HD2 ARG A 85 4.124 14.622 26.932 1.00 21.24 H new ATOM 0 HD3 ARG A 85 3.789 16.021 25.932 1.00 21.24 H new ATOM 0 HE ARG A 85 6.365 14.736 26.325 1.00 41.31 H new ATOM 0 HH11 ARG A 85 4.763 17.809 25.651 1.00 41.42 H new ATOM 0 HH12 ARG A 85 6.160 18.484 24.806 1.00 41.42 H new ATOM 0 HH21 ARG A 85 8.156 15.610 25.239 1.00 31.23 H new ATOM 0 HH22 ARG A 85 8.073 17.245 24.573 1.00 31.23 H new ATOM 1191 N ASP A 86 1.263 17.668 26.125 1.00 45.31 N ATOM 1192 CA ASP A 86 0.246 17.471 25.099 1.00 63.12 C ATOM 1193 C ASP A 86 0.603 16.292 24.199 1.00 24.43 C ATOM 1194 O ASP A 86 1.744 16.159 23.754 1.00 55.31 O ATOM 1195 CB ASP A 86 0.086 18.739 24.259 1.00 60.13 C ATOM 1196 CG ASP A 86 1.300 19.018 23.394 1.00 73.31 C ATOM 1197 OD1 ASP A 86 2.433 18.912 23.909 1.00 34.30 O ATOM 1198 OD2 ASP A 86 1.117 19.341 22.202 1.00 74.11 O ATOM 0 H ASP A 86 2.173 17.958 25.766 1.00 45.31 H new ATOM 0 HA ASP A 86 -0.699 17.252 25.597 1.00 63.12 H new ATOM 0 HB2 ASP A 86 -0.794 18.642 23.624 1.00 60.13 H new ATOM 0 HB3 ASP A 86 -0.089 19.589 24.919 1.00 60.13 H new ATOM 1203 N LYS A 87 -0.379 15.436 23.937 1.00 64.14 N ATOM 1204 CA LYS A 87 -0.170 14.267 23.090 1.00 4.14 C ATOM 1205 C LYS A 87 -1.411 13.972 22.254 1.00 24.22 C ATOM 1206 O LYS A 87 -2.497 13.756 22.792 1.00 34.13 O ATOM 1207 CB LYS A 87 0.183 13.049 23.946 1.00 23.45 C ATOM 1208 CG LYS A 87 1.398 12.286 23.447 1.00 22.13 C ATOM 1209 CD LYS A 87 2.664 13.119 23.560 1.00 63.54 C ATOM 1210 CE LYS A 87 3.836 12.448 22.860 1.00 64.23 C ATOM 1211 NZ LYS A 87 5.122 13.145 23.139 1.00 1.22 N ATOM 0 H LYS A 87 -1.328 15.530 24.299 1.00 64.14 H new ATOM 0 HA LYS A 87 0.658 14.482 22.415 1.00 4.14 H new ATOM 0 HB2 LYS A 87 0.365 13.376 24.970 1.00 23.45 H new ATOM 0 HB3 LYS A 87 -0.673 12.375 23.974 1.00 23.45 H new ATOM 0 HG2 LYS A 87 1.513 11.367 24.022 1.00 22.13 H new ATOM 0 HG3 LYS A 87 1.244 11.995 22.408 1.00 22.13 H new ATOM 0 HD2 LYS A 87 2.493 14.103 23.124 1.00 63.54 H new ATOM 0 HD3 LYS A 87 2.907 13.274 24.611 1.00 63.54 H new ATOM 0 HE2 LYS A 87 3.907 11.410 23.185 1.00 64.23 H new ATOM 0 HE3 LYS A 87 3.657 12.433 21.785 1.00 64.23 H new ATOM 0 HZ1 LYS A 87 5.896 12.657 22.644 1.00 1.22 H new ATOM 0 HZ2 LYS A 87 5.063 14.128 22.806 1.00 1.22 H new ATOM 0 HZ3 LYS A 87 5.306 13.137 24.163 1.00 1.22 H new ATOM 1225 N LEU A 88 -1.242 13.962 20.937 1.00 40.55 N ATOM 1226 CA LEU A 88 -2.349 13.692 20.025 1.00 23.25 C ATOM 1227 C LEU A 88 -2.332 12.238 19.565 1.00 30.44 C ATOM 1228 O LEU A 88 -1.280 11.696 19.225 1.00 42.33 O ATOM 1229 CB LEU A 88 -2.277 14.623 18.814 1.00 71.21 C ATOM 1230 CG LEU A 88 -2.537 16.104 19.089 1.00 1.35 C ATOM 1231 CD1 LEU A 88 -1.224 16.862 19.213 1.00 14.35 C ATOM 1232 CD2 LEU A 88 -3.402 16.707 17.992 1.00 4.31 C ATOM 0 H LEU A 88 -0.349 14.138 20.476 1.00 40.55 H new ATOM 0 HA LEU A 88 -3.281 13.874 20.560 1.00 23.25 H new ATOM 0 HB2 LEU A 88 -1.289 14.526 18.365 1.00 71.21 H new ATOM 0 HB3 LEU A 88 -2.999 14.279 18.073 1.00 71.21 H new ATOM 0 HG LEU A 88 -3.073 16.190 20.034 1.00 1.35 H new ATOM 0 HD11 LEU A 88 -1.429 17.915 19.409 1.00 14.35 H new ATOM 0 HD12 LEU A 88 -0.640 16.447 20.035 1.00 14.35 H new ATOM 0 HD13 LEU A 88 -0.661 16.768 18.285 1.00 14.35 H new ATOM 0 HD21 LEU A 88 -3.577 17.762 18.205 1.00 4.31 H new ATOM 0 HD22 LEU A 88 -2.893 16.610 17.033 1.00 4.31 H new ATOM 0 HD23 LEU A 88 -4.357 16.182 17.952 1.00 4.31 H new ATOM 1244 N ILE A 89 -3.504 11.612 19.556 1.00 32.13 N ATOM 1245 CA ILE A 89 -3.624 10.222 19.135 1.00 72.24 C ATOM 1246 C ILE A 89 -4.488 10.099 17.884 1.00 40.41 C ATOM 1247 O ILE A 89 -5.411 10.888 17.674 1.00 63.24 O ATOM 1248 CB ILE A 89 -4.227 9.346 20.249 1.00 64.43 C ATOM 1249 CG1 ILE A 89 -3.516 9.612 21.577 1.00 21.33 C ATOM 1250 CG2 ILE A 89 -4.130 7.874 19.876 1.00 71.24 C ATOM 1251 CD1 ILE A 89 -4.368 10.359 22.579 1.00 2.12 C ATOM 0 H ILE A 89 -4.384 12.046 19.836 1.00 32.13 H new ATOM 0 HA ILE A 89 -2.616 9.872 18.914 1.00 72.24 H new ATOM 0 HB ILE A 89 -5.280 9.603 20.364 1.00 64.43 H new ATOM 0 HG12 ILE A 89 -3.208 8.661 22.012 1.00 21.33 H new ATOM 0 HG13 ILE A 89 -2.608 10.184 21.386 1.00 21.33 H new ATOM 0 HG21 ILE A 89 -4.560 7.268 20.673 1.00 71.24 H new ATOM 0 HG22 ILE A 89 -4.677 7.697 18.950 1.00 71.24 H new ATOM 0 HG23 ILE A 89 -3.084 7.602 19.738 1.00 71.24 H new ATOM 0 HD11 ILE A 89 -3.800 10.513 23.497 1.00 2.12 H new ATOM 0 HD12 ILE A 89 -4.655 11.325 22.164 1.00 2.12 H new ATOM 0 HD13 ILE A 89 -5.264 9.778 22.800 1.00 2.12 H new ATOM 1263 N LEU A 90 -4.184 9.105 17.057 1.00 12.10 N ATOM 1264 CA LEU A 90 -4.934 8.877 15.827 1.00 51.04 C ATOM 1265 C LEU A 90 -5.440 7.440 15.755 1.00 24.45 C ATOM 1266 O LEU A 90 -4.652 6.493 15.774 1.00 73.00 O ATOM 1267 CB LEU A 90 -4.060 9.183 14.609 1.00 10.22 C ATOM 1268 CG LEU A 90 -4.742 9.061 13.246 1.00 43.51 C ATOM 1269 CD1 LEU A 90 -4.606 10.359 12.464 1.00 74.22 C ATOM 1270 CD2 LEU A 90 -4.156 7.898 12.459 1.00 41.44 C ATOM 0 H LEU A 90 -3.423 8.444 17.216 1.00 12.10 H new ATOM 0 HA LEU A 90 -5.795 9.546 15.827 1.00 51.04 H new ATOM 0 HB2 LEU A 90 -3.673 10.197 14.710 1.00 10.22 H new ATOM 0 HB3 LEU A 90 -3.202 8.511 14.625 1.00 10.22 H new ATOM 0 HG LEU A 90 -5.802 8.867 13.407 1.00 43.51 H new ATOM 0 HD11 LEU A 90 -5.097 10.254 11.497 1.00 74.22 H new ATOM 0 HD12 LEU A 90 -5.073 11.171 13.022 1.00 74.22 H new ATOM 0 HD13 LEU A 90 -3.550 10.584 12.312 1.00 74.22 H new ATOM 0 HD21 LEU A 90 -4.653 7.826 11.492 1.00 41.44 H new ATOM 0 HD22 LEU A 90 -3.089 8.062 12.307 1.00 41.44 H new ATOM 0 HD23 LEU A 90 -4.305 6.972 13.013 1.00 41.44 H new ATOM 1282 N ILE A 91 -6.757 7.285 15.672 1.00 25.51 N ATOM 1283 CA ILE A 91 -7.366 5.963 15.595 1.00 72.25 C ATOM 1284 C ILE A 91 -7.913 5.691 14.197 1.00 32.23 C ATOM 1285 O ILE A 91 -8.798 6.399 13.717 1.00 44.50 O ATOM 1286 CB ILE A 91 -8.506 5.807 16.619 1.00 43.51 C ATOM 1287 CG1 ILE A 91 -7.976 6.018 18.039 1.00 33.50 C ATOM 1288 CG2 ILE A 91 -9.154 4.437 16.487 1.00 43.44 C ATOM 1289 CD1 ILE A 91 -9.027 6.513 19.008 1.00 24.03 C ATOM 0 H ILE A 91 -7.422 8.058 15.656 1.00 25.51 H new ATOM 0 HA ILE A 91 -6.582 5.241 15.824 1.00 72.25 H new ATOM 0 HB ILE A 91 -9.263 6.565 16.417 1.00 43.51 H new ATOM 0 HG12 ILE A 91 -7.566 5.078 18.409 1.00 33.50 H new ATOM 0 HG13 ILE A 91 -7.155 6.734 18.009 1.00 33.50 H new ATOM 0 HG21 ILE A 91 -9.957 4.343 17.217 1.00 43.44 H new ATOM 0 HG22 ILE A 91 -9.561 4.322 15.483 1.00 43.44 H new ATOM 0 HG23 ILE A 91 -8.408 3.663 16.666 1.00 43.44 H new ATOM 0 HD11 ILE A 91 -8.581 6.640 19.995 1.00 24.03 H new ATOM 0 HD12 ILE A 91 -9.420 7.469 18.661 1.00 24.03 H new ATOM 0 HD13 ILE A 91 -9.838 5.787 19.067 1.00 24.03 H new ATOM 1301 N SER A 92 -7.382 4.658 13.550 1.00 1.34 N ATOM 1302 CA SER A 92 -7.815 4.293 12.207 1.00 53.11 C ATOM 1303 C SER A 92 -8.772 3.105 12.249 1.00 42.22 C ATOM 1304 O SER A 92 -8.563 2.152 13.000 1.00 42.52 O ATOM 1305 CB SER A 92 -6.606 3.958 11.332 1.00 51.15 C ATOM 1306 OG SER A 92 -6.002 5.135 10.824 1.00 53.32 O ATOM 0 H SER A 92 -6.651 4.059 13.935 1.00 1.34 H new ATOM 0 HA SER A 92 -8.340 5.146 11.777 1.00 53.11 H new ATOM 0 HB2 SER A 92 -5.877 3.394 11.914 1.00 51.15 H new ATOM 0 HB3 SER A 92 -6.917 3.319 10.505 1.00 51.15 H new ATOM 0 HG SER A 92 -6.381 5.344 9.945 1.00 53.32 H new ATOM 1312 N TRP A 93 -9.821 3.170 11.437 1.00 1.12 N ATOM 1313 CA TRP A 93 -10.811 2.100 11.381 1.00 43.22 C ATOM 1314 C TRP A 93 -10.554 1.184 10.190 1.00 72.52 C ATOM 1315 O TRP A 93 -10.650 1.606 9.038 1.00 24.23 O ATOM 1316 CB TRP A 93 -12.221 2.686 11.295 1.00 41.12 C ATOM 1317 CG TRP A 93 -13.177 2.079 12.276 1.00 12.13 C ATOM 1318 CD1 TRP A 93 -13.853 0.900 12.140 1.00 10.22 C ATOM 1319 CD2 TRP A 93 -13.565 2.622 13.543 1.00 51.31 C ATOM 1320 NE1 TRP A 93 -14.638 0.678 13.246 1.00 23.20 N ATOM 1321 CE2 TRP A 93 -14.478 1.719 14.121 1.00 12.15 C ATOM 1322 CE3 TRP A 93 -13.228 3.782 14.246 1.00 55.45 C ATOM 1323 CZ2 TRP A 93 -15.058 1.943 15.368 1.00 64.34 C ATOM 1324 CZ3 TRP A 93 -13.805 4.003 15.482 1.00 25.11 C ATOM 1325 CH2 TRP A 93 -14.710 3.087 16.033 1.00 31.34 C ATOM 0 H TRP A 93 -10.008 3.951 10.809 1.00 1.12 H new ATOM 0 HA TRP A 93 -10.726 1.511 12.294 1.00 43.22 H new ATOM 0 HB2 TRP A 93 -12.171 3.761 11.465 1.00 41.12 H new ATOM 0 HB3 TRP A 93 -12.606 2.541 10.286 1.00 41.12 H new ATOM 0 HD1 TRP A 93 -13.781 0.239 11.289 1.00 10.22 H new ATOM 0 HE1 TRP A 93 -15.242 -0.131 13.391 1.00 23.20 H new ATOM 0 HE3 TRP A 93 -12.529 4.493 13.831 1.00 55.45 H new ATOM 0 HZ2 TRP A 93 -15.757 1.239 15.794 1.00 64.34 H new ATOM 0 HZ3 TRP A 93 -13.554 4.897 16.033 1.00 25.11 H new ATOM 0 HH2 TRP A 93 -15.142 3.288 17.002 1.00 31.34 H new ATOM 1336 N ASN A 94 -10.228 -0.073 10.475 1.00 74.11 N ATOM 1337 CA ASN A 94 -9.958 -1.049 9.426 1.00 62.42 C ATOM 1338 C ASN A 94 -10.155 -2.471 9.942 1.00 33.41 C ATOM 1339 O ASN A 94 -9.203 -3.170 10.289 1.00 21.22 O ATOM 1340 CB ASN A 94 -8.532 -0.880 8.898 1.00 2.10 C ATOM 1341 CG ASN A 94 -8.409 -1.255 7.434 1.00 62.11 C ATOM 1342 OD1 ASN A 94 -7.543 -2.044 7.054 1.00 1.43 O ATOM 1343 ND2 ASN A 94 -9.277 -0.690 6.603 1.00 13.24 N ATOM 0 H ASN A 94 -10.145 -0.439 11.423 1.00 74.11 H new ATOM 0 HA ASN A 94 -10.663 -0.875 8.613 1.00 62.42 H new ATOM 0 HB2 ASN A 94 -8.218 0.155 9.033 1.00 2.10 H new ATOM 0 HB3 ASN A 94 -7.854 -1.498 9.487 1.00 2.10 H new ATOM 0 HD21 ASN A 94 -9.243 -0.904 5.606 1.00 13.24 H new ATOM 0 HD22 ASN A 94 -9.978 -0.042 6.961 1.00 13.24 H new ATOM 1350 N PRO A 95 -11.421 -2.912 9.994 1.00 52.41 N ATOM 1351 CA PRO A 95 -11.774 -4.254 10.465 1.00 22.21 C ATOM 1352 C PRO A 95 -11.331 -5.344 9.495 1.00 52.03 C ATOM 1353 O PRO A 95 -11.560 -5.245 8.289 1.00 21.00 O ATOM 1354 CB PRO A 95 -13.301 -4.208 10.557 1.00 31.21 C ATOM 1355 CG PRO A 95 -13.708 -3.156 9.584 1.00 64.12 C ATOM 1356 CD PRO A 95 -12.606 -2.133 9.596 1.00 41.20 C ATOM 0 HA PRO A 95 -11.284 -4.497 11.408 1.00 22.21 H new ATOM 0 HB2 PRO A 95 -13.742 -5.172 10.305 1.00 31.21 H new ATOM 0 HB3 PRO A 95 -13.629 -3.962 11.567 1.00 31.21 H new ATOM 0 HG2 PRO A 95 -13.840 -3.576 8.587 1.00 64.12 H new ATOM 0 HG3 PRO A 95 -14.660 -2.708 9.869 1.00 64.12 H new ATOM 0 HD2 PRO A 95 -12.474 -1.673 8.617 1.00 41.20 H new ATOM 0 HD3 PRO A 95 -12.813 -1.328 10.301 1.00 41.20 H new ATOM 1364 N ASP A 96 -10.697 -6.383 10.028 1.00 54.41 N ATOM 1365 CA ASP A 96 -10.224 -7.492 9.209 1.00 70.34 C ATOM 1366 C ASP A 96 -11.377 -8.132 8.442 1.00 72.30 C ATOM 1367 O ASP A 96 -11.171 -8.773 7.411 1.00 3.23 O ATOM 1368 CB ASP A 96 -9.532 -8.540 10.082 1.00 50.01 C ATOM 1369 CG ASP A 96 -8.941 -9.674 9.267 1.00 2.33 C ATOM 1370 OD1 ASP A 96 -8.157 -9.390 8.337 1.00 73.43 O ATOM 1371 OD2 ASP A 96 -9.261 -10.844 9.561 1.00 61.32 O ATOM 0 H ASP A 96 -10.499 -6.480 11.024 1.00 54.41 H new ATOM 0 HA ASP A 96 -9.506 -7.099 8.489 1.00 70.34 H new ATOM 0 HB2 ASP A 96 -8.742 -8.062 10.661 1.00 50.01 H new ATOM 0 HB3 ASP A 96 -10.249 -8.945 10.796 1.00 50.01 H new ATOM 1376 N SER A 97 -12.591 -7.955 8.953 1.00 34.40 N ATOM 1377 CA SER A 97 -13.777 -8.520 8.319 1.00 12.23 C ATOM 1378 C SER A 97 -14.551 -7.446 7.560 1.00 45.10 C ATOM 1379 O SER A 97 -15.696 -7.654 7.163 1.00 52.20 O ATOM 1380 CB SER A 97 -14.681 -9.170 9.368 1.00 14.12 C ATOM 1381 OG SER A 97 -14.404 -10.554 9.493 1.00 10.14 O ATOM 0 H SER A 97 -12.779 -7.425 9.804 1.00 34.40 H new ATOM 0 HA SER A 97 -13.452 -9.280 7.608 1.00 12.23 H new ATOM 0 HB2 SER A 97 -14.538 -8.679 10.331 1.00 14.12 H new ATOM 0 HB3 SER A 97 -15.726 -9.029 9.090 1.00 14.12 H new ATOM 0 HG SER A 97 -14.994 -10.946 10.171 1.00 10.14 H new ATOM 1387 N GLY A 98 -13.914 -6.295 7.362 1.00 61.52 N ATOM 1388 CA GLY A 98 -14.556 -5.205 6.651 1.00 30.22 C ATOM 1389 C GLY A 98 -14.742 -5.504 5.177 1.00 74.21 C ATOM 1390 O GLY A 98 -15.591 -6.313 4.803 1.00 15.22 O ATOM 0 H GLY A 98 -12.965 -6.099 7.681 1.00 61.52 H new ATOM 0 HA2 GLY A 98 -15.527 -5.003 7.103 1.00 30.22 H new ATOM 0 HA3 GLY A 98 -13.958 -4.301 6.762 1.00 30.22 H new ATOM 1394 N ALA A 99 -13.948 -4.849 4.337 1.00 61.02 N ATOM 1395 CA ALA A 99 -14.029 -5.049 2.895 1.00 32.33 C ATOM 1396 C ALA A 99 -12.642 -5.215 2.285 1.00 44.41 C ATOM 1397 O ALA A 99 -11.631 -4.811 2.862 1.00 73.35 O ATOM 1398 CB ALA A 99 -14.760 -3.886 2.241 1.00 34.23 C ATOM 0 H ALA A 99 -13.241 -4.175 4.630 1.00 61.02 H new ATOM 0 HA ALA A 99 -14.590 -5.965 2.711 1.00 32.33 H new ATOM 0 HB1 ALA A 99 -14.813 -4.049 1.165 1.00 34.23 H new ATOM 0 HB2 ALA A 99 -15.769 -3.816 2.647 1.00 34.23 H new ATOM 0 HB3 ALA A 99 -14.222 -2.959 2.442 1.00 34.23 H new ATOM 1404 N PRO A 100 -12.588 -5.822 1.090 1.00 32.54 N ATOM 1405 CA PRO A 100 -11.329 -6.055 0.376 1.00 35.21 C ATOM 1406 C PRO A 100 -10.711 -4.762 -0.145 1.00 21.35 C ATOM 1407 O PRO A 100 -9.519 -4.516 0.038 1.00 24.13 O ATOM 1408 CB PRO A 100 -11.744 -6.957 -0.789 1.00 54.33 C ATOM 1409 CG PRO A 100 -13.186 -6.651 -1.010 1.00 23.31 C ATOM 1410 CD PRO A 100 -13.753 -6.329 0.345 1.00 42.11 C ATOM 0 HA PRO A 100 -10.568 -6.493 1.022 1.00 35.21 H new ATOM 0 HB2 PRO A 100 -11.154 -6.748 -1.681 1.00 54.33 H new ATOM 0 HB3 PRO A 100 -11.595 -8.009 -0.547 1.00 54.33 H new ATOM 0 HG2 PRO A 100 -13.306 -5.810 -1.693 1.00 23.31 H new ATOM 0 HG3 PRO A 100 -13.701 -7.501 -1.457 1.00 23.31 H new ATOM 0 HD2 PRO A 100 -14.546 -5.583 0.282 1.00 42.11 H new ATOM 0 HD3 PRO A 100 -14.182 -7.211 0.821 1.00 42.11 H new ATOM 1418 N ARG A 101 -11.529 -3.940 -0.793 1.00 43.23 N ATOM 1419 CA ARG A 101 -11.061 -2.672 -1.341 1.00 22.20 C ATOM 1420 C ARG A 101 -10.689 -1.701 -0.224 1.00 21.51 C ATOM 1421 O ARG A 101 -9.655 -1.035 -0.284 1.00 11.13 O ATOM 1422 CB ARG A 101 -12.136 -2.051 -2.234 1.00 43.45 C ATOM 1423 CG ARG A 101 -12.159 -2.618 -3.644 1.00 63.13 C ATOM 1424 CD ARG A 101 -12.419 -1.533 -4.677 1.00 41.05 C ATOM 1425 NE ARG A 101 -12.507 -2.075 -6.031 1.00 33.45 N ATOM 1426 CZ ARG A 101 -12.925 -1.373 -7.078 1.00 31.31 C ATOM 1427 NH1 ARG A 101 -13.290 -0.108 -6.929 1.00 15.54 N ATOM 1428 NH2 ARG A 101 -12.978 -1.937 -8.278 1.00 23.11 N ATOM 0 H ARG A 101 -12.519 -4.129 -0.952 1.00 43.23 H new ATOM 0 HA ARG A 101 -10.171 -2.869 -1.939 1.00 22.20 H new ATOM 0 HB2 ARG A 101 -13.112 -2.205 -1.774 1.00 43.45 H new ATOM 0 HB3 ARG A 101 -11.975 -0.974 -2.287 1.00 43.45 H new ATOM 0 HG2 ARG A 101 -11.207 -3.104 -3.857 1.00 63.13 H new ATOM 0 HG3 ARG A 101 -12.931 -3.384 -3.717 1.00 63.13 H new ATOM 0 HD2 ARG A 101 -13.347 -1.015 -4.433 1.00 41.05 H new ATOM 0 HD3 ARG A 101 -11.620 -0.793 -4.634 1.00 41.05 H new ATOM 0 HE ARG A 101 -12.232 -3.046 -6.180 1.00 33.45 H new ATOM 0 HH11 ARG A 101 -13.250 0.329 -6.008 1.00 15.54 H new ATOM 0 HH12 ARG A 101 -13.611 0.429 -7.735 1.00 15.54 H new ATOM 0 HH21 ARG A 101 -12.698 -2.910 -8.397 1.00 23.11 H new ATOM 0 HH22 ARG A 101 -13.299 -1.397 -9.082 1.00 23.11 H new ATOM 1442 N THR A 102 -11.539 -1.626 0.795 1.00 33.23 N ATOM 1443 CA THR A 102 -11.302 -0.736 1.925 1.00 64.42 C ATOM 1444 C THR A 102 -10.025 -1.117 2.666 1.00 60.43 C ATOM 1445 O THR A 102 -9.227 -0.255 3.033 1.00 44.03 O ATOM 1446 CB THR A 102 -12.482 -0.757 2.915 1.00 63.45 C ATOM 1447 OG1 THR A 102 -12.751 -2.102 3.327 1.00 13.10 O ATOM 1448 CG2 THR A 102 -13.728 -0.156 2.283 1.00 11.43 C ATOM 0 H THR A 102 -12.398 -2.171 0.861 1.00 33.23 H new ATOM 0 HA THR A 102 -11.197 0.270 1.518 1.00 64.42 H new ATOM 0 HB THR A 102 -12.210 -0.159 3.784 1.00 63.45 H new ATOM 0 HG1 THR A 102 -13.258 -2.092 4.166 1.00 13.10 H new ATOM 0 HG21 THR A 102 -14.548 -0.181 3.000 1.00 11.43 H new ATOM 0 HG22 THR A 102 -13.529 0.877 1.996 1.00 11.43 H new ATOM 0 HG23 THR A 102 -14.001 -0.732 1.399 1.00 11.43 H new ATOM 1456 N LYS A 103 -9.837 -2.415 2.883 1.00 51.24 N ATOM 1457 CA LYS A 103 -8.656 -2.912 3.578 1.00 1.53 C ATOM 1458 C LYS A 103 -7.381 -2.492 2.854 1.00 50.15 C ATOM 1459 O LYS A 103 -6.445 -1.984 3.470 1.00 65.15 O ATOM 1460 CB LYS A 103 -8.711 -4.436 3.694 1.00 22.54 C ATOM 1461 CG LYS A 103 -7.399 -5.060 4.140 1.00 75.12 C ATOM 1462 CD LYS A 103 -6.960 -4.527 5.493 1.00 4.00 C ATOM 1463 CE LYS A 103 -6.138 -5.554 6.256 1.00 24.14 C ATOM 1464 NZ LYS A 103 -4.923 -4.948 6.868 1.00 23.35 N ATOM 0 H LYS A 103 -10.488 -3.142 2.587 1.00 51.24 H new ATOM 0 HA LYS A 103 -8.644 -2.478 4.578 1.00 1.53 H new ATOM 0 HB2 LYS A 103 -9.493 -4.710 4.402 1.00 22.54 H new ATOM 0 HB3 LYS A 103 -8.994 -4.856 2.728 1.00 22.54 H new ATOM 0 HG2 LYS A 103 -7.510 -6.143 4.193 1.00 75.12 H new ATOM 0 HG3 LYS A 103 -6.627 -4.854 3.399 1.00 75.12 H new ATOM 0 HD2 LYS A 103 -6.373 -3.619 5.355 1.00 4.00 H new ATOM 0 HD3 LYS A 103 -7.837 -4.253 6.079 1.00 4.00 H new ATOM 0 HE2 LYS A 103 -6.752 -6.003 7.036 1.00 24.14 H new ATOM 0 HE3 LYS A 103 -5.843 -6.357 5.581 1.00 24.14 H new ATOM 0 HZ1 LYS A 103 -4.390 -5.680 7.379 1.00 23.35 H new ATOM 0 HZ2 LYS A 103 -4.324 -4.541 6.121 1.00 23.35 H new ATOM 0 HZ3 LYS A 103 -5.205 -4.199 7.532 1.00 23.35 H new ATOM 1478 N MET A 104 -7.353 -2.706 1.542 1.00 33.43 N ATOM 1479 CA MET A 104 -6.194 -2.348 0.734 1.00 43.50 C ATOM 1480 C MET A 104 -6.081 -0.833 0.588 1.00 62.45 C ATOM 1481 O MET A 104 -4.982 -0.292 0.460 1.00 24.13 O ATOM 1482 CB MET A 104 -6.286 -3.000 -0.647 1.00 12.41 C ATOM 1483 CG MET A 104 -4.958 -3.052 -1.384 1.00 60.42 C ATOM 1484 SD MET A 104 -4.503 -4.726 -1.876 1.00 63.32 S ATOM 1485 CE MET A 104 -3.196 -5.080 -0.703 1.00 70.23 C ATOM 0 H MET A 104 -8.120 -3.126 1.017 1.00 33.43 H new ATOM 0 HA MET A 104 -5.301 -2.715 1.241 1.00 43.50 H new ATOM 0 HB2 MET A 104 -6.671 -4.014 -0.536 1.00 12.41 H new ATOM 0 HB3 MET A 104 -7.007 -2.450 -1.252 1.00 12.41 H new ATOM 0 HG2 MET A 104 -5.013 -2.419 -2.270 1.00 60.42 H new ATOM 0 HG3 MET A 104 -4.176 -2.640 -0.746 1.00 60.42 H new ATOM 0 HE1 MET A 104 -2.811 -6.084 -0.880 1.00 70.23 H new ATOM 0 HE2 MET A 104 -2.391 -4.356 -0.826 1.00 70.23 H new ATOM 0 HE3 MET A 104 -3.590 -5.016 0.311 1.00 70.23 H new ATOM 1495 N LEU A 105 -7.223 -0.155 0.606 1.00 43.01 N ATOM 1496 CA LEU A 105 -7.252 1.298 0.475 1.00 61.31 C ATOM 1497 C LEU A 105 -6.383 1.958 1.540 1.00 3.03 C ATOM 1498 O LEU A 105 -5.563 2.826 1.237 1.00 33.42 O ATOM 1499 CB LEU A 105 -8.689 1.810 0.583 1.00 10.41 C ATOM 1500 CG LEU A 105 -9.275 2.437 -0.683 1.00 32.04 C ATOM 1501 CD1 LEU A 105 -9.343 1.411 -1.803 1.00 55.55 C ATOM 1502 CD2 LEU A 105 -10.654 3.016 -0.402 1.00 33.42 C ATOM 0 H LEU A 105 -8.141 -0.588 0.710 1.00 43.01 H new ATOM 0 HA LEU A 105 -6.853 1.558 -0.505 1.00 61.31 H new ATOM 0 HB2 LEU A 105 -9.328 0.979 0.882 1.00 10.41 H new ATOM 0 HB3 LEU A 105 -8.731 2.549 1.383 1.00 10.41 H new ATOM 0 HG LEU A 105 -8.621 3.249 -1.001 1.00 32.04 H new ATOM 0 HD11 LEU A 105 -9.762 1.874 -2.696 1.00 55.55 H new ATOM 0 HD12 LEU A 105 -8.340 1.044 -2.022 1.00 55.55 H new ATOM 0 HD13 LEU A 105 -9.975 0.578 -1.495 1.00 55.55 H new ATOM 0 HD21 LEU A 105 -11.056 3.458 -1.314 1.00 33.42 H new ATOM 0 HD22 LEU A 105 -11.319 2.223 -0.060 1.00 33.42 H new ATOM 0 HD23 LEU A 105 -10.577 3.782 0.369 1.00 33.42 H new ATOM 1514 N TYR A 106 -6.566 1.540 2.788 1.00 44.32 N ATOM 1515 CA TYR A 106 -5.798 2.091 3.899 1.00 54.34 C ATOM 1516 C TYR A 106 -4.303 1.878 3.687 1.00 63.35 C ATOM 1517 O TYR A 106 -3.484 2.708 4.080 1.00 42.44 O ATOM 1518 CB TYR A 106 -6.235 1.448 5.216 1.00 1.30 C ATOM 1519 CG TYR A 106 -6.701 2.446 6.252 1.00 50.32 C ATOM 1520 CD1 TYR A 106 -5.839 3.416 6.749 1.00 63.32 C ATOM 1521 CD2 TYR A 106 -8.004 2.420 6.733 1.00 55.44 C ATOM 1522 CE1 TYR A 106 -6.260 4.329 7.696 1.00 72.13 C ATOM 1523 CE2 TYR A 106 -8.435 3.331 7.678 1.00 32.34 C ATOM 1524 CZ TYR A 106 -7.559 4.283 8.157 1.00 32.52 C ATOM 1525 OH TYR A 106 -7.983 5.191 9.099 1.00 14.43 O ATOM 0 H TYR A 106 -7.239 0.822 3.056 1.00 44.32 H new ATOM 0 HA TYR A 106 -5.990 3.163 3.944 1.00 54.34 H new ATOM 0 HB2 TYR A 106 -7.041 0.742 5.016 1.00 1.30 H new ATOM 0 HB3 TYR A 106 -5.403 0.875 5.624 1.00 1.30 H new ATOM 0 HD1 TYR A 106 -4.822 3.457 6.388 1.00 63.32 H new ATOM 0 HD2 TYR A 106 -8.692 1.675 6.362 1.00 55.44 H new ATOM 0 HE1 TYR A 106 -5.576 5.075 8.073 1.00 72.13 H new ATOM 0 HE2 TYR A 106 -9.452 3.298 8.040 1.00 32.34 H new ATOM 0 HH TYR A 106 -8.836 4.894 9.479 1.00 14.43 H new ATOM 1535 N SER A 107 -3.954 0.758 3.061 1.00 34.33 N ATOM 1536 CA SER A 107 -2.558 0.432 2.799 1.00 65.43 C ATOM 1537 C SER A 107 -2.038 1.202 1.589 1.00 40.22 C ATOM 1538 O SER A 107 -0.846 1.495 1.490 1.00 14.14 O ATOM 1539 CB SER A 107 -2.398 -1.072 2.567 1.00 62.21 C ATOM 1540 OG SER A 107 -2.718 -1.419 1.231 1.00 61.03 O ATOM 0 H SER A 107 -4.620 0.061 2.726 1.00 34.33 H new ATOM 0 HA SER A 107 -1.973 0.722 3.672 1.00 65.43 H new ATOM 0 HB2 SER A 107 -1.373 -1.370 2.788 1.00 62.21 H new ATOM 0 HB3 SER A 107 -3.044 -1.620 3.253 1.00 62.21 H new ATOM 0 HG SER A 107 -3.684 -1.332 1.093 1.00 61.03 H new ATOM 1546 N SER A 108 -2.941 1.527 0.670 1.00 54.43 N ATOM 1547 CA SER A 108 -2.575 2.261 -0.536 1.00 71.34 C ATOM 1548 C SER A 108 -2.155 3.688 -0.198 1.00 21.30 C ATOM 1549 O SER A 108 -1.393 4.313 -0.935 1.00 4.43 O ATOM 1550 CB SER A 108 -3.746 2.282 -1.521 1.00 63.43 C ATOM 1551 OG SER A 108 -3.376 1.710 -2.764 1.00 55.34 O ATOM 0 H SER A 108 -3.932 1.294 0.737 1.00 54.43 H new ATOM 0 HA SER A 108 -1.729 1.752 -0.998 1.00 71.34 H new ATOM 0 HB2 SER A 108 -4.589 1.733 -1.101 1.00 63.43 H new ATOM 0 HB3 SER A 108 -4.079 3.309 -1.674 1.00 63.43 H new ATOM 0 HG SER A 108 -4.141 1.733 -3.376 1.00 55.34 H new ATOM 1557 N SER A 109 -2.658 4.196 0.922 1.00 12.23 N ATOM 1558 CA SER A 109 -2.339 5.551 1.358 1.00 60.22 C ATOM 1559 C SER A 109 -1.485 5.528 2.622 1.00 72.10 C ATOM 1560 O SER A 109 -1.371 6.532 3.325 1.00 23.01 O ATOM 1561 CB SER A 109 -3.623 6.344 1.610 1.00 23.10 C ATOM 1562 OG SER A 109 -3.998 6.287 2.975 1.00 25.34 O ATOM 0 H SER A 109 -3.288 3.690 1.544 1.00 12.23 H new ATOM 0 HA SER A 109 -1.770 6.037 0.565 1.00 60.22 H new ATOM 0 HB2 SER A 109 -3.477 7.382 1.313 1.00 23.10 H new ATOM 0 HB3 SER A 109 -4.427 5.946 0.992 1.00 23.10 H new ATOM 0 HG SER A 109 -4.820 6.803 3.110 1.00 25.34 H new ATOM 1568 N ARG A 110 -0.888 4.375 2.904 1.00 22.31 N ATOM 1569 CA ARG A 110 -0.045 4.219 4.084 1.00 53.42 C ATOM 1570 C ARG A 110 1.212 5.076 3.970 1.00 2.24 C ATOM 1571 O ARG A 110 1.610 5.742 4.926 1.00 11.34 O ATOM 1572 CB ARG A 110 0.340 2.751 4.271 1.00 25.13 C ATOM 1573 CG ARG A 110 1.372 2.259 3.269 1.00 52.31 C ATOM 1574 CD ARG A 110 1.572 0.755 3.368 1.00 41.11 C ATOM 1575 NE ARG A 110 1.451 0.100 2.068 1.00 11.13 N ATOM 1576 CZ ARG A 110 1.305 -1.212 1.917 1.00 10.42 C ATOM 1577 NH1 ARG A 110 1.262 -2.004 2.979 1.00 12.14 N ATOM 1578 NH2 ARG A 110 1.201 -1.733 0.701 1.00 23.14 N ATOM 0 H ARG A 110 -0.972 3.535 2.332 1.00 22.31 H new ATOM 0 HA ARG A 110 -0.613 4.551 4.953 1.00 53.42 H new ATOM 0 HB2 ARG A 110 0.730 2.612 5.279 1.00 25.13 H new ATOM 0 HB3 ARG A 110 -0.556 2.136 4.188 1.00 25.13 H new ATOM 0 HG2 ARG A 110 1.053 2.519 2.260 1.00 52.31 H new ATOM 0 HG3 ARG A 110 2.321 2.766 3.444 1.00 52.31 H new ATOM 0 HD2 ARG A 110 2.556 0.547 3.789 1.00 41.11 H new ATOM 0 HD3 ARG A 110 0.837 0.336 4.055 1.00 41.11 H new ATOM 0 HE ARG A 110 1.480 0.681 1.230 1.00 11.13 H new ATOM 0 HH11 ARG A 110 1.341 -1.607 3.915 1.00 12.14 H new ATOM 0 HH12 ARG A 110 1.150 -3.011 2.860 1.00 12.14 H new ATOM 0 HH21 ARG A 110 1.233 -1.126 -0.118 1.00 23.14 H new ATOM 0 HH22 ARG A 110 1.089 -2.740 0.586 1.00 23.14 H new ATOM 1592 N ASP A 111 1.833 5.053 2.796 1.00 4.44 N ATOM 1593 CA ASP A 111 3.045 5.828 2.558 1.00 45.35 C ATOM 1594 C ASP A 111 2.751 7.325 2.600 1.00 61.52 C ATOM 1595 O ASP A 111 3.590 8.121 3.020 1.00 63.44 O ATOM 1596 CB ASP A 111 3.658 5.454 1.207 1.00 55.33 C ATOM 1597 CG ASP A 111 5.123 5.831 1.111 1.00 52.54 C ATOM 1598 OD1 ASP A 111 5.840 5.684 2.122 1.00 65.14 O ATOM 1599 OD2 ASP A 111 5.552 6.275 0.025 1.00 54.24 O ATOM 0 H ASP A 111 1.517 4.506 1.995 1.00 4.44 H new ATOM 0 HA ASP A 111 3.757 5.594 3.349 1.00 45.35 H new ATOM 0 HB2 ASP A 111 3.551 4.381 1.047 1.00 55.33 H new ATOM 0 HB3 ASP A 111 3.105 5.952 0.410 1.00 55.33 H new ATOM 1604 N ALA A 112 1.554 7.699 2.161 1.00 11.50 N ATOM 1605 CA ALA A 112 1.149 9.100 2.150 1.00 75.54 C ATOM 1606 C ALA A 112 0.706 9.554 3.536 1.00 2.33 C ATOM 1607 O ALA A 112 0.872 10.719 3.901 1.00 10.02 O ATOM 1608 CB ALA A 112 0.032 9.317 1.139 1.00 12.45 C ATOM 0 H ALA A 112 0.848 7.053 1.809 1.00 11.50 H new ATOM 0 HA ALA A 112 2.011 9.700 1.858 1.00 75.54 H new ATOM 0 HB1 ALA A 112 -0.261 10.367 1.141 1.00 12.45 H new ATOM 0 HB2 ALA A 112 0.382 9.040 0.145 1.00 12.45 H new ATOM 0 HB3 ALA A 112 -0.826 8.700 1.407 1.00 12.45 H new ATOM 1614 N LEU A 113 0.142 8.629 4.305 1.00 5.32 N ATOM 1615 CA LEU A 113 -0.325 8.935 5.653 1.00 42.52 C ATOM 1616 C LEU A 113 0.816 8.834 6.661 1.00 54.43 C ATOM 1617 O LEU A 113 0.759 9.425 7.739 1.00 3.32 O ATOM 1618 CB LEU A 113 -1.457 7.986 6.049 1.00 3.04 C ATOM 1619 CG LEU A 113 -2.871 8.439 5.685 1.00 31.32 C ATOM 1620 CD1 LEU A 113 -3.875 7.332 5.969 1.00 53.50 C ATOM 1621 CD2 LEU A 113 -3.239 9.704 6.447 1.00 61.31 C ATOM 0 H LEU A 113 -0.003 7.661 4.018 1.00 5.32 H new ATOM 0 HA LEU A 113 -0.699 9.959 5.658 1.00 42.52 H new ATOM 0 HB2 LEU A 113 -1.275 7.019 5.580 1.00 3.04 H new ATOM 0 HB3 LEU A 113 -1.413 7.830 7.127 1.00 3.04 H new ATOM 0 HG LEU A 113 -2.898 8.661 4.618 1.00 31.32 H new ATOM 0 HD11 LEU A 113 -4.876 7.672 5.704 1.00 53.50 H new ATOM 0 HD12 LEU A 113 -3.623 6.451 5.378 1.00 53.50 H new ATOM 0 HD13 LEU A 113 -3.847 7.078 7.029 1.00 53.50 H new ATOM 0 HD21 LEU A 113 -4.249 10.012 6.175 1.00 61.31 H new ATOM 0 HD22 LEU A 113 -3.195 9.509 7.519 1.00 61.31 H new ATOM 0 HD23 LEU A 113 -2.537 10.499 6.194 1.00 61.31 H new ATOM 1633 N VAL A 114 1.852 8.083 6.301 1.00 14.10 N ATOM 1634 CA VAL A 114 3.007 7.907 7.172 1.00 5.22 C ATOM 1635 C VAL A 114 3.542 9.251 7.654 1.00 41.21 C ATOM 1636 O VAL A 114 3.669 9.503 8.852 1.00 5.33 O ATOM 1637 CB VAL A 114 4.138 7.144 6.457 1.00 21.22 C ATOM 1638 CG1 VAL A 114 5.495 7.578 6.989 1.00 4.21 C ATOM 1639 CG2 VAL A 114 3.950 5.643 6.616 1.00 72.44 C ATOM 0 H VAL A 114 1.915 7.587 5.412 1.00 14.10 H new ATOM 0 HA VAL A 114 2.671 7.324 8.029 1.00 5.22 H new ATOM 0 HB VAL A 114 4.098 7.382 5.394 1.00 21.22 H new ATOM 0 HG11 VAL A 114 6.281 7.028 6.472 1.00 4.21 H new ATOM 0 HG12 VAL A 114 5.628 8.647 6.819 1.00 4.21 H new ATOM 0 HG13 VAL A 114 5.550 7.371 8.058 1.00 4.21 H new ATOM 0 HG21 VAL A 114 4.758 5.119 6.105 1.00 72.44 H new ATOM 0 HG22 VAL A 114 3.963 5.385 7.675 1.00 72.44 H new ATOM 0 HG23 VAL A 114 2.995 5.348 6.182 1.00 72.44 H new ATOM 1649 N PRO A 115 3.863 10.137 6.699 1.00 12.01 N ATOM 1650 CA PRO A 115 4.388 11.472 7.002 1.00 62.33 C ATOM 1651 C PRO A 115 3.336 12.380 7.629 1.00 43.35 C ATOM 1652 O PRO A 115 3.647 13.208 8.486 1.00 44.21 O ATOM 1653 CB PRO A 115 4.809 12.007 5.631 1.00 75.35 C ATOM 1654 CG PRO A 115 3.955 11.269 4.658 1.00 33.30 C ATOM 1655 CD PRO A 115 3.737 9.904 5.251 1.00 53.04 C ATOM 0 HA PRO A 115 5.200 11.436 7.728 1.00 62.33 H new ATOM 0 HB2 PRO A 115 4.651 13.083 5.560 1.00 75.35 H new ATOM 0 HB3 PRO A 115 5.868 11.828 5.444 1.00 75.35 H new ATOM 0 HG2 PRO A 115 3.006 11.783 4.503 1.00 33.30 H new ATOM 0 HG3 PRO A 115 4.442 11.199 3.686 1.00 33.30 H new ATOM 0 HD2 PRO A 115 2.756 9.505 4.992 1.00 53.04 H new ATOM 0 HD3 PRO A 115 4.477 9.188 4.893 1.00 53.04 H new ATOM 1663 N LEU A 116 2.090 12.221 7.196 1.00 23.23 N ATOM 1664 CA LEU A 116 0.991 13.027 7.716 1.00 41.10 C ATOM 1665 C LEU A 116 0.734 12.714 9.187 1.00 41.24 C ATOM 1666 O LEU A 116 0.333 13.587 9.958 1.00 63.41 O ATOM 1667 CB LEU A 116 -0.279 12.779 6.901 1.00 51.25 C ATOM 1668 CG LEU A 116 -0.575 13.793 5.794 1.00 31.25 C ATOM 1669 CD1 LEU A 116 -0.919 15.149 6.391 1.00 35.41 C ATOM 1670 CD2 LEU A 116 0.610 13.910 4.848 1.00 43.34 C ATOM 0 H LEU A 116 1.816 11.542 6.486 1.00 23.23 H new ATOM 0 HA LEU A 116 1.271 14.077 7.631 1.00 41.10 H new ATOM 0 HB2 LEU A 116 -0.210 11.789 6.450 1.00 51.25 H new ATOM 0 HB3 LEU A 116 -1.128 12.760 7.585 1.00 51.25 H new ATOM 0 HG LEU A 116 -1.435 13.441 5.225 1.00 31.25 H new ATOM 0 HD11 LEU A 116 -1.127 15.858 5.589 1.00 35.41 H new ATOM 0 HD12 LEU A 116 -1.799 15.054 7.028 1.00 35.41 H new ATOM 0 HD13 LEU A 116 -0.079 15.509 6.985 1.00 35.41 H new ATOM 0 HD21 LEU A 116 0.382 14.635 4.067 1.00 43.34 H new ATOM 0 HD22 LEU A 116 1.488 14.239 5.404 1.00 43.34 H new ATOM 0 HD23 LEU A 116 0.811 12.939 4.394 1.00 43.34 H new ATOM 1682 N THR A 117 0.969 11.463 9.570 1.00 4.11 N ATOM 1683 CA THR A 117 0.765 11.035 10.948 1.00 33.11 C ATOM 1684 C THR A 117 2.095 10.826 11.662 1.00 20.03 C ATOM 1685 O THR A 117 2.294 9.818 12.340 1.00 13.21 O ATOM 1686 CB THR A 117 -0.052 9.730 11.015 1.00 4.35 C ATOM 1687 OG1 THR A 117 0.623 8.692 10.296 1.00 41.52 O ATOM 1688 CG2 THR A 117 -1.444 9.933 10.437 1.00 30.22 C ATOM 0 H THR A 117 1.301 10.728 8.945 1.00 4.11 H new ATOM 0 HA THR A 117 0.210 11.829 11.447 1.00 33.11 H new ATOM 0 HB THR A 117 -0.150 9.441 12.062 1.00 4.35 H new ATOM 0 HG1 THR A 117 0.492 8.822 9.334 1.00 41.52 H new ATOM 0 HG21 THR A 117 -2.002 8.998 10.495 1.00 30.22 H new ATOM 0 HG22 THR A 117 -1.965 10.703 11.006 1.00 30.22 H new ATOM 0 HG23 THR A 117 -1.364 10.243 9.395 1.00 30.22 H new ATOM 1696 N GLN A 118 3.002 11.785 11.506 1.00 22.32 N ATOM 1697 CA GLN A 118 4.314 11.704 12.137 1.00 2.43 C ATOM 1698 C GLN A 118 4.266 12.241 13.564 1.00 51.51 C ATOM 1699 O GLN A 118 3.887 13.389 13.793 1.00 0.23 O ATOM 1700 CB GLN A 118 5.345 12.485 11.320 1.00 1.23 C ATOM 1701 CG GLN A 118 6.446 11.614 10.738 1.00 62.11 C ATOM 1702 CD GLN A 118 7.751 12.365 10.557 1.00 14.01 C ATOM 1703 OE1 GLN A 118 8.604 12.372 11.444 1.00 4.24 O ATOM 1704 NE2 GLN A 118 7.912 13.003 9.404 1.00 71.45 N ATOM 0 H GLN A 118 2.853 12.626 10.949 1.00 22.32 H new ATOM 0 HA GLN A 118 4.608 10.655 12.173 1.00 2.43 H new ATOM 0 HB2 GLN A 118 4.835 13.003 10.508 1.00 1.23 H new ATOM 0 HB3 GLN A 118 5.795 13.250 11.953 1.00 1.23 H new ATOM 0 HG2 GLN A 118 6.611 10.759 11.393 1.00 62.11 H new ATOM 0 HG3 GLN A 118 6.121 11.220 9.775 1.00 62.11 H new ATOM 0 HE21 GLN A 118 7.178 12.970 8.696 1.00 71.45 H new ATOM 0 HE22 GLN A 118 8.769 13.526 9.226 1.00 71.45 H new ATOM 1713 N GLY A 119 4.652 11.403 14.520 1.00 23.45 N ATOM 1714 CA GLY A 119 4.645 11.811 15.913 1.00 51.21 C ATOM 1715 C GLY A 119 3.406 11.340 16.649 1.00 44.01 C ATOM 1716 O GLY A 119 3.498 10.806 17.755 1.00 52.15 O ATOM 0 H GLY A 119 4.970 10.448 14.355 1.00 23.45 H new ATOM 0 HA2 GLY A 119 5.531 11.415 16.409 1.00 51.21 H new ATOM 0 HA3 GLY A 119 4.707 12.898 15.970 1.00 51.21 H new ATOM 1720 N PHE A 120 2.244 11.539 16.036 1.00 62.11 N ATOM 1721 CA PHE A 120 0.981 11.133 16.641 1.00 22.23 C ATOM 1722 C PHE A 120 0.843 9.613 16.644 1.00 2.21 C ATOM 1723 O PHE A 120 1.091 8.956 15.634 1.00 72.14 O ATOM 1724 CB PHE A 120 -0.194 11.762 15.890 1.00 32.41 C ATOM 1725 CG PHE A 120 0.001 13.219 15.584 1.00 72.02 C ATOM 1726 CD1 PHE A 120 0.489 14.084 16.549 1.00 3.25 C ATOM 1727 CD2 PHE A 120 -0.305 13.724 14.330 1.00 20.12 C ATOM 1728 CE1 PHE A 120 0.670 15.426 16.271 1.00 63.12 C ATOM 1729 CE2 PHE A 120 -0.126 15.064 14.046 1.00 43.43 C ATOM 1730 CZ PHE A 120 0.361 15.917 15.017 1.00 23.35 C ATOM 0 H PHE A 120 2.151 11.979 15.121 1.00 62.11 H new ATOM 0 HA PHE A 120 0.972 11.483 17.673 1.00 22.23 H new ATOM 0 HB2 PHE A 120 -0.350 11.221 14.957 1.00 32.41 H new ATOM 0 HB3 PHE A 120 -1.100 11.642 16.483 1.00 32.41 H new ATOM 0 HD1 PHE A 120 0.731 13.705 17.531 1.00 3.25 H new ATOM 0 HD2 PHE A 120 -0.688 13.063 13.567 1.00 20.12 H new ATOM 0 HE1 PHE A 120 1.052 16.089 17.033 1.00 63.12 H new ATOM 0 HE2 PHE A 120 -0.367 15.445 13.064 1.00 43.43 H new ATOM 0 HZ PHE A 120 0.500 16.965 14.797 1.00 23.35 H new ATOM 1740 N GLN A 121 0.447 9.063 17.787 1.00 0.13 N ATOM 1741 CA GLN A 121 0.277 7.621 17.922 1.00 4.23 C ATOM 1742 C GLN A 121 -0.851 7.120 17.028 1.00 74.23 C ATOM 1743 O GLN A 121 -2.013 7.094 17.432 1.00 22.34 O ATOM 1744 CB GLN A 121 -0.009 7.254 19.379 1.00 15.44 C ATOM 1745 CG GLN A 121 1.240 7.155 20.239 1.00 3.42 C ATOM 1746 CD GLN A 121 2.151 8.357 20.086 1.00 41.55 C ATOM 1747 OE1 GLN A 121 3.047 8.368 19.241 1.00 24.23 O ATOM 1748 NE2 GLN A 121 1.926 9.380 20.903 1.00 71.51 N ATOM 0 H GLN A 121 0.238 9.594 18.633 1.00 0.13 H new ATOM 0 HA GLN A 121 1.204 7.140 17.609 1.00 4.23 H new ATOM 0 HB2 GLN A 121 -0.677 8.001 19.808 1.00 15.44 H new ATOM 0 HB3 GLN A 121 -0.536 6.300 19.408 1.00 15.44 H new ATOM 0 HG2 GLN A 121 0.949 7.055 21.285 1.00 3.42 H new ATOM 0 HG3 GLN A 121 1.789 6.252 19.973 1.00 3.42 H new ATOM 0 HE21 GLN A 121 1.173 9.329 21.589 1.00 71.51 H new ATOM 0 HE22 GLN A 121 2.507 10.217 20.845 1.00 71.51 H new ATOM 1757 N GLY A 122 -0.501 6.722 15.808 1.00 54.41 N ATOM 1758 CA GLY A 122 -1.497 6.228 14.875 1.00 63.41 C ATOM 1759 C GLY A 122 -1.616 4.717 14.902 1.00 72.22 C ATOM 1760 O GLY A 122 -0.677 4.007 14.542 1.00 25.22 O ATOM 0 H GLY A 122 0.454 6.733 15.450 1.00 54.41 H new ATOM 0 HA2 GLY A 122 -2.464 6.670 15.113 1.00 63.41 H new ATOM 0 HA3 GLY A 122 -1.238 6.551 13.867 1.00 63.41 H new ATOM 1764 N ILE A 123 -2.773 4.224 15.330 1.00 33.04 N ATOM 1765 CA ILE A 123 -3.011 2.788 15.403 1.00 33.23 C ATOM 1766 C ILE A 123 -4.344 2.418 14.760 1.00 24.03 C ATOM 1767 O ILE A 123 -5.344 3.111 14.941 1.00 51.31 O ATOM 1768 CB ILE A 123 -3.001 2.289 16.860 1.00 32.23 C ATOM 1769 CG1 ILE A 123 -1.759 2.804 17.590 1.00 20.32 C ATOM 1770 CG2 ILE A 123 -3.054 0.769 16.900 1.00 65.21 C ATOM 1771 CD1 ILE A 123 -1.973 4.129 18.287 1.00 55.22 C ATOM 0 H ILE A 123 -3.560 4.798 15.632 1.00 33.04 H new ATOM 0 HA ILE A 123 -2.200 2.306 14.857 1.00 33.23 H new ATOM 0 HB ILE A 123 -3.884 2.677 17.367 1.00 32.23 H new ATOM 0 HG12 ILE A 123 -1.446 2.062 18.325 1.00 20.32 H new ATOM 0 HG13 ILE A 123 -0.943 2.907 16.874 1.00 20.32 H new ATOM 0 HG21 ILE A 123 -3.046 0.432 17.937 1.00 65.21 H new ATOM 0 HG22 ILE A 123 -3.966 0.424 16.413 1.00 65.21 H new ATOM 0 HG23 ILE A 123 -2.188 0.361 16.379 1.00 65.21 H new ATOM 0 HD11 ILE A 123 -1.051 4.432 18.783 1.00 55.22 H new ATOM 0 HD12 ILE A 123 -2.256 4.884 17.554 1.00 55.22 H new ATOM 0 HD13 ILE A 123 -2.766 4.027 19.027 1.00 55.22 H new ATOM 1783 N GLN A 124 -4.348 1.320 14.011 1.00 13.20 N ATOM 1784 CA GLN A 124 -5.559 0.858 13.342 1.00 25.41 C ATOM 1785 C GLN A 124 -6.213 -0.276 14.124 1.00 34.13 C ATOM 1786 O GLN A 124 -5.630 -1.347 14.289 1.00 74.33 O ATOM 1787 CB GLN A 124 -5.235 0.393 11.921 1.00 32.52 C ATOM 1788 CG GLN A 124 -6.394 -0.309 11.232 1.00 15.10 C ATOM 1789 CD GLN A 124 -6.394 -1.806 11.468 1.00 61.40 C ATOM 1790 OE1 GLN A 124 -7.261 -2.337 12.163 1.00 63.41 O ATOM 1791 NE2 GLN A 124 -5.419 -2.497 10.889 1.00 45.20 N ATOM 0 H GLN A 124 -3.528 0.735 13.852 1.00 13.20 H new ATOM 0 HA GLN A 124 -6.259 1.692 13.293 1.00 25.41 H new ATOM 0 HB2 GLN A 124 -4.937 1.255 11.325 1.00 32.52 H new ATOM 0 HB3 GLN A 124 -4.380 -0.282 11.955 1.00 32.52 H new ATOM 0 HG2 GLN A 124 -7.333 0.111 11.591 1.00 15.10 H new ATOM 0 HG3 GLN A 124 -6.346 -0.114 10.161 1.00 15.10 H new ATOM 0 HE21 GLN A 124 -4.721 -2.017 10.321 1.00 45.20 H new ATOM 0 HE22 GLN A 124 -5.368 -3.508 11.012 1.00 45.20 H new ATOM 1800 N ALA A 125 -7.428 -0.032 14.605 1.00 72.32 N ATOM 1801 CA ALA A 125 -8.163 -1.033 15.368 1.00 22.32 C ATOM 1802 C ALA A 125 -9.666 -0.899 15.147 1.00 44.05 C ATOM 1803 O ALA A 125 -10.225 0.190 15.267 1.00 72.10 O ATOM 1804 CB ALA A 125 -7.833 -0.915 16.849 1.00 51.52 C ATOM 0 H ALA A 125 -7.924 0.850 14.480 1.00 72.32 H new ATOM 0 HA ALA A 125 -7.857 -2.018 15.016 1.00 22.32 H new ATOM 0 HB1 ALA A 125 -8.389 -1.669 17.407 1.00 51.52 H new ATOM 0 HB2 ALA A 125 -6.764 -1.069 16.997 1.00 51.52 H new ATOM 0 HB3 ALA A 125 -8.109 0.077 17.205 1.00 51.52 H new ATOM 1810 N ASN A 126 -10.313 -2.013 14.821 1.00 20.22 N ATOM 1811 CA ASN A 126 -11.752 -2.019 14.581 1.00 5.03 C ATOM 1812 C ASN A 126 -12.508 -2.480 15.823 1.00 13.33 C ATOM 1813 O ASN A 126 -11.937 -3.112 16.712 1.00 71.11 O ATOM 1814 CB ASN A 126 -12.089 -2.929 13.398 1.00 4.22 C ATOM 1815 CG ASN A 126 -12.184 -4.388 13.800 1.00 52.01 C ATOM 1816 OD1 ASN A 126 -11.170 -5.065 13.967 1.00 23.02 O ATOM 1817 ND2 ASN A 126 -13.408 -4.879 13.956 1.00 21.44 N ATOM 0 H ASN A 126 -9.864 -2.923 14.717 1.00 20.22 H new ATOM 0 HA ASN A 126 -12.061 -1.000 14.346 1.00 5.03 H new ATOM 0 HB2 ASN A 126 -13.035 -2.614 12.959 1.00 4.22 H new ATOM 0 HB3 ASN A 126 -11.326 -2.816 12.627 1.00 4.22 H new ATOM 0 HD21 ASN A 126 -13.536 -5.855 14.225 1.00 21.44 H new ATOM 0 HD22 ASN A 126 -14.220 -4.281 13.807 1.00 21.44 H new ATOM 1824 N ASP A 127 -13.796 -2.159 15.877 1.00 13.14 N ATOM 1825 CA ASP A 127 -14.633 -2.541 17.009 1.00 4.03 C ATOM 1826 C ASP A 127 -14.150 -1.871 18.292 1.00 20.21 C ATOM 1827 O ASP A 127 -13.387 -0.907 18.251 1.00 4.11 O ATOM 1828 CB ASP A 127 -14.632 -4.061 17.181 1.00 2.33 C ATOM 1829 CG ASP A 127 -16.013 -4.611 17.476 1.00 55.23 C ATOM 1830 OD1 ASP A 127 -16.979 -4.172 16.817 1.00 11.42 O ATOM 1831 OD2 ASP A 127 -16.129 -5.480 18.365 1.00 13.13 O ATOM 0 H ASP A 127 -14.283 -1.635 15.150 1.00 13.14 H new ATOM 0 HA ASP A 127 -15.651 -2.207 16.807 1.00 4.03 H new ATOM 0 HB2 ASP A 127 -14.245 -4.526 16.274 1.00 2.33 H new ATOM 0 HB3 ASP A 127 -13.956 -4.332 17.992 1.00 2.33 H new ATOM 1836 N ALA A 128 -14.602 -2.389 19.430 1.00 45.32 N ATOM 1837 CA ALA A 128 -14.215 -1.842 20.724 1.00 12.54 C ATOM 1838 C ALA A 128 -12.698 -1.744 20.849 1.00 74.33 C ATOM 1839 O ALA A 128 -12.179 -0.914 21.594 1.00 12.50 O ATOM 1840 CB ALA A 128 -14.785 -2.693 21.849 1.00 73.31 C ATOM 0 H ALA A 128 -15.236 -3.186 19.481 1.00 45.32 H new ATOM 0 HA ALA A 128 -14.625 -0.835 20.801 1.00 12.54 H new ATOM 0 HB1 ALA A 128 -14.488 -2.273 22.810 1.00 73.31 H new ATOM 0 HB2 ALA A 128 -15.873 -2.707 21.780 1.00 73.31 H new ATOM 0 HB3 ALA A 128 -14.403 -3.711 21.765 1.00 73.31 H new ATOM 1846 N SER A 129 -11.993 -2.599 20.115 1.00 51.24 N ATOM 1847 CA SER A 129 -10.535 -2.612 20.146 1.00 13.14 C ATOM 1848 C SER A 129 -9.970 -1.263 19.711 1.00 33.31 C ATOM 1849 O SER A 129 -8.843 -0.910 20.054 1.00 63.13 O ATOM 1850 CB SER A 129 -9.994 -3.720 19.241 1.00 33.44 C ATOM 1851 OG SER A 129 -9.152 -4.602 19.963 1.00 20.41 O ATOM 0 H SER A 129 -12.408 -3.292 19.492 1.00 51.24 H new ATOM 0 HA SER A 129 -10.220 -2.805 21.172 1.00 13.14 H new ATOM 0 HB2 SER A 129 -10.824 -4.278 18.808 1.00 33.44 H new ATOM 0 HB3 SER A 129 -9.439 -3.279 18.413 1.00 33.44 H new ATOM 0 HG SER A 129 -8.820 -5.302 19.363 1.00 20.41 H new ATOM 1857 N GLY A 130 -10.764 -0.513 18.952 1.00 21.14 N ATOM 1858 CA GLY A 130 -10.327 0.788 18.482 1.00 42.23 C ATOM 1859 C GLY A 130 -10.543 1.880 19.511 1.00 74.21 C ATOM 1860 O GLY A 130 -9.962 2.961 19.412 1.00 52.34 O ATOM 0 H GLY A 130 -11.701 -0.784 18.655 1.00 21.14 H new ATOM 0 HA2 GLY A 130 -9.269 0.741 18.224 1.00 42.23 H new ATOM 0 HA3 GLY A 130 -10.867 1.041 17.570 1.00 42.23 H new ATOM 1864 N LEU A 131 -11.383 1.599 20.501 1.00 22.43 N ATOM 1865 CA LEU A 131 -11.677 2.566 21.553 1.00 25.21 C ATOM 1866 C LEU A 131 -11.045 2.142 22.875 1.00 23.40 C ATOM 1867 O LEU A 131 -11.521 2.510 23.949 1.00 75.52 O ATOM 1868 CB LEU A 131 -13.189 2.720 21.724 1.00 61.32 C ATOM 1869 CG LEU A 131 -14.017 2.676 20.439 1.00 32.23 C ATOM 1870 CD1 LEU A 131 -15.500 2.787 20.756 1.00 34.25 C ATOM 1871 CD2 LEU A 131 -13.588 3.785 19.490 1.00 54.20 C ATOM 0 H LEU A 131 -11.873 0.709 20.597 1.00 22.43 H new ATOM 0 HA LEU A 131 -11.251 3.525 21.259 1.00 25.21 H new ATOM 0 HB2 LEU A 131 -13.542 1.930 22.387 1.00 61.32 H new ATOM 0 HB3 LEU A 131 -13.383 3.668 22.226 1.00 61.32 H new ATOM 0 HG LEU A 131 -13.842 1.718 19.949 1.00 32.23 H new ATOM 0 HD11 LEU A 131 -16.074 2.754 19.830 1.00 34.25 H new ATOM 0 HD12 LEU A 131 -15.798 1.957 21.397 1.00 34.25 H new ATOM 0 HD13 LEU A 131 -15.693 3.729 21.269 1.00 34.25 H new ATOM 0 HD21 LEU A 131 -14.188 3.738 18.581 1.00 54.20 H new ATOM 0 HD22 LEU A 131 -13.733 4.752 19.971 1.00 54.20 H new ATOM 0 HD23 LEU A 131 -12.535 3.660 19.237 1.00 54.20 H new ATOM 1883 N ASP A 132 -9.968 1.368 22.789 1.00 75.33 N ATOM 1884 CA ASP A 132 -9.269 0.896 23.978 1.00 64.10 C ATOM 1885 C ASP A 132 -8.520 2.039 24.657 1.00 61.50 C ATOM 1886 O ASP A 132 -7.443 2.439 24.214 1.00 71.10 O ATOM 1887 CB ASP A 132 -8.293 -0.223 23.611 1.00 24.12 C ATOM 1888 CG ASP A 132 -8.995 -1.442 23.046 1.00 32.14 C ATOM 1889 OD1 ASP A 132 -10.225 -1.557 23.232 1.00 44.31 O ATOM 1890 OD2 ASP A 132 -8.315 -2.282 22.420 1.00 54.13 O ATOM 0 H ASP A 132 -9.561 1.055 21.908 1.00 75.33 H new ATOM 0 HA ASP A 132 -10.011 0.506 24.675 1.00 64.10 H new ATOM 0 HB2 ASP A 132 -7.575 0.150 22.881 1.00 24.12 H new ATOM 0 HB3 ASP A 132 -7.726 -0.512 24.496 1.00 24.12 H new ATOM 1895 N PHE A 133 -9.098 2.560 25.734 1.00 44.30 N ATOM 1896 CA PHE A 133 -8.486 3.659 26.473 1.00 31.52 C ATOM 1897 C PHE A 133 -7.077 3.290 26.928 1.00 30.01 C ATOM 1898 O PHE A 133 -6.135 4.062 26.751 1.00 73.21 O ATOM 1899 CB PHE A 133 -9.345 4.027 27.685 1.00 73.34 C ATOM 1900 CG PHE A 133 -10.726 4.494 27.321 1.00 63.32 C ATOM 1901 CD1 PHE A 133 -10.905 5.572 26.469 1.00 64.43 C ATOM 1902 CD2 PHE A 133 -11.844 3.854 27.830 1.00 14.43 C ATOM 1903 CE1 PHE A 133 -12.174 6.004 26.133 1.00 22.40 C ATOM 1904 CE2 PHE A 133 -13.116 4.282 27.498 1.00 72.22 C ATOM 1905 CZ PHE A 133 -13.281 5.357 26.647 1.00 1.22 C ATOM 0 H PHE A 133 -9.988 2.240 26.115 1.00 44.30 H new ATOM 0 HA PHE A 133 -8.421 4.520 25.807 1.00 31.52 H new ATOM 0 HB2 PHE A 133 -9.424 3.160 28.341 1.00 73.34 H new ATOM 0 HB3 PHE A 133 -8.843 4.811 28.252 1.00 73.34 H new ATOM 0 HD1 PHE A 133 -10.043 6.080 26.063 1.00 64.43 H new ATOM 0 HD2 PHE A 133 -11.721 3.011 28.494 1.00 14.43 H new ATOM 0 HE1 PHE A 133 -12.300 6.847 25.469 1.00 22.40 H new ATOM 0 HE2 PHE A 133 -13.980 3.776 27.904 1.00 72.22 H new ATOM 0 HZ PHE A 133 -14.274 5.691 26.384 1.00 1.22 H new ATOM 1915 N GLU A 134 -6.942 2.105 27.516 1.00 51.23 N ATOM 1916 CA GLU A 134 -5.649 1.635 27.997 1.00 24.03 C ATOM 1917 C GLU A 134 -4.626 1.602 26.865 1.00 3.34 C ATOM 1918 O GLU A 134 -3.446 1.884 27.073 1.00 11.14 O ATOM 1919 CB GLU A 134 -5.785 0.242 28.616 1.00 14.32 C ATOM 1920 CG GLU A 134 -5.159 0.125 29.996 1.00 54.12 C ATOM 1921 CD GLU A 134 -4.951 -1.315 30.422 1.00 73.35 C ATOM 1922 OE1 GLU A 134 -5.688 -2.193 29.926 1.00 63.41 O ATOM 1923 OE2 GLU A 134 -4.051 -1.564 31.251 1.00 40.13 O ATOM 0 H GLU A 134 -7.712 1.454 27.670 1.00 51.23 H new ATOM 0 HA GLU A 134 -5.300 2.331 28.759 1.00 24.03 H new ATOM 0 HB2 GLU A 134 -6.842 -0.015 28.683 1.00 14.32 H new ATOM 0 HB3 GLU A 134 -5.321 -0.488 27.953 1.00 14.32 H new ATOM 0 HG2 GLU A 134 -4.200 0.644 30.001 1.00 54.12 H new ATOM 0 HG3 GLU A 134 -5.797 0.627 30.724 1.00 54.12 H new ATOM 1930 N GLU A 135 -5.088 1.256 25.668 1.00 24.40 N ATOM 1931 CA GLU A 135 -4.213 1.185 24.504 1.00 64.43 C ATOM 1932 C GLU A 135 -3.716 2.573 24.111 1.00 23.01 C ATOM 1933 O GLU A 135 -2.537 2.758 23.805 1.00 55.21 O ATOM 1934 CB GLU A 135 -4.946 0.541 23.325 1.00 13.31 C ATOM 1935 CG GLU A 135 -4.031 0.160 22.173 1.00 15.53 C ATOM 1936 CD GLU A 135 -4.740 -0.658 21.111 1.00 12.52 C ATOM 1937 OE1 GLU A 135 -5.982 -0.772 21.180 1.00 23.21 O ATOM 1938 OE2 GLU A 135 -4.052 -1.183 20.211 1.00 54.13 O ATOM 0 H GLU A 135 -6.062 1.021 25.479 1.00 24.40 H new ATOM 0 HA GLU A 135 -3.352 0.571 24.766 1.00 64.43 H new ATOM 0 HB2 GLU A 135 -5.466 -0.351 23.675 1.00 13.31 H new ATOM 0 HB3 GLU A 135 -5.707 1.231 22.960 1.00 13.31 H new ATOM 0 HG2 GLU A 135 -3.627 1.065 21.720 1.00 15.53 H new ATOM 0 HG3 GLU A 135 -3.184 -0.408 22.559 1.00 15.53 H new ATOM 1945 N ILE A 136 -4.622 3.544 24.122 1.00 13.30 N ATOM 1946 CA ILE A 136 -4.277 4.915 23.768 1.00 45.32 C ATOM 1947 C ILE A 136 -3.261 5.496 24.746 1.00 12.40 C ATOM 1948 O ILE A 136 -2.265 6.094 24.340 1.00 1.52 O ATOM 1949 CB ILE A 136 -5.522 5.821 23.740 1.00 71.31 C ATOM 1950 CG1 ILE A 136 -6.543 5.289 22.732 1.00 52.41 C ATOM 1951 CG2 ILE A 136 -5.130 7.251 23.401 1.00 63.11 C ATOM 1952 CD1 ILE A 136 -6.045 5.303 21.304 1.00 74.35 C ATOM 0 H ILE A 136 -5.601 3.407 24.372 1.00 13.30 H new ATOM 0 HA ILE A 136 -3.840 4.882 22.770 1.00 45.32 H new ATOM 0 HB ILE A 136 -5.979 5.816 24.729 1.00 71.31 H new ATOM 0 HG12 ILE A 136 -6.813 4.269 23.004 1.00 52.41 H new ATOM 0 HG13 ILE A 136 -7.452 5.887 22.797 1.00 52.41 H new ATOM 0 HG21 ILE A 136 -6.021 7.879 23.385 1.00 63.11 H new ATOM 0 HG22 ILE A 136 -4.435 7.626 24.153 1.00 63.11 H new ATOM 0 HG23 ILE A 136 -4.652 7.275 22.422 1.00 63.11 H new ATOM 0 HD11 ILE A 136 -6.820 4.913 20.645 1.00 74.35 H new ATOM 0 HD12 ILE A 136 -5.802 6.325 21.013 1.00 74.35 H new ATOM 0 HD13 ILE A 136 -5.153 4.681 21.224 1.00 74.35 H new ATOM 1964 N SER A 137 -3.520 5.315 26.037 1.00 74.40 N ATOM 1965 CA SER A 137 -2.630 5.823 27.074 1.00 31.52 C ATOM 1966 C SER A 137 -1.262 5.153 26.991 1.00 45.51 C ATOM 1967 O SER A 137 -0.230 5.802 27.168 1.00 62.52 O ATOM 1968 CB SER A 137 -3.240 5.591 28.458 1.00 72.11 C ATOM 1969 OG SER A 137 -4.122 4.482 28.447 1.00 31.33 O ATOM 0 H SER A 137 -4.339 4.820 26.390 1.00 74.40 H new ATOM 0 HA SER A 137 -2.502 6.894 26.916 1.00 31.52 H new ATOM 0 HB2 SER A 137 -2.446 5.421 29.185 1.00 72.11 H new ATOM 0 HB3 SER A 137 -3.778 6.484 28.776 1.00 72.11 H new ATOM 0 HG SER A 137 -4.962 4.737 28.011 1.00 31.33 H new ATOM 1975 N ARG A 138 -1.262 3.852 26.720 1.00 5.33 N ATOM 1976 CA ARG A 138 -0.021 3.094 26.615 1.00 62.14 C ATOM 1977 C ARG A 138 0.796 3.553 25.410 1.00 0.13 C ATOM 1978 O ARG A 138 2.026 3.582 25.455 1.00 1.32 O ATOM 1979 CB ARG A 138 -0.321 1.598 26.501 1.00 44.24 C ATOM 1980 CG ARG A 138 0.922 0.723 26.541 1.00 54.21 C ATOM 1981 CD ARG A 138 1.409 0.383 25.141 1.00 1.22 C ATOM 1982 NE ARG A 138 2.078 -0.914 25.095 1.00 74.53 N ATOM 1983 CZ ARG A 138 2.328 -1.572 23.968 1.00 35.41 C ATOM 1984 NH1 ARG A 138 1.967 -1.057 22.801 1.00 13.52 N ATOM 1985 NH2 ARG A 138 2.940 -2.749 24.007 1.00 2.23 N ATOM 0 H ARG A 138 -2.107 3.301 26.569 1.00 5.33 H new ATOM 0 HA ARG A 138 0.563 3.273 27.518 1.00 62.14 H new ATOM 0 HB2 ARG A 138 -0.987 1.307 27.313 1.00 44.24 H new ATOM 0 HB3 ARG A 138 -0.855 1.413 25.569 1.00 44.24 H new ATOM 0 HG2 ARG A 138 1.713 1.237 27.088 1.00 54.21 H new ATOM 0 HG3 ARG A 138 0.704 -0.196 27.085 1.00 54.21 H new ATOM 0 HD2 ARG A 138 0.563 0.379 24.454 1.00 1.22 H new ATOM 0 HD3 ARG A 138 2.095 1.157 24.798 1.00 1.22 H new ATOM 0 HE ARG A 138 2.369 -1.338 25.976 1.00 74.53 H new ATOM 0 HH11 ARG A 138 1.496 -0.153 22.766 1.00 13.52 H new ATOM 0 HH12 ARG A 138 2.160 -1.565 21.938 1.00 13.52 H new ATOM 0 HH21 ARG A 138 3.219 -3.149 24.903 1.00 2.23 H new ATOM 0 HH22 ARG A 138 3.131 -3.253 23.141 1.00 2.23 H new ATOM 1999 N LYS A 139 0.104 3.911 24.334 1.00 32.30 N ATOM 2000 CA LYS A 139 0.763 4.369 23.117 1.00 2.42 C ATOM 2001 C LYS A 139 1.408 5.735 23.329 1.00 12.54 C ATOM 2002 O LYS A 139 2.569 5.946 22.980 1.00 25.15 O ATOM 2003 CB LYS A 139 -0.241 4.441 21.964 1.00 22.14 C ATOM 2004 CG LYS A 139 -0.736 3.081 21.504 1.00 61.22 C ATOM 2005 CD LYS A 139 0.189 2.474 20.462 1.00 52.32 C ATOM 2006 CE LYS A 139 -0.027 0.974 20.331 1.00 4.31 C ATOM 2007 NZ LYS A 139 1.087 0.316 19.594 1.00 44.10 N ATOM 0 H LYS A 139 -0.914 3.893 24.280 1.00 32.30 H new ATOM 0 HA LYS A 139 1.545 3.652 22.865 1.00 2.42 H new ATOM 0 HB2 LYS A 139 -1.095 5.044 22.274 1.00 22.14 H new ATOM 0 HB3 LYS A 139 0.222 4.954 21.121 1.00 22.14 H new ATOM 0 HG2 LYS A 139 -0.810 2.411 22.361 1.00 61.22 H new ATOM 0 HG3 LYS A 139 -1.739 3.179 21.088 1.00 61.22 H new ATOM 0 HD2 LYS A 139 0.017 2.953 19.498 1.00 52.32 H new ATOM 0 HD3 LYS A 139 1.226 2.671 20.735 1.00 52.32 H new ATOM 0 HE2 LYS A 139 -0.117 0.532 21.323 1.00 4.31 H new ATOM 0 HE3 LYS A 139 -0.967 0.786 19.812 1.00 4.31 H new ATOM 0 HZ1 LYS A 139 0.903 -0.705 19.526 1.00 44.10 H new ATOM 0 HZ2 LYS A 139 1.157 0.720 18.638 1.00 44.10 H new ATOM 0 HZ3 LYS A 139 1.980 0.473 20.103 1.00 44.10 H new ATOM 2021 N VAL A 140 0.647 6.661 23.905 1.00 73.01 N ATOM 2022 CA VAL A 140 1.145 8.006 24.166 1.00 13.21 C ATOM 2023 C VAL A 140 2.228 7.992 25.239 1.00 52.51 C ATOM 2024 O VAL A 140 3.211 8.728 25.154 1.00 43.22 O ATOM 2025 CB VAL A 140 0.010 8.948 24.610 1.00 50.53 C ATOM 2026 CG1 VAL A 140 -0.998 9.136 23.486 1.00 13.23 C ATOM 2027 CG2 VAL A 140 -0.668 8.413 25.862 1.00 60.23 C ATOM 0 H VAL A 140 -0.317 6.504 24.200 1.00 73.01 H new ATOM 0 HA VAL A 140 1.568 8.374 23.231 1.00 13.21 H new ATOM 0 HB VAL A 140 0.440 9.921 24.846 1.00 50.53 H new ATOM 0 HG11 VAL A 140 -1.793 9.804 23.818 1.00 13.23 H new ATOM 0 HG12 VAL A 140 -0.499 9.568 22.618 1.00 13.23 H new ATOM 0 HG13 VAL A 140 -1.425 8.171 23.215 1.00 13.23 H new ATOM 0 HG21 VAL A 140 -1.467 9.091 26.161 1.00 60.23 H new ATOM 0 HG22 VAL A 140 -1.086 7.428 25.656 1.00 60.23 H new ATOM 0 HG23 VAL A 140 0.063 8.336 26.667 1.00 60.23 H new ATOM 2037 N LYS A 141 2.041 7.150 26.249 1.00 2.14 N ATOM 2038 CA LYS A 141 3.003 7.038 27.340 1.00 74.31 C ATOM 2039 C LYS A 141 4.231 6.246 26.903 1.00 42.54 C ATOM 2040 O LYS A 141 5.303 6.367 27.497 1.00 54.13 O ATOM 2041 CB LYS A 141 2.354 6.365 28.552 1.00 70.54 C ATOM 2042 CG LYS A 141 2.366 4.847 28.483 1.00 4.25 C ATOM 2043 CD LYS A 141 3.521 4.263 29.280 1.00 70.32 C ATOM 2044 CE LYS A 141 3.025 3.455 30.470 1.00 42.25 C ATOM 2045 NZ LYS A 141 4.042 2.472 30.935 1.00 71.43 N ATOM 0 H LYS A 141 1.232 6.535 26.335 1.00 2.14 H new ATOM 0 HA LYS A 141 3.320 8.044 27.616 1.00 74.31 H new ATOM 0 HB2 LYS A 141 2.874 6.684 29.456 1.00 70.54 H new ATOM 0 HB3 LYS A 141 1.323 6.708 28.639 1.00 70.54 H new ATOM 0 HG2 LYS A 141 1.423 4.457 28.867 1.00 4.25 H new ATOM 0 HG3 LYS A 141 2.443 4.529 27.443 1.00 4.25 H new ATOM 0 HD2 LYS A 141 4.126 3.627 28.634 1.00 70.32 H new ATOM 0 HD3 LYS A 141 4.167 5.068 29.630 1.00 70.32 H new ATOM 0 HE2 LYS A 141 2.772 4.130 31.287 1.00 42.25 H new ATOM 0 HE3 LYS A 141 2.110 2.929 30.196 1.00 42.25 H new ATOM 0 HZ1 LYS A 141 3.666 1.941 31.747 1.00 71.43 H new ATOM 0 HZ2 LYS A 141 4.265 1.812 30.163 1.00 71.43 H new ATOM 0 HZ3 LYS A 141 4.906 2.975 31.220 1.00 71.43 H new ATOM 2059 N SER A 142 4.069 5.438 25.860 1.00 52.31 N ATOM 2060 CA SER A 142 5.165 4.626 25.345 1.00 75.42 C ATOM 2061 C SER A 142 6.271 5.506 24.772 1.00 3.04 C ATOM 2062 O SER A 142 7.455 5.195 24.899 1.00 73.45 O ATOM 2063 CB SER A 142 4.653 3.665 24.269 1.00 4.40 C ATOM 2064 OG SER A 142 5.637 3.445 23.273 1.00 51.42 O ATOM 0 H SER A 142 3.189 5.328 25.355 1.00 52.31 H new ATOM 0 HA SER A 142 5.577 4.048 26.173 1.00 75.42 H new ATOM 0 HB2 SER A 142 4.376 2.716 24.727 1.00 4.40 H new ATOM 0 HB3 SER A 142 3.752 4.073 23.811 1.00 4.40 H new ATOM 0 HG SER A 142 5.287 2.827 22.598 1.00 51.42 H new ATOM 2070 N ASN A 143 5.876 6.608 24.142 1.00 22.43 N ATOM 2071 CA ASN A 143 6.834 7.534 23.549 1.00 12.02 C ATOM 2072 C ASN A 143 7.650 6.848 22.458 1.00 24.13 C ATOM 2073 O ASN A 143 8.805 7.201 22.218 1.00 1.04 O ATOM 2074 CB ASN A 143 7.767 8.093 24.625 1.00 41.51 C ATOM 2075 CG ASN A 143 8.229 9.504 24.313 1.00 33.01 C ATOM 2076 OD1 ASN A 143 8.397 9.871 23.150 1.00 24.02 O ATOM 2077 ND2 ASN A 143 8.436 10.302 25.354 1.00 15.20 N ATOM 0 H ASN A 143 4.900 6.881 24.029 1.00 22.43 H new ATOM 0 HA ASN A 143 6.277 8.355 23.098 1.00 12.02 H new ATOM 0 HB2 ASN A 143 7.254 8.086 25.587 1.00 41.51 H new ATOM 0 HB3 ASN A 143 8.636 7.442 24.723 1.00 41.51 H new ATOM 0 HD21 ASN A 143 8.747 11.262 25.207 1.00 15.20 H new ATOM 0 HD22 ASN A 143 8.284 9.955 26.301 1.00 15.20 H new ATOM 2084 N ARG A 144 7.042 5.866 21.801 1.00 42.24 N ATOM 2085 CA ARG A 144 7.713 5.130 20.736 1.00 53.14 C ATOM 2086 C ARG A 144 6.710 4.657 19.687 1.00 41.41 C ATOM 2087 O ARG A 144 5.676 5.290 19.474 1.00 74.33 O ATOM 2088 CB ARG A 144 8.467 3.931 21.312 1.00 23.13 C ATOM 2089 CG ARG A 144 9.404 3.265 20.318 1.00 71.14 C ATOM 2090 CD ARG A 144 9.449 1.758 20.517 1.00 13.14 C ATOM 2091 NE ARG A 144 9.483 1.038 19.247 1.00 4.32 N ATOM 2092 CZ ARG A 144 9.273 -0.269 19.137 1.00 10.31 C ATOM 2093 NH1 ARG A 144 9.014 -0.995 20.216 1.00 53.14 N ATOM 2094 NH2 ARG A 144 9.321 -0.852 17.946 1.00 2.31 N ATOM 0 H ARG A 144 6.086 5.562 21.987 1.00 42.24 H new ATOM 0 HA ARG A 144 8.425 5.802 20.257 1.00 53.14 H new ATOM 0 HB2 ARG A 144 9.042 4.257 22.178 1.00 23.13 H new ATOM 0 HB3 ARG A 144 7.745 3.195 21.667 1.00 23.13 H new ATOM 0 HG2 ARG A 144 9.078 3.489 19.302 1.00 71.14 H new ATOM 0 HG3 ARG A 144 10.407 3.678 20.429 1.00 71.14 H new ATOM 0 HD2 ARG A 144 10.328 1.496 21.105 1.00 13.14 H new ATOM 0 HD3 ARG A 144 8.577 1.442 21.089 1.00 13.14 H new ATOM 0 HE ARG A 144 9.679 1.568 18.398 1.00 4.32 H new ATOM 0 HH11 ARG A 144 8.976 -0.550 21.133 1.00 53.14 H new ATOM 0 HH12 ARG A 144 8.853 -1.998 20.129 1.00 53.14 H new ATOM 0 HH21 ARG A 144 9.519 -0.296 17.114 1.00 2.31 H new ATOM 0 HH22 ARG A 144 9.160 -1.856 17.863 1.00 2.31 H new