USER MOD reduce.3.24.130724 H: found=0, std=0, add=1213, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1209 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 55 THR OG1 : rot 180:sc= -0.551 USER MOD Set 1.2: A 58 LYS NZ :NH3+ 178:sc= 0.994 (180deg=0.991) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.114 USER MOD Single : A 7 THR OG1 : rot 32:sc= 0.262 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 19:sc= 1.28 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 4:sc= 0.826 USER MOD Single : A 22 SER OG : rot -28:sc= 0.542 USER MOD Single : A 23 SER OG : rot -70:sc= 1.24 USER MOD Single : A 27 GLN : amide:sc= 1.1 K(o=1.1,f=-5.4!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -57:sc= 0.453 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -177:sc= 1.27 (180deg=1.21) USER MOD Single : A 37 THR OG1 : rot 135:sc= 1.24 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 21:sc= 1.23 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0432 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= -0.0736 USER MOD Single : A 66 THR OG1 : rot 86:sc= 1.11 USER MOD Single : A 67 MET CE :methyl -165:sc= 0 (180deg=-0.0151) USER MOD Single : A 68 LYS NZ :NH3+ -142:sc= 1.24 (180deg=0.646) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0034 K(o=-0.0034,f=-0.9) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 170:sc= -0.0298 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.805 X(o=-0.8,f=-0.32) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= -0.0208 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -0.979 K(o=-0.98,f=-1.8) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 137:sc= 0.0295 USER MOD Single : A 122 CYS SG : rot 132:sc= 0.726 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot -50:sc= 0.00272 USER MOD Single : A 127 TYR OH : rot -80:sc= -0.266 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.17) USER MOD Single : A 139 THR OG1 : rot 89:sc= 0.965 USER MOD Single : A 141 GLN : amide:sc= -0.816 K(o=-0.82,f=-2.6!) USER MOD Single : A 142 ASN : amide:sc= 0.332 X(o=0.33,f=0) USER MOD Single : A 144 LYS NZ :NH3+ -176:sc= 0.317 (180deg=0.289) USER MOD Single : A 147 ASN : amide:sc= 1.76 K(o=1.8,f=-8!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 HIS : no HD1:sc= -0.178 X(o=-0.18,f=-0.64) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.832 1.159 11.167 1.00 72.21 N ATOM 2 CA GLY A 1 -28.779 1.111 9.702 1.00 42.02 C ATOM 3 C GLY A 1 -27.382 0.718 9.272 1.00 3.43 C ATOM 4 O GLY A 1 -26.911 -0.341 9.676 1.00 62.23 O ATOM 0 H1 GLY A 1 -29.789 1.429 11.471 1.00 72.21 H new ATOM 0 H2 GLY A 1 -28.597 0.223 11.554 1.00 72.21 H new ATOM 0 H3 GLY A 1 -28.148 1.860 11.516 1.00 72.21 H new ATOM 0 HA2 GLY A 1 -29.506 0.393 9.322 1.00 42.02 H new ATOM 0 HA3 GLY A 1 -29.042 2.082 9.284 1.00 42.02 H new ATOM 8 N ASP A 2 -26.720 1.589 8.499 1.00 53.21 N ATOM 9 CA ASP A 2 -25.298 1.541 8.127 1.00 1.44 C ATOM 10 C ASP A 2 -24.875 0.143 7.643 1.00 31.22 C ATOM 11 O ASP A 2 -23.768 -0.338 7.918 1.00 13.32 O ATOM 12 CB ASP A 2 -24.437 2.126 9.263 1.00 15.05 C ATOM 13 CG ASP A 2 -24.487 3.652 9.294 1.00 14.44 C ATOM 14 OD1 ASP A 2 -25.582 4.224 9.486 1.00 22.41 O ATOM 15 OD2 ASP A 2 -23.427 4.290 9.101 1.00 13.14 O ATOM 0 H ASP A 2 -27.191 2.396 8.091 1.00 53.21 H new ATOM 0 HA ASP A 2 -25.127 2.178 7.259 1.00 1.44 H new ATOM 0 HB2 ASP A 2 -24.783 1.733 10.219 1.00 15.05 H new ATOM 0 HB3 ASP A 2 -23.404 1.800 9.139 1.00 15.05 H new ATOM 20 N SER A 3 -25.772 -0.516 6.901 1.00 32.21 N ATOM 21 CA SER A 3 -25.708 -1.925 6.537 1.00 1.44 C ATOM 22 C SER A 3 -25.543 -2.112 5.032 1.00 40.00 C ATOM 23 O SER A 3 -25.952 -1.254 4.244 1.00 22.45 O ATOM 24 CB SER A 3 -26.974 -2.642 7.004 1.00 2.22 C ATOM 25 OG SER A 3 -26.695 -3.553 8.049 1.00 63.31 O ATOM 0 H SER A 3 -26.599 -0.054 6.523 1.00 32.21 H new ATOM 0 HA SER A 3 -24.835 -2.354 7.029 1.00 1.44 H new ATOM 0 HB2 SER A 3 -27.705 -1.908 7.344 1.00 2.22 H new ATOM 0 HB3 SER A 3 -27.423 -3.174 6.165 1.00 2.22 H new ATOM 0 HG SER A 3 -27.524 -3.995 8.328 1.00 63.31 H new ATOM 31 N GLU A 4 -25.047 -3.286 4.640 1.00 75.44 N ATOM 32 CA GLU A 4 -24.810 -3.680 3.261 1.00 11.01 C ATOM 33 C GLU A 4 -25.107 -5.177 3.078 1.00 52.03 C ATOM 34 O GLU A 4 -25.247 -5.905 4.066 1.00 43.00 O ATOM 35 CB GLU A 4 -23.348 -3.331 2.894 1.00 13.15 C ATOM 36 CG GLU A 4 -22.313 -4.168 3.684 1.00 35.34 C ATOM 37 CD GLU A 4 -20.867 -3.660 3.595 1.00 74.24 C ATOM 38 OE1 GLU A 4 -20.640 -2.433 3.641 1.00 73.11 O ATOM 39 OE2 GLU A 4 -19.949 -4.513 3.490 1.00 20.22 O ATOM 0 H GLU A 4 -24.791 -4.015 5.306 1.00 75.44 H new ATOM 0 HA GLU A 4 -25.477 -3.139 2.590 1.00 11.01 H new ATOM 0 HB2 GLU A 4 -23.199 -3.491 1.826 1.00 13.15 H new ATOM 0 HB3 GLU A 4 -23.174 -2.272 3.085 1.00 13.15 H new ATOM 0 HG2 GLU A 4 -22.611 -4.191 4.732 1.00 35.34 H new ATOM 0 HG3 GLU A 4 -22.345 -5.195 3.321 1.00 35.34 H new ATOM 46 N LEU A 5 -25.229 -5.632 1.824 1.00 2.24 N ATOM 47 CA LEU A 5 -25.262 -7.026 1.381 1.00 54.00 C ATOM 48 C LEU A 5 -25.193 -7.068 -0.154 1.00 41.14 C ATOM 49 O LEU A 5 -25.517 -6.057 -0.788 1.00 74.51 O ATOM 50 CB LEU A 5 -26.573 -7.700 1.832 1.00 72.41 C ATOM 51 CG LEU A 5 -26.397 -9.207 2.093 1.00 0.15 C ATOM 52 CD1 LEU A 5 -25.566 -9.482 3.354 1.00 4.22 C ATOM 53 CD2 LEU A 5 -27.770 -9.875 2.207 1.00 31.33 C ATOM 0 H LEU A 5 -25.313 -4.987 1.039 1.00 2.24 H new ATOM 0 HA LEU A 5 -24.414 -7.554 1.817 1.00 54.00 H new ATOM 0 HB2 LEU A 5 -26.934 -7.216 2.740 1.00 72.41 H new ATOM 0 HB3 LEU A 5 -27.336 -7.553 1.068 1.00 72.41 H new ATOM 0 HG LEU A 5 -25.851 -9.629 1.249 1.00 0.15 H new ATOM 0 HD11 LEU A 5 -25.468 -10.558 3.498 1.00 4.22 H new ATOM 0 HD12 LEU A 5 -24.576 -9.040 3.241 1.00 4.22 H new ATOM 0 HD13 LEU A 5 -26.063 -9.044 4.220 1.00 4.22 H new ATOM 0 HD21 LEU A 5 -27.642 -10.942 2.392 1.00 31.33 H new ATOM 0 HD22 LEU A 5 -28.325 -9.428 3.032 1.00 31.33 H new ATOM 0 HD23 LEU A 5 -28.323 -9.732 1.278 1.00 31.33 H new ATOM 65 N THR A 6 -24.882 -8.241 -0.726 1.00 53.43 N ATOM 66 CA THR A 6 -24.815 -8.586 -2.148 1.00 12.02 C ATOM 67 C THR A 6 -23.986 -7.566 -2.947 1.00 3.22 C ATOM 68 O THR A 6 -23.235 -6.784 -2.350 1.00 13.14 O ATOM 69 CB THR A 6 -26.222 -8.955 -2.687 1.00 42.24 C ATOM 70 OG1 THR A 6 -26.113 -9.623 -3.929 1.00 42.42 O ATOM 71 CG2 THR A 6 -27.205 -7.797 -2.884 1.00 32.31 C ATOM 0 H THR A 6 -24.649 -9.047 -0.146 1.00 53.43 H new ATOM 0 HA THR A 6 -24.242 -9.502 -2.292 1.00 12.02 H new ATOM 0 HB THR A 6 -26.633 -9.581 -1.895 1.00 42.24 H new ATOM 0 HG1 THR A 6 -27.008 -9.852 -4.257 1.00 42.42 H new ATOM 0 HG21 THR A 6 -28.151 -8.183 -3.264 1.00 32.31 H new ATOM 0 HG22 THR A 6 -27.374 -7.297 -1.930 1.00 32.31 H new ATOM 0 HG23 THR A 6 -26.791 -7.085 -3.598 1.00 32.31 H new ATOM 79 N THR A 7 -23.991 -7.654 -4.279 1.00 34.42 N ATOM 80 CA THR A 7 -23.270 -6.747 -5.160 1.00 15.04 C ATOM 81 C THR A 7 -24.147 -6.475 -6.393 1.00 64.44 C ATOM 82 O THR A 7 -24.324 -7.355 -7.242 1.00 54.14 O ATOM 83 CB THR A 7 -21.855 -7.288 -5.485 1.00 54.33 C ATOM 84 OG1 THR A 7 -21.851 -8.482 -6.234 1.00 55.14 O ATOM 85 CG2 THR A 7 -21.008 -7.581 -4.241 1.00 13.33 C ATOM 0 H THR A 7 -24.509 -8.375 -4.781 1.00 34.42 H new ATOM 0 HA THR A 7 -23.087 -5.790 -4.671 1.00 15.04 H new ATOM 0 HB THR A 7 -21.430 -6.470 -6.066 1.00 54.33 H new ATOM 0 HG1 THR A 7 -22.631 -8.498 -6.828 1.00 55.14 H new ATOM 0 HG21 THR A 7 -20.031 -7.956 -4.546 1.00 13.33 H new ATOM 0 HG22 THR A 7 -20.881 -6.665 -3.663 1.00 13.33 H new ATOM 0 HG23 THR A 7 -21.509 -8.330 -3.628 1.00 13.33 H new ATOM 93 N GLN A 8 -24.750 -5.286 -6.485 1.00 32.15 N ATOM 94 CA GLN A 8 -25.551 -4.885 -7.638 1.00 2.03 C ATOM 95 C GLN A 8 -24.674 -4.833 -8.887 1.00 41.03 C ATOM 96 O GLN A 8 -24.950 -5.546 -9.853 1.00 20.34 O ATOM 97 CB GLN A 8 -26.238 -3.533 -7.396 1.00 55.04 C ATOM 98 CG GLN A 8 -27.440 -3.630 -6.442 1.00 60.30 C ATOM 99 CD GLN A 8 -28.529 -2.627 -6.826 1.00 44.12 C ATOM 100 OE1 GLN A 8 -28.706 -1.573 -6.213 1.00 0.15 O ATOM 101 NE2 GLN A 8 -29.268 -2.917 -7.882 1.00 63.14 N ATOM 0 H GLN A 8 -24.694 -4.574 -5.757 1.00 32.15 H new ATOM 0 HA GLN A 8 -26.335 -5.627 -7.788 1.00 2.03 H new ATOM 0 HB2 GLN A 8 -25.512 -2.831 -6.986 1.00 55.04 H new ATOM 0 HB3 GLN A 8 -26.571 -3.125 -8.350 1.00 55.04 H new ATOM 0 HG2 GLN A 8 -27.847 -4.641 -6.466 1.00 60.30 H new ATOM 0 HG3 GLN A 8 -27.113 -3.443 -5.419 1.00 60.30 H new ATOM 0 HE21 GLN A 8 -29.117 -3.791 -8.386 1.00 63.14 H new ATOM 0 HE22 GLN A 8 -29.989 -2.267 -8.194 1.00 63.14 H new ATOM 110 N ASP A 9 -23.616 -4.017 -8.855 1.00 40.24 N ATOM 111 CA ASP A 9 -22.746 -3.780 -10.011 1.00 11.25 C ATOM 112 C ASP A 9 -21.265 -3.794 -9.628 1.00 34.12 C ATOM 113 O ASP A 9 -20.388 -3.489 -10.436 1.00 72.50 O ATOM 114 CB ASP A 9 -23.178 -2.473 -10.703 1.00 72.13 C ATOM 115 CG ASP A 9 -22.489 -2.225 -12.046 1.00 75.14 C ATOM 116 OD1 ASP A 9 -22.593 -3.088 -12.948 1.00 61.40 O ATOM 117 OD2 ASP A 9 -21.926 -1.122 -12.260 1.00 0.12 O ATOM 0 H ASP A 9 -23.337 -3.499 -8.021 1.00 40.24 H new ATOM 0 HA ASP A 9 -22.860 -4.598 -10.723 1.00 11.25 H new ATOM 0 HB2 ASP A 9 -24.257 -2.495 -10.858 1.00 72.13 H new ATOM 0 HB3 ASP A 9 -22.968 -1.635 -10.038 1.00 72.13 H new ATOM 122 N GLY A 10 -20.955 -4.165 -8.392 1.00 32.55 N ATOM 123 CA GLY A 10 -19.633 -4.140 -7.805 1.00 60.42 C ATOM 124 C GLY A 10 -19.747 -4.405 -6.312 1.00 42.13 C ATOM 125 O GLY A 10 -20.739 -4.053 -5.665 1.00 33.31 O ATOM 0 H GLY A 10 -21.662 -4.509 -7.742 1.00 32.55 H new ATOM 0 HA2 GLY A 10 -18.999 -4.893 -8.273 1.00 60.42 H new ATOM 0 HA3 GLY A 10 -19.162 -3.173 -7.980 1.00 60.42 H new ATOM 129 N GLU A 11 -18.710 -5.016 -5.762 1.00 60.52 N ATOM 130 CA GLU A 11 -18.430 -5.025 -4.339 1.00 43.33 C ATOM 131 C GLU A 11 -18.180 -3.582 -3.888 1.00 72.51 C ATOM 132 O GLU A 11 -17.662 -2.774 -4.661 1.00 1.25 O ATOM 133 CB GLU A 11 -17.213 -5.932 -4.106 1.00 0.02 C ATOM 134 CG GLU A 11 -17.184 -6.510 -2.696 1.00 73.54 C ATOM 135 CD GLU A 11 -16.271 -7.741 -2.619 1.00 62.44 C ATOM 136 OE1 GLU A 11 -16.653 -8.809 -3.165 1.00 60.13 O ATOM 137 OE2 GLU A 11 -15.194 -7.665 -1.993 1.00 44.00 O ATOM 0 H GLU A 11 -18.022 -5.533 -6.310 1.00 60.52 H new ATOM 0 HA GLU A 11 -19.263 -5.415 -3.754 1.00 43.33 H new ATOM 0 HB2 GLU A 11 -17.226 -6.747 -4.830 1.00 0.02 H new ATOM 0 HB3 GLU A 11 -16.300 -5.363 -4.282 1.00 0.02 H new ATOM 0 HG2 GLU A 11 -16.835 -5.751 -1.996 1.00 73.54 H new ATOM 0 HG3 GLU A 11 -18.194 -6.784 -2.392 1.00 73.54 H new ATOM 144 N ASP A 12 -18.561 -3.224 -2.665 1.00 52.30 N ATOM 145 CA ASP A 12 -18.339 -1.863 -2.164 1.00 64.14 C ATOM 146 C ASP A 12 -16.872 -1.671 -1.794 1.00 64.11 C ATOM 147 O ASP A 12 -16.207 -2.625 -1.377 1.00 1.43 O ATOM 148 CB ASP A 12 -19.198 -1.562 -0.937 1.00 72.32 C ATOM 149 CG ASP A 12 -19.466 -0.068 -0.831 1.00 64.22 C ATOM 150 OD1 ASP A 12 -20.479 0.386 -1.399 1.00 52.23 O ATOM 151 OD2 ASP A 12 -18.621 0.628 -0.226 1.00 32.35 O ATOM 0 H ASP A 12 -19.022 -3.849 -2.004 1.00 52.30 H new ATOM 0 HA ASP A 12 -18.621 -1.177 -2.963 1.00 64.14 H new ATOM 0 HB2 ASP A 12 -20.142 -2.103 -1.004 1.00 72.32 H new ATOM 0 HB3 ASP A 12 -18.693 -1.912 -0.037 1.00 72.32 H new ATOM 156 N PHE A 13 -16.376 -0.436 -1.866 1.00 35.44 N ATOM 157 CA PHE A 13 -15.033 -0.107 -1.407 1.00 43.44 C ATOM 158 C PHE A 13 -14.911 -0.303 0.104 1.00 31.43 C ATOM 159 O PHE A 13 -13.836 -0.630 0.602 1.00 4.03 O ATOM 160 CB PHE A 13 -14.627 1.318 -1.811 1.00 34.32 C ATOM 161 CG PHE A 13 -15.502 2.457 -1.326 1.00 40.42 C ATOM 162 CD1 PHE A 13 -16.783 2.649 -1.873 1.00 71.34 C ATOM 163 CD2 PHE A 13 -15.027 3.349 -0.345 1.00 41.31 C ATOM 164 CE1 PHE A 13 -17.614 3.658 -1.372 1.00 20.51 C ATOM 165 CE2 PHE A 13 -15.851 4.377 0.140 1.00 34.32 C ATOM 166 CZ PHE A 13 -17.156 4.517 -0.356 1.00 71.30 C ATOM 0 H PHE A 13 -16.893 0.358 -2.243 1.00 35.44 H new ATOM 0 HA PHE A 13 -14.342 -0.793 -1.898 1.00 43.44 H new ATOM 0 HB2 PHE A 13 -13.614 1.495 -1.450 1.00 34.32 H new ATOM 0 HB3 PHE A 13 -14.590 1.362 -2.899 1.00 34.32 H new ATOM 0 HD1 PHE A 13 -17.126 2.018 -2.680 1.00 71.34 H new ATOM 0 HD2 PHE A 13 -14.022 3.241 0.037 1.00 41.31 H new ATOM 0 HE1 PHE A 13 -18.612 3.778 -1.767 1.00 20.51 H new ATOM 0 HE2 PHE A 13 -15.482 5.058 0.893 1.00 34.32 H new ATOM 0 HZ PHE A 13 -17.807 5.282 0.041 1.00 71.30 H new ATOM 176 N LYS A 14 -15.995 -0.148 0.862 1.00 61.32 N ATOM 177 CA LYS A 14 -16.016 -0.489 2.282 1.00 75.11 C ATOM 178 C LYS A 14 -16.118 -1.998 2.496 1.00 41.34 C ATOM 179 O LYS A 14 -15.421 -2.526 3.361 1.00 41.20 O ATOM 180 CB LYS A 14 -17.152 0.264 2.992 1.00 52.03 C ATOM 181 CG LYS A 14 -16.727 0.742 4.389 1.00 0.13 C ATOM 182 CD LYS A 14 -15.682 1.867 4.319 1.00 53.14 C ATOM 183 CE LYS A 14 -15.511 2.529 5.685 1.00 23.11 C ATOM 184 NZ LYS A 14 -14.977 3.894 5.546 1.00 41.02 N ATOM 0 H LYS A 14 -16.880 0.216 0.510 1.00 61.32 H new ATOM 0 HA LYS A 14 -15.071 -0.173 2.724 1.00 75.11 H new ATOM 0 HB2 LYS A 14 -17.453 1.121 2.390 1.00 52.03 H new ATOM 0 HB3 LYS A 14 -18.022 -0.387 3.079 1.00 52.03 H new ATOM 0 HG2 LYS A 14 -17.603 1.094 4.934 1.00 0.13 H new ATOM 0 HG3 LYS A 14 -16.319 -0.098 4.951 1.00 0.13 H new ATOM 0 HD2 LYS A 14 -14.727 1.463 3.983 1.00 53.14 H new ATOM 0 HD3 LYS A 14 -15.990 2.611 3.584 1.00 53.14 H new ATOM 0 HE2 LYS A 14 -16.471 2.561 6.201 1.00 23.11 H new ATOM 0 HE3 LYS A 14 -14.838 1.932 6.301 1.00 23.11 H new ATOM 0 HZ1 LYS A 14 -14.870 4.322 6.488 1.00 41.02 H new ATOM 0 HZ2 LYS A 14 -14.051 3.858 5.075 1.00 41.02 H new ATOM 0 HZ3 LYS A 14 -15.633 4.467 4.978 1.00 41.02 H new ATOM 198 N SER A 15 -16.883 -2.708 1.663 1.00 51.32 N ATOM 199 CA SER A 15 -17.085 -4.157 1.709 1.00 33.51 C ATOM 200 C SER A 15 -15.809 -4.967 1.457 1.00 42.02 C ATOM 201 O SER A 15 -15.861 -6.197 1.531 1.00 14.03 O ATOM 202 CB SER A 15 -18.135 -4.575 0.668 1.00 74.33 C ATOM 203 OG SER A 15 -19.226 -5.303 1.191 1.00 62.31 O ATOM 0 H SER A 15 -17.402 -2.267 0.903 1.00 51.32 H new ATOM 0 HA SER A 15 -17.419 -4.377 2.723 1.00 33.51 H new ATOM 0 HB2 SER A 15 -18.515 -3.680 0.176 1.00 74.33 H new ATOM 0 HB3 SER A 15 -17.647 -5.178 -0.098 1.00 74.33 H new ATOM 0 HG SER A 15 -19.277 -5.165 2.160 1.00 62.31 H new ATOM 209 N PHE A 16 -14.672 -4.334 1.144 1.00 63.33 N ATOM 210 CA PHE A 16 -13.388 -5.024 1.118 1.00 32.22 C ATOM 211 C PHE A 16 -12.361 -4.406 2.076 1.00 72.24 C ATOM 212 O PHE A 16 -11.420 -5.117 2.430 1.00 44.20 O ATOM 213 CB PHE A 16 -12.902 -5.224 -0.336 1.00 63.10 C ATOM 214 CG PHE A 16 -11.943 -4.188 -0.888 1.00 3.43 C ATOM 215 CD1 PHE A 16 -12.355 -2.854 -1.035 1.00 11.22 C ATOM 216 CD2 PHE A 16 -10.640 -4.562 -1.279 1.00 55.03 C ATOM 217 CE1 PHE A 16 -11.460 -1.883 -1.517 1.00 72.12 C ATOM 218 CE2 PHE A 16 -9.755 -3.600 -1.797 1.00 54.15 C ATOM 219 CZ PHE A 16 -10.158 -2.254 -1.892 1.00 63.33 C ATOM 0 H PHE A 16 -14.621 -3.344 0.906 1.00 63.33 H new ATOM 0 HA PHE A 16 -13.526 -6.028 1.519 1.00 32.22 H new ATOM 0 HB2 PHE A 16 -12.421 -6.200 -0.402 1.00 63.10 H new ATOM 0 HB3 PHE A 16 -13.777 -5.256 -0.985 1.00 63.10 H new ATOM 0 HD1 PHE A 16 -13.365 -2.572 -0.776 1.00 11.22 H new ATOM 0 HD2 PHE A 16 -10.322 -5.589 -1.180 1.00 55.03 H new ATOM 0 HE1 PHE A 16 -11.773 -0.853 -1.599 1.00 72.12 H new ATOM 0 HE2 PHE A 16 -8.767 -3.893 -2.122 1.00 54.15 H new ATOM 0 HZ PHE A 16 -9.466 -1.507 -2.253 1.00 63.33 H new ATOM 229 N LEU A 17 -12.564 -3.162 2.538 1.00 62.33 N ATOM 230 CA LEU A 17 -11.620 -2.445 3.395 1.00 2.31 C ATOM 231 C LEU A 17 -11.438 -3.122 4.751 1.00 4.13 C ATOM 232 O LEU A 17 -10.365 -3.639 5.057 1.00 12.22 O ATOM 233 CB LEU A 17 -12.078 -0.988 3.582 1.00 60.23 C ATOM 234 CG LEU A 17 -10.980 0.054 3.855 1.00 11.31 C ATOM 235 CD1 LEU A 17 -10.286 -0.154 5.197 1.00 75.54 C ATOM 236 CD2 LEU A 17 -9.952 0.112 2.725 1.00 75.52 C ATOM 0 H LEU A 17 -13.402 -2.623 2.321 1.00 62.33 H new ATOM 0 HA LEU A 17 -10.651 -2.461 2.896 1.00 2.31 H new ATOM 0 HB2 LEU A 17 -12.619 -0.684 2.686 1.00 60.23 H new ATOM 0 HB3 LEU A 17 -12.788 -0.958 4.409 1.00 60.23 H new ATOM 0 HG LEU A 17 -11.492 1.015 3.900 1.00 11.31 H new ATOM 0 HD11 LEU A 17 -9.522 0.611 5.334 1.00 75.54 H new ATOM 0 HD12 LEU A 17 -11.019 -0.082 6.001 1.00 75.54 H new ATOM 0 HD13 LEU A 17 -9.821 -1.140 5.217 1.00 75.54 H new ATOM 0 HD21 LEU A 17 -9.195 0.861 2.960 1.00 75.52 H new ATOM 0 HD22 LEU A 17 -9.476 -0.863 2.615 1.00 75.52 H new ATOM 0 HD23 LEU A 17 -10.450 0.379 1.793 1.00 75.52 H new ATOM 248 N ASP A 18 -12.475 -3.100 5.591 1.00 71.32 N ATOM 249 CA ASP A 18 -12.371 -3.566 6.968 1.00 62.30 C ATOM 250 C ASP A 18 -11.927 -5.028 6.989 1.00 40.02 C ATOM 251 O ASP A 18 -11.066 -5.402 7.784 1.00 44.31 O ATOM 252 CB ASP A 18 -13.681 -3.349 7.720 1.00 74.41 C ATOM 253 CG ASP A 18 -13.597 -3.852 9.163 1.00 64.13 C ATOM 254 OD1 ASP A 18 -12.697 -3.399 9.912 1.00 33.32 O ATOM 255 OD2 ASP A 18 -14.499 -4.622 9.565 1.00 5.15 O ATOM 0 H ASP A 18 -13.402 -2.761 5.335 1.00 71.32 H new ATOM 0 HA ASP A 18 -11.613 -2.979 7.488 1.00 62.30 H new ATOM 0 HB2 ASP A 18 -13.930 -2.288 7.719 1.00 74.41 H new ATOM 0 HB3 ASP A 18 -14.488 -3.866 7.201 1.00 74.41 H new ATOM 260 N LYS A 19 -12.412 -5.813 6.022 1.00 60.20 N ATOM 261 CA LYS A 19 -11.952 -7.154 5.719 1.00 22.43 C ATOM 262 C LYS A 19 -10.441 -7.218 5.569 1.00 31.32 C ATOM 263 O LYS A 19 -9.840 -8.014 6.294 1.00 33.12 O ATOM 264 CB LYS A 19 -12.642 -7.681 4.456 1.00 44.00 C ATOM 265 CG LYS A 19 -13.864 -8.525 4.805 1.00 40.02 C ATOM 266 CD LYS A 19 -14.542 -9.037 3.532 1.00 61.20 C ATOM 267 CE LYS A 19 -15.422 -10.257 3.801 1.00 24.21 C ATOM 268 NZ LYS A 19 -16.596 -9.950 4.640 1.00 42.12 N ATOM 0 H LYS A 19 -13.168 -5.510 5.408 1.00 60.20 H new ATOM 0 HA LYS A 19 -12.220 -7.791 6.562 1.00 22.43 H new ATOM 0 HB2 LYS A 19 -12.943 -6.843 3.827 1.00 44.00 H new ATOM 0 HB3 LYS A 19 -11.938 -8.278 3.876 1.00 44.00 H new ATOM 0 HG2 LYS A 19 -13.566 -9.367 5.429 1.00 40.02 H new ATOM 0 HG3 LYS A 19 -14.569 -7.931 5.386 1.00 40.02 H new ATOM 0 HD2 LYS A 19 -15.148 -8.241 3.100 1.00 61.20 H new ATOM 0 HD3 LYS A 19 -13.781 -9.294 2.795 1.00 61.20 H new ATOM 0 HE2 LYS A 19 -15.760 -10.670 2.851 1.00 24.21 H new ATOM 0 HE3 LYS A 19 -14.825 -11.027 4.289 1.00 24.21 H new ATOM 0 HZ1 LYS A 19 -17.153 -10.816 4.787 1.00 42.12 H new ATOM 0 HZ2 LYS A 19 -16.279 -9.582 5.559 1.00 42.12 H new ATOM 0 HZ3 LYS A 19 -17.185 -9.236 4.165 1.00 42.12 H new ATOM 282 N PHE A 20 -9.805 -6.476 4.649 1.00 72.45 N ATOM 283 CA PHE A 20 -8.376 -6.708 4.425 1.00 63.15 C ATOM 284 C PHE A 20 -7.633 -6.273 5.695 1.00 60.21 C ATOM 285 O PHE A 20 -6.683 -6.950 6.103 1.00 5.40 O ATOM 286 CB PHE A 20 -7.781 -6.007 3.185 1.00 43.15 C ATOM 287 CG PHE A 20 -7.058 -4.688 3.429 1.00 20.33 C ATOM 288 CD1 PHE A 20 -7.729 -3.461 3.512 1.00 62.13 C ATOM 289 CD2 PHE A 20 -5.667 -4.715 3.636 1.00 11.34 C ATOM 290 CE1 PHE A 20 -7.032 -2.294 3.875 1.00 41.24 C ATOM 291 CE2 PHE A 20 -4.968 -3.559 4.014 1.00 63.55 C ATOM 292 CZ PHE A 20 -5.659 -2.350 4.162 1.00 11.24 C ATOM 0 H PHE A 20 -10.232 -5.748 4.077 1.00 72.45 H new ATOM 0 HA PHE A 20 -8.251 -7.770 4.215 1.00 63.15 H new ATOM 0 HB2 PHE A 20 -7.083 -6.695 2.707 1.00 43.15 H new ATOM 0 HB3 PHE A 20 -8.588 -5.827 2.475 1.00 43.15 H new ATOM 0 HD1 PHE A 20 -8.786 -3.411 3.296 1.00 62.13 H new ATOM 0 HD2 PHE A 20 -5.128 -5.641 3.502 1.00 11.34 H new ATOM 0 HE1 PHE A 20 -7.555 -1.351 3.933 1.00 41.24 H new ATOM 0 HE2 PHE A 20 -3.903 -3.601 4.190 1.00 63.55 H new ATOM 0 HZ PHE A 20 -5.138 -1.465 4.495 1.00 11.24 H new ATOM 302 N THR A 21 -8.095 -5.206 6.373 1.00 73.14 N ATOM 303 CA THR A 21 -7.483 -4.811 7.639 1.00 13.30 C ATOM 304 C THR A 21 -7.745 -5.804 8.780 1.00 10.12 C ATOM 305 O THR A 21 -7.177 -5.637 9.855 1.00 2.31 O ATOM 306 CB THR A 21 -7.931 -3.409 8.061 1.00 54.21 C ATOM 307 OG1 THR A 21 -9.337 -3.291 8.168 1.00 21.42 O ATOM 308 CG2 THR A 21 -7.456 -2.329 7.098 1.00 55.42 C ATOM 0 H THR A 21 -8.872 -4.619 6.069 1.00 73.14 H new ATOM 0 HA THR A 21 -6.409 -4.809 7.454 1.00 13.30 H new ATOM 0 HB THR A 21 -7.473 -3.264 9.040 1.00 54.21 H new ATOM 0 HG1 THR A 21 -9.752 -4.164 8.007 1.00 21.42 H new ATOM 0 HG21 THR A 21 -7.801 -1.355 7.445 1.00 55.42 H new ATOM 0 HG22 THR A 21 -6.367 -2.334 7.055 1.00 55.42 H new ATOM 0 HG23 THR A 21 -7.859 -2.524 6.104 1.00 55.42 H new ATOM 316 N SER A 22 -8.605 -6.803 8.585 1.00 12.21 N ATOM 317 CA SER A 22 -9.011 -7.753 9.601 1.00 14.40 C ATOM 318 C SER A 22 -8.551 -9.171 9.248 1.00 12.04 C ATOM 319 O SER A 22 -8.824 -10.087 10.030 1.00 22.24 O ATOM 320 CB SER A 22 -10.534 -7.656 9.769 1.00 51.41 C ATOM 321 OG SER A 22 -10.973 -8.464 10.834 1.00 72.51 O ATOM 0 H SER A 22 -9.049 -6.972 7.682 1.00 12.21 H new ATOM 0 HA SER A 22 -8.535 -7.514 10.552 1.00 14.40 H new ATOM 0 HB2 SER A 22 -10.819 -6.620 9.952 1.00 51.41 H new ATOM 0 HB3 SER A 22 -11.026 -7.964 8.846 1.00 51.41 H new ATOM 0 HG SER A 22 -10.363 -9.223 10.942 1.00 72.51 H new ATOM 327 N SER A 23 -7.902 -9.396 8.098 1.00 21.30 N ATOM 328 CA SER A 23 -7.578 -10.739 7.643 1.00 24.10 C ATOM 329 C SER A 23 -6.252 -10.752 6.874 1.00 70.51 C ATOM 330 O SER A 23 -6.209 -10.670 5.644 1.00 2.23 O ATOM 331 CB SER A 23 -8.791 -11.336 6.908 1.00 74.12 C ATOM 332 OG SER A 23 -9.271 -10.554 5.821 1.00 22.42 O ATOM 0 H SER A 23 -7.593 -8.656 7.468 1.00 21.30 H new ATOM 0 HA SER A 23 -7.393 -11.405 8.486 1.00 24.10 H new ATOM 0 HB2 SER A 23 -8.523 -12.325 6.536 1.00 74.12 H new ATOM 0 HB3 SER A 23 -9.601 -11.474 7.624 1.00 74.12 H new ATOM 0 HG SER A 23 -9.694 -9.740 6.165 1.00 22.42 H new ATOM 338 N ALA A 24 -5.150 -10.866 7.618 1.00 13.41 N ATOM 339 CA ALA A 24 -3.783 -10.920 7.123 1.00 11.03 C ATOM 340 C ALA A 24 -3.642 -11.934 5.993 1.00 70.13 C ATOM 341 O ALA A 24 -3.261 -11.571 4.878 1.00 23.13 O ATOM 342 CB ALA A 24 -2.846 -11.274 8.280 1.00 3.20 C ATOM 0 H ALA A 24 -5.195 -10.926 8.635 1.00 13.41 H new ATOM 0 HA ALA A 24 -3.516 -9.943 6.719 1.00 11.03 H new ATOM 0 HB1 ALA A 24 -1.819 -11.316 7.917 1.00 3.20 H new ATOM 0 HB2 ALA A 24 -2.925 -10.514 9.058 1.00 3.20 H new ATOM 0 HB3 ALA A 24 -3.126 -12.244 8.691 1.00 3.20 H new ATOM 348 N ALA A 25 -3.973 -13.204 6.251 1.00 70.33 N ATOM 349 CA ALA A 25 -3.817 -14.271 5.264 1.00 41.43 C ATOM 350 C ALA A 25 -4.733 -14.103 4.047 1.00 73.52 C ATOM 351 O ALA A 25 -4.662 -14.905 3.116 1.00 44.43 O ATOM 352 CB ALA A 25 -4.088 -15.627 5.913 1.00 10.32 C ATOM 0 H ALA A 25 -4.354 -13.517 7.144 1.00 70.33 H new ATOM 0 HA ALA A 25 -2.789 -14.215 4.907 1.00 41.43 H new ATOM 0 HB1 ALA A 25 -3.970 -16.416 5.170 1.00 10.32 H new ATOM 0 HB2 ALA A 25 -3.383 -15.787 6.729 1.00 10.32 H new ATOM 0 HB3 ALA A 25 -5.105 -15.646 6.304 1.00 10.32 H new ATOM 358 N PHE A 26 -5.616 -13.108 4.038 1.00 73.54 N ATOM 359 CA PHE A 26 -6.572 -12.871 2.973 1.00 61.44 C ATOM 360 C PHE A 26 -6.128 -11.750 2.038 1.00 35.22 C ATOM 361 O PHE A 26 -6.601 -11.695 0.907 1.00 21.20 O ATOM 362 CB PHE A 26 -7.923 -12.546 3.598 1.00 13.32 C ATOM 363 CG PHE A 26 -8.993 -13.552 3.265 1.00 33.54 C ATOM 364 CD1 PHE A 26 -9.448 -13.668 1.941 1.00 12.30 C ATOM 365 CD2 PHE A 26 -9.488 -14.412 4.263 1.00 51.01 C ATOM 366 CE1 PHE A 26 -10.387 -14.655 1.608 1.00 4.33 C ATOM 367 CE2 PHE A 26 -10.422 -15.403 3.927 1.00 12.34 C ATOM 368 CZ PHE A 26 -10.861 -15.529 2.602 1.00 14.40 C ATOM 0 H PHE A 26 -5.684 -12.428 4.795 1.00 73.54 H new ATOM 0 HA PHE A 26 -6.645 -13.771 2.363 1.00 61.44 H new ATOM 0 HB2 PHE A 26 -7.810 -12.491 4.681 1.00 13.32 H new ATOM 0 HB3 PHE A 26 -8.244 -11.560 3.261 1.00 13.32 H new ATOM 0 HD1 PHE A 26 -9.075 -12.998 1.180 1.00 12.30 H new ATOM 0 HD2 PHE A 26 -9.150 -14.309 5.284 1.00 51.01 H new ATOM 0 HE1 PHE A 26 -10.744 -14.743 0.593 1.00 4.33 H new ATOM 0 HE2 PHE A 26 -10.802 -16.068 4.688 1.00 12.34 H new ATOM 0 HZ PHE A 26 -11.568 -16.303 2.343 1.00 14.40 H new ATOM 378 N GLN A 27 -5.210 -10.873 2.460 1.00 11.23 N ATOM 379 CA GLN A 27 -4.763 -9.760 1.623 1.00 43.42 C ATOM 380 C GLN A 27 -4.227 -10.272 0.271 1.00 12.04 C ATOM 381 O GLN A 27 -4.451 -9.673 -0.780 1.00 53.23 O ATOM 382 CB GLN A 27 -3.700 -8.934 2.366 1.00 71.55 C ATOM 383 CG GLN A 27 -4.170 -8.335 3.703 1.00 55.15 C ATOM 384 CD GLN A 27 -3.199 -7.278 4.247 1.00 60.51 C ATOM 385 OE1 GLN A 27 -2.185 -6.965 3.621 1.00 31.30 O ATOM 386 NE2 GLN A 27 -3.513 -6.701 5.392 1.00 32.20 N ATOM 0 H GLN A 27 -4.764 -10.915 3.376 1.00 11.23 H new ATOM 0 HA GLN A 27 -5.616 -9.114 1.415 1.00 43.42 H new ATOM 0 HB2 GLN A 27 -2.832 -9.567 2.552 1.00 71.55 H new ATOM 0 HB3 GLN A 27 -3.370 -8.123 1.716 1.00 71.55 H new ATOM 0 HG2 GLN A 27 -5.154 -7.886 3.570 1.00 55.15 H new ATOM 0 HG3 GLN A 27 -4.281 -9.134 4.436 1.00 55.15 H new ATOM 0 HE21 GLN A 27 -4.359 -6.980 5.889 1.00 32.20 H new ATOM 0 HE22 GLN A 27 -2.910 -5.976 5.780 1.00 32.20 H new ATOM 395 N TYR A 28 -3.565 -11.432 0.293 1.00 74.25 N ATOM 396 CA TYR A 28 -2.929 -12.083 -0.846 1.00 43.02 C ATOM 397 C TYR A 28 -3.900 -12.543 -1.943 1.00 4.42 C ATOM 398 O TYR A 28 -3.437 -12.875 -3.034 1.00 33.24 O ATOM 399 CB TYR A 28 -2.099 -13.275 -0.344 1.00 3.20 C ATOM 400 CG TYR A 28 -1.120 -12.926 0.763 1.00 43.11 C ATOM 401 CD1 TYR A 28 -1.549 -12.951 2.105 1.00 74.14 C ATOM 402 CD2 TYR A 28 0.200 -12.535 0.455 1.00 15.14 C ATOM 403 CE1 TYR A 28 -0.688 -12.535 3.132 1.00 65.45 C ATOM 404 CE2 TYR A 28 1.078 -12.163 1.488 1.00 23.40 C ATOM 405 CZ TYR A 28 0.629 -12.132 2.826 1.00 3.24 C ATOM 406 OH TYR A 28 1.483 -11.765 3.819 1.00 50.35 O ATOM 0 H TYR A 28 -3.455 -11.968 1.154 1.00 74.25 H new ATOM 0 HA TYR A 28 -2.296 -11.331 -1.317 1.00 43.02 H new ATOM 0 HB2 TYR A 28 -2.776 -14.050 0.015 1.00 3.20 H new ATOM 0 HB3 TYR A 28 -1.547 -13.698 -1.183 1.00 3.20 H new ATOM 0 HD1 TYR A 28 -2.545 -13.292 2.344 1.00 74.14 H new ATOM 0 HD2 TYR A 28 0.535 -12.521 -0.572 1.00 15.14 H new ATOM 0 HE1 TYR A 28 -1.033 -12.523 4.155 1.00 65.45 H new ATOM 0 HE2 TYR A 28 2.100 -11.900 1.257 1.00 23.40 H new ATOM 0 HH TYR A 28 2.348 -11.518 3.431 1.00 50.35 H new ATOM 416 N THR A 29 -5.217 -12.573 -1.707 1.00 52.24 N ATOM 417 CA THR A 29 -6.182 -13.051 -2.702 1.00 4.20 C ATOM 418 C THR A 29 -6.808 -11.892 -3.504 1.00 11.33 C ATOM 419 O THR A 29 -7.740 -12.104 -4.293 1.00 13.23 O ATOM 420 CB THR A 29 -7.236 -13.953 -2.027 1.00 32.14 C ATOM 421 OG1 THR A 29 -8.109 -13.215 -1.207 1.00 52.34 O ATOM 422 CG2 THR A 29 -6.622 -15.053 -1.150 1.00 20.54 C ATOM 0 H THR A 29 -5.640 -12.270 -0.830 1.00 52.24 H new ATOM 0 HA THR A 29 -5.651 -13.658 -3.436 1.00 4.20 H new ATOM 0 HB THR A 29 -7.773 -14.409 -2.859 1.00 32.14 H new ATOM 0 HG1 THR A 29 -7.591 -12.733 -0.529 1.00 52.34 H new ATOM 0 HG21 THR A 29 -7.418 -15.651 -0.706 1.00 20.54 H new ATOM 0 HG22 THR A 29 -5.986 -15.693 -1.761 1.00 20.54 H new ATOM 0 HG23 THR A 29 -6.026 -14.598 -0.359 1.00 20.54 H new ATOM 430 N ARG A 30 -6.351 -10.651 -3.278 1.00 23.34 N ATOM 431 CA ARG A 30 -7.079 -9.419 -3.563 1.00 4.00 C ATOM 432 C ARG A 30 -6.126 -8.391 -4.175 1.00 55.34 C ATOM 433 O ARG A 30 -6.194 -7.207 -3.852 1.00 11.02 O ATOM 434 CB ARG A 30 -7.739 -8.937 -2.250 1.00 20.20 C ATOM 435 CG ARG A 30 -8.984 -9.749 -1.852 1.00 63.13 C ATOM 436 CD ARG A 30 -9.345 -9.537 -0.377 1.00 33.43 C ATOM 437 NE ARG A 30 -10.570 -10.269 -0.005 1.00 75.22 N ATOM 438 CZ ARG A 30 -10.943 -10.614 1.235 1.00 31.41 C ATOM 439 NH1 ARG A 30 -10.173 -10.334 2.282 1.00 43.03 N ATOM 440 NH2 ARG A 30 -12.093 -11.245 1.434 1.00 23.22 N ATOM 0 H ARG A 30 -5.429 -10.479 -2.877 1.00 23.34 H new ATOM 0 HA ARG A 30 -7.870 -9.578 -4.296 1.00 4.00 H new ATOM 0 HB2 ARG A 30 -7.007 -8.991 -1.444 1.00 20.20 H new ATOM 0 HB3 ARG A 30 -8.018 -7.889 -2.357 1.00 20.20 H new ATOM 0 HG2 ARG A 30 -9.826 -9.457 -2.479 1.00 63.13 H new ATOM 0 HG3 ARG A 30 -8.803 -10.808 -2.035 1.00 63.13 H new ATOM 0 HD2 ARG A 30 -8.518 -9.868 0.251 1.00 33.43 H new ATOM 0 HD3 ARG A 30 -9.484 -8.473 -0.186 1.00 33.43 H new ATOM 0 HE ARG A 30 -11.194 -10.539 -0.765 1.00 75.22 H new ATOM 0 HH11 ARG A 30 -9.285 -9.850 2.147 1.00 43.03 H new ATOM 0 HH12 ARG A 30 -10.470 -10.603 3.220 1.00 43.03 H new ATOM 0 HH21 ARG A 30 -12.696 -11.469 0.642 1.00 23.22 H new ATOM 0 HH22 ARG A 30 -12.374 -11.506 2.379 1.00 23.22 H new ATOM 454 N VAL A 31 -5.221 -8.819 -5.054 1.00 22.34 N ATOM 455 CA VAL A 31 -4.174 -7.967 -5.616 1.00 32.14 C ATOM 456 C VAL A 31 -4.170 -8.152 -7.134 1.00 33.51 C ATOM 457 O VAL A 31 -4.410 -9.262 -7.626 1.00 2.22 O ATOM 458 CB VAL A 31 -2.816 -8.318 -4.964 1.00 52.11 C ATOM 459 CG1 VAL A 31 -1.749 -7.265 -5.299 1.00 63.24 C ATOM 460 CG2 VAL A 31 -2.899 -8.435 -3.434 1.00 23.42 C ATOM 0 H VAL A 31 -5.194 -9.778 -5.400 1.00 22.34 H new ATOM 0 HA VAL A 31 -4.360 -6.914 -5.405 1.00 32.14 H new ATOM 0 HB VAL A 31 -2.541 -9.288 -5.377 1.00 52.11 H new ATOM 0 HG11 VAL A 31 -0.806 -7.540 -4.827 1.00 63.24 H new ATOM 0 HG12 VAL A 31 -1.613 -7.216 -6.379 1.00 63.24 H new ATOM 0 HG13 VAL A 31 -2.070 -6.291 -4.929 1.00 63.24 H new ATOM 0 HG21 VAL A 31 -1.916 -8.683 -3.034 1.00 23.42 H new ATOM 0 HG22 VAL A 31 -3.233 -7.486 -3.014 1.00 23.42 H new ATOM 0 HG23 VAL A 31 -3.607 -9.219 -3.167 1.00 23.42 H new ATOM 470 N LYS A 32 -3.907 -7.083 -7.884 1.00 40.21 N ATOM 471 CA LYS A 32 -3.731 -7.103 -9.327 1.00 75.33 C ATOM 472 C LYS A 32 -2.269 -6.861 -9.633 1.00 24.22 C ATOM 473 O LYS A 32 -1.618 -6.119 -8.904 1.00 44.41 O ATOM 474 CB LYS A 32 -4.594 -5.989 -9.933 1.00 64.42 C ATOM 475 CG LYS A 32 -5.890 -6.561 -10.497 1.00 33.20 C ATOM 476 CD LYS A 32 -5.739 -6.949 -11.973 1.00 60.25 C ATOM 477 CE LYS A 32 -5.929 -5.753 -12.910 1.00 74.35 C ATOM 478 NZ LYS A 32 -4.920 -5.688 -13.991 1.00 73.34 N ATOM 0 H LYS A 32 -3.808 -6.149 -7.486 1.00 40.21 H new ATOM 0 HA LYS A 32 -4.032 -8.062 -9.748 1.00 75.33 H new ATOM 0 HB2 LYS A 32 -4.821 -5.242 -9.172 1.00 64.42 H new ATOM 0 HB3 LYS A 32 -4.040 -5.481 -10.723 1.00 64.42 H new ATOM 0 HG2 LYS A 32 -6.185 -7.436 -9.918 1.00 33.20 H new ATOM 0 HG3 LYS A 32 -6.689 -5.826 -10.393 1.00 33.20 H new ATOM 0 HD2 LYS A 32 -4.751 -7.380 -12.134 1.00 60.25 H new ATOM 0 HD3 LYS A 32 -6.468 -7.721 -12.220 1.00 60.25 H new ATOM 0 HE2 LYS A 32 -6.923 -5.803 -13.354 1.00 74.35 H new ATOM 0 HE3 LYS A 32 -5.886 -4.833 -12.327 1.00 74.35 H new ATOM 0 HZ1 LYS A 32 -5.105 -4.857 -14.589 1.00 73.34 H new ATOM 0 HZ2 LYS A 32 -3.970 -5.611 -13.575 1.00 73.34 H new ATOM 0 HZ3 LYS A 32 -4.975 -6.550 -14.570 1.00 73.34 H new ATOM 492 N PHE A 33 -1.773 -7.443 -10.722 1.00 61.53 N ATOM 493 CA PHE A 33 -0.411 -7.207 -11.170 1.00 12.30 C ATOM 494 C PHE A 33 -0.373 -7.046 -12.694 1.00 21.14 C ATOM 495 O PHE A 33 -1.154 -7.715 -13.383 1.00 53.22 O ATOM 496 CB PHE A 33 0.483 -8.352 -10.698 1.00 1.00 C ATOM 497 CG PHE A 33 0.834 -8.287 -9.227 1.00 64.45 C ATOM 498 CD1 PHE A 33 1.815 -7.378 -8.793 1.00 23.11 C ATOM 499 CD2 PHE A 33 0.196 -9.123 -8.290 1.00 42.44 C ATOM 500 CE1 PHE A 33 2.186 -7.332 -7.447 1.00 4.30 C ATOM 501 CE2 PHE A 33 0.563 -9.065 -6.934 1.00 23.13 C ATOM 502 CZ PHE A 33 1.561 -8.167 -6.512 1.00 14.04 C ATOM 0 H PHE A 33 -2.302 -8.086 -11.312 1.00 61.53 H new ATOM 0 HA PHE A 33 -0.035 -6.280 -10.737 1.00 12.30 H new ATOM 0 HB2 PHE A 33 -0.018 -9.299 -10.901 1.00 1.00 H new ATOM 0 HB3 PHE A 33 1.403 -8.346 -11.282 1.00 1.00 H new ATOM 0 HD1 PHE A 33 2.284 -6.713 -9.503 1.00 23.11 H new ATOM 0 HD2 PHE A 33 -0.574 -9.808 -8.613 1.00 42.44 H new ATOM 0 HE1 PHE A 33 2.959 -6.649 -7.126 1.00 4.30 H new ATOM 0 HE2 PHE A 33 0.079 -9.710 -6.216 1.00 23.13 H new ATOM 0 HZ PHE A 33 1.844 -8.122 -5.471 1.00 14.04 H new ATOM 512 N PRO A 34 0.552 -6.250 -13.265 1.00 74.42 N ATOM 513 CA PRO A 34 1.616 -5.510 -12.581 1.00 64.23 C ATOM 514 C PRO A 34 1.061 -4.373 -11.718 1.00 11.24 C ATOM 515 O PRO A 34 -0.094 -3.982 -11.900 1.00 53.11 O ATOM 516 CB PRO A 34 2.497 -4.960 -13.707 1.00 74.35 C ATOM 517 CG PRO A 34 1.544 -4.812 -14.886 1.00 2.40 C ATOM 518 CD PRO A 34 0.587 -5.984 -14.698 1.00 11.43 C ATOM 0 HA PRO A 34 2.168 -6.152 -11.894 1.00 64.23 H new ATOM 0 HB2 PRO A 34 2.944 -4.004 -13.433 1.00 74.35 H new ATOM 0 HB3 PRO A 34 3.317 -5.640 -13.940 1.00 74.35 H new ATOM 0 HG2 PRO A 34 1.021 -3.856 -14.865 1.00 2.40 H new ATOM 0 HG3 PRO A 34 2.069 -4.868 -15.840 1.00 2.40 H new ATOM 0 HD2 PRO A 34 -0.407 -5.740 -15.074 1.00 11.43 H new ATOM 0 HD3 PRO A 34 0.930 -6.860 -15.249 1.00 11.43 H new ATOM 526 N LEU A 35 1.850 -3.881 -10.755 1.00 73.45 N ATOM 527 CA LEU A 35 1.526 -2.640 -10.057 1.00 71.14 C ATOM 528 C LEU A 35 2.143 -1.470 -10.801 1.00 43.05 C ATOM 529 O LEU A 35 2.979 -1.646 -11.695 1.00 14.23 O ATOM 530 CB LEU A 35 2.080 -2.632 -8.633 1.00 32.50 C ATOM 531 CG LEU A 35 1.615 -3.813 -7.780 1.00 32.53 C ATOM 532 CD1 LEU A 35 2.419 -3.775 -6.502 1.00 71.23 C ATOM 533 CD2 LEU A 35 0.127 -3.849 -7.455 1.00 51.24 C ATOM 0 H LEU A 35 2.714 -4.325 -10.445 1.00 73.45 H new ATOM 0 HA LEU A 35 0.440 -2.559 -10.017 1.00 71.14 H new ATOM 0 HB2 LEU A 35 3.169 -2.635 -8.677 1.00 32.50 H new ATOM 0 HB3 LEU A 35 1.784 -1.704 -8.144 1.00 32.50 H new ATOM 0 HG LEU A 35 1.779 -4.717 -8.366 1.00 32.53 H new ATOM 0 HD11 LEU A 35 2.120 -4.603 -5.859 1.00 71.23 H new ATOM 0 HD12 LEU A 35 3.480 -3.863 -6.737 1.00 71.23 H new ATOM 0 HD13 LEU A 35 2.238 -2.832 -5.986 1.00 71.23 H new ATOM 0 HD21 LEU A 35 -0.091 -4.727 -6.847 1.00 51.24 H new ATOM 0 HD22 LEU A 35 -0.147 -2.949 -6.905 1.00 51.24 H new ATOM 0 HD23 LEU A 35 -0.447 -3.897 -8.381 1.00 51.24 H new ATOM 545 N LYS A 36 1.794 -0.263 -10.367 1.00 32.21 N ATOM 546 CA LYS A 36 2.292 0.950 -11.013 1.00 13.02 C ATOM 547 C LYS A 36 3.633 1.400 -10.430 1.00 12.43 C ATOM 548 O LYS A 36 4.508 1.754 -11.224 1.00 53.41 O ATOM 549 CB LYS A 36 1.214 2.045 -11.073 1.00 51.31 C ATOM 550 CG LYS A 36 0.577 2.375 -9.718 1.00 4.03 C ATOM 551 CD LYS A 36 -0.435 3.520 -9.804 1.00 31.31 C ATOM 552 CE LYS A 36 -1.702 3.112 -10.562 1.00 21.31 C ATOM 553 NZ LYS A 36 -2.717 4.186 -10.533 1.00 74.14 N ATOM 0 H LYS A 36 1.172 -0.097 -9.576 1.00 32.21 H new ATOM 0 HA LYS A 36 2.511 0.716 -12.055 1.00 13.02 H new ATOM 0 HB2 LYS A 36 1.656 2.952 -11.484 1.00 51.31 H new ATOM 0 HB3 LYS A 36 0.431 1.731 -11.763 1.00 51.31 H new ATOM 0 HG2 LYS A 36 0.081 1.486 -9.328 1.00 4.03 H new ATOM 0 HG3 LYS A 36 1.360 2.640 -9.008 1.00 4.03 H new ATOM 0 HD2 LYS A 36 -0.703 3.843 -8.798 1.00 31.31 H new ATOM 0 HD3 LYS A 36 0.025 4.374 -10.301 1.00 31.31 H new ATOM 0 HE2 LYS A 36 -1.449 2.876 -11.596 1.00 21.31 H new ATOM 0 HE3 LYS A 36 -2.116 2.206 -10.120 1.00 21.31 H new ATOM 0 HZ1 LYS A 36 -3.581 3.860 -11.011 1.00 74.14 H new ATOM 0 HZ2 LYS A 36 -2.938 4.429 -9.546 1.00 74.14 H new ATOM 0 HZ3 LYS A 36 -2.347 5.026 -11.022 1.00 74.14 H new ATOM 567 N THR A 37 3.843 1.313 -9.117 1.00 64.41 N ATOM 568 CA THR A 37 4.999 1.841 -8.386 1.00 74.51 C ATOM 569 C THR A 37 5.909 0.681 -7.949 1.00 72.34 C ATOM 570 O THR A 37 5.631 0.043 -6.930 1.00 42.05 O ATOM 571 CB THR A 37 4.542 2.737 -7.225 1.00 22.23 C ATOM 572 OG1 THR A 37 3.539 3.604 -7.703 1.00 53.04 O ATOM 573 CG2 THR A 37 5.666 3.615 -6.678 1.00 24.21 C ATOM 0 H THR A 37 3.177 0.848 -8.500 1.00 64.41 H new ATOM 0 HA THR A 37 5.594 2.481 -9.038 1.00 74.51 H new ATOM 0 HB THR A 37 4.194 2.080 -6.428 1.00 22.23 H new ATOM 0 HG1 THR A 37 2.795 3.627 -7.065 1.00 53.04 H new ATOM 0 HG21 THR A 37 5.285 4.226 -5.860 1.00 24.21 H new ATOM 0 HG22 THR A 37 6.476 2.984 -6.312 1.00 24.21 H new ATOM 0 HG23 THR A 37 6.040 4.263 -7.471 1.00 24.21 H new ATOM 581 N PRO A 38 6.866 0.237 -8.783 1.00 52.31 N ATOM 582 CA PRO A 38 7.725 -0.903 -8.489 1.00 44.05 C ATOM 583 C PRO A 38 8.697 -0.613 -7.341 1.00 55.05 C ATOM 584 O PRO A 38 8.799 0.501 -6.827 1.00 43.01 O ATOM 585 CB PRO A 38 8.481 -1.149 -9.802 1.00 12.33 C ATOM 586 CG PRO A 38 8.697 0.271 -10.311 1.00 12.30 C ATOM 587 CD PRO A 38 7.383 0.948 -9.942 1.00 61.22 C ATOM 0 HA PRO A 38 7.151 -1.769 -8.160 1.00 44.05 H new ATOM 0 HB2 PRO A 38 9.423 -1.672 -9.639 1.00 12.33 H new ATOM 0 HB3 PRO A 38 7.900 -1.750 -10.502 1.00 12.33 H new ATOM 0 HG2 PRO A 38 9.551 0.750 -9.831 1.00 12.30 H new ATOM 0 HG3 PRO A 38 8.880 0.295 -11.385 1.00 12.30 H new ATOM 0 HD2 PRO A 38 7.540 2.002 -9.713 1.00 61.22 H new ATOM 0 HD3 PRO A 38 6.677 0.904 -10.771 1.00 61.22 H new ATOM 595 N ILE A 39 9.443 -1.652 -6.980 1.00 33.14 N ATOM 596 CA ILE A 39 10.621 -1.559 -6.140 1.00 74.55 C ATOM 597 C ILE A 39 11.676 -0.837 -6.975 1.00 75.21 C ATOM 598 O ILE A 39 12.035 -1.362 -8.030 1.00 51.31 O ATOM 599 CB ILE A 39 11.127 -2.977 -5.773 1.00 63.15 C ATOM 600 CG1 ILE A 39 10.040 -4.051 -5.552 1.00 55.42 C ATOM 601 CG2 ILE A 39 12.128 -2.899 -4.609 1.00 52.41 C ATOM 602 CD1 ILE A 39 9.046 -3.735 -4.439 1.00 24.24 C ATOM 0 H ILE A 39 9.235 -2.606 -7.274 1.00 33.14 H new ATOM 0 HA ILE A 39 10.407 -1.030 -5.211 1.00 74.55 H new ATOM 0 HB ILE A 39 11.637 -3.340 -6.665 1.00 63.15 H new ATOM 0 HG12 ILE A 39 9.490 -4.188 -6.483 1.00 55.42 H new ATOM 0 HG13 ILE A 39 10.527 -5.000 -5.327 1.00 55.42 H new ATOM 0 HG21 ILE A 39 12.476 -3.902 -4.361 1.00 52.41 H new ATOM 0 HG22 ILE A 39 12.978 -2.282 -4.901 1.00 52.41 H new ATOM 0 HG23 ILE A 39 11.641 -2.458 -3.739 1.00 52.41 H new ATOM 0 HD11 ILE A 39 8.321 -4.545 -4.358 1.00 24.24 H new ATOM 0 HD12 ILE A 39 9.579 -3.629 -3.494 1.00 24.24 H new ATOM 0 HD13 ILE A 39 8.526 -2.805 -4.669 1.00 24.24 H new ATOM 614 N THR A 40 12.220 0.278 -6.495 1.00 31.31 N ATOM 615 CA THR A 40 13.413 0.903 -7.057 1.00 24.50 C ATOM 616 C THR A 40 14.415 1.031 -5.916 1.00 61.15 C ATOM 617 O THR A 40 14.144 1.751 -4.952 1.00 34.13 O ATOM 618 CB THR A 40 13.083 2.256 -7.715 1.00 54.03 C ATOM 619 OG1 THR A 40 12.312 2.018 -8.876 1.00 4.44 O ATOM 620 CG2 THR A 40 14.356 3.008 -8.102 1.00 72.31 C ATOM 0 H THR A 40 11.839 0.780 -5.693 1.00 31.31 H new ATOM 0 HA THR A 40 13.837 0.298 -7.858 1.00 24.50 H new ATOM 0 HB THR A 40 12.530 2.867 -7.002 1.00 54.03 H new ATOM 0 HG1 THR A 40 12.093 2.872 -9.304 1.00 4.44 H new ATOM 0 HG21 THR A 40 14.091 3.959 -8.564 1.00 72.31 H new ATOM 0 HG22 THR A 40 14.955 3.192 -7.210 1.00 72.31 H new ATOM 0 HG23 THR A 40 14.932 2.410 -8.808 1.00 72.31 H new ATOM 628 N LEU A 41 15.545 0.326 -6.012 1.00 1.21 N ATOM 629 CA LEU A 41 16.676 0.434 -5.089 1.00 12.31 C ATOM 630 C LEU A 41 17.822 1.090 -5.842 1.00 55.01 C ATOM 631 O LEU A 41 17.950 0.855 -7.046 1.00 24.42 O ATOM 632 CB LEU A 41 17.170 -0.951 -4.653 1.00 62.41 C ATOM 633 CG LEU A 41 16.085 -1.871 -4.092 1.00 11.34 C ATOM 634 CD1 LEU A 41 16.725 -3.118 -3.502 1.00 75.21 C ATOM 635 CD2 LEU A 41 15.269 -1.223 -2.983 1.00 41.24 C ATOM 0 H LEU A 41 15.702 -0.355 -6.755 1.00 1.21 H new ATOM 0 HA LEU A 41 16.360 1.001 -4.213 1.00 12.31 H new ATOM 0 HB2 LEU A 41 17.636 -1.441 -5.508 1.00 62.41 H new ATOM 0 HB3 LEU A 41 17.945 -0.824 -3.897 1.00 62.41 H new ATOM 0 HG LEU A 41 15.423 -2.102 -4.927 1.00 11.34 H new ATOM 0 HD11 LEU A 41 15.949 -3.771 -3.103 1.00 75.21 H new ATOM 0 HD12 LEU A 41 17.279 -3.645 -4.279 1.00 75.21 H new ATOM 0 HD13 LEU A 41 17.406 -2.833 -2.700 1.00 75.21 H new ATOM 0 HD21 LEU A 41 14.516 -1.926 -2.627 1.00 41.24 H new ATOM 0 HD22 LEU A 41 15.928 -0.949 -2.159 1.00 41.24 H new ATOM 0 HD23 LEU A 41 14.778 -0.329 -3.368 1.00 41.24 H new ATOM 647 N LEU A 42 18.691 1.821 -5.151 1.00 13.04 N ATOM 648 CA LEU A 42 19.941 2.258 -5.729 1.00 1.43 C ATOM 649 C LEU A 42 20.948 1.110 -5.709 1.00 33.02 C ATOM 650 O LEU A 42 21.145 0.468 -4.671 1.00 55.51 O ATOM 651 CB LEU A 42 20.459 3.445 -4.922 1.00 54.14 C ATOM 652 CG LEU A 42 21.583 4.201 -5.634 1.00 34.04 C ATOM 653 CD1 LEU A 42 21.078 4.847 -6.927 1.00 12.51 C ATOM 654 CD2 LEU A 42 22.067 5.283 -4.680 1.00 24.21 C ATOM 0 H LEU A 42 18.545 2.120 -4.187 1.00 13.04 H new ATOM 0 HA LEU A 42 19.794 2.562 -6.765 1.00 1.43 H new ATOM 0 HB2 LEU A 42 19.635 4.131 -4.723 1.00 54.14 H new ATOM 0 HB3 LEU A 42 20.820 3.092 -3.956 1.00 54.14 H new ATOM 0 HG LEU A 42 22.386 3.514 -5.901 1.00 34.04 H new ATOM 0 HD11 LEU A 42 21.897 5.378 -7.413 1.00 12.51 H new ATOM 0 HD12 LEU A 42 20.699 4.074 -7.596 1.00 12.51 H new ATOM 0 HD13 LEU A 42 20.278 5.550 -6.694 1.00 12.51 H new ATOM 0 HD21 LEU A 42 22.872 5.849 -5.149 1.00 24.21 H new ATOM 0 HD22 LEU A 42 21.242 5.955 -4.443 1.00 24.21 H new ATOM 0 HD23 LEU A 42 22.434 4.822 -3.763 1.00 24.21 H new ATOM 666 N ALA A 43 21.594 0.875 -6.849 1.00 31.00 N ATOM 667 CA ALA A 43 22.649 -0.105 -7.058 1.00 33.33 C ATOM 668 C ALA A 43 23.881 0.175 -6.195 1.00 23.24 C ATOM 669 O ALA A 43 23.997 1.229 -5.567 1.00 24.42 O ATOM 670 CB ALA A 43 23.069 -0.066 -8.527 1.00 22.12 C ATOM 0 H ALA A 43 21.380 1.396 -7.699 1.00 31.00 H new ATOM 0 HA ALA A 43 22.256 -1.082 -6.777 1.00 33.33 H new ATOM 0 HB1 ALA A 43 23.860 -0.796 -8.699 1.00 22.12 H new ATOM 0 HB2 ALA A 43 22.212 -0.305 -9.157 1.00 22.12 H new ATOM 0 HB3 ALA A 43 23.435 0.930 -8.774 1.00 22.12 H new ATOM 676 N ASP A 44 24.852 -0.738 -6.247 1.00 15.30 N ATOM 677 CA ASP A 44 26.168 -0.584 -5.622 1.00 44.13 C ATOM 678 C ASP A 44 26.893 0.616 -6.229 1.00 43.35 C ATOM 679 O ASP A 44 27.577 1.366 -5.538 1.00 54.53 O ATOM 680 CB ASP A 44 26.994 -1.857 -5.850 1.00 42.15 C ATOM 681 CG ASP A 44 27.866 -2.181 -4.640 1.00 73.43 C ATOM 682 OD1 ASP A 44 27.351 -2.898 -3.749 1.00 2.21 O ATOM 683 OD2 ASP A 44 29.064 -1.828 -4.621 1.00 73.05 O ATOM 0 H ASP A 44 24.743 -1.626 -6.736 1.00 15.30 H new ATOM 0 HA ASP A 44 26.042 -0.420 -4.552 1.00 44.13 H new ATOM 0 HB2 ASP A 44 26.326 -2.694 -6.053 1.00 42.15 H new ATOM 0 HB3 ASP A 44 27.624 -1.731 -6.731 1.00 42.15 H new ATOM 688 N ASP A 45 26.637 0.844 -7.518 1.00 54.43 N ATOM 689 CA ASP A 45 27.197 1.854 -8.404 1.00 3.14 C ATOM 690 C ASP A 45 26.830 3.271 -7.959 1.00 74.34 C ATOM 691 O ASP A 45 27.459 4.247 -8.364 1.00 72.21 O ATOM 692 CB ASP A 45 26.701 1.621 -9.824 1.00 4.33 C ATOM 693 CG ASP A 45 26.810 0.186 -10.350 1.00 14.43 C ATOM 694 OD1 ASP A 45 26.098 -0.697 -9.804 1.00 42.44 O ATOM 695 OD2 ASP A 45 27.534 -0.043 -11.343 1.00 20.31 O ATOM 0 H ASP A 45 25.961 0.263 -8.014 1.00 54.43 H new ATOM 0 HA ASP A 45 28.283 1.764 -8.366 1.00 3.14 H new ATOM 0 HB2 ASP A 45 25.656 1.927 -9.877 1.00 4.33 H new ATOM 0 HB3 ASP A 45 27.259 2.275 -10.494 1.00 4.33 H new ATOM 700 N GLY A 46 25.786 3.398 -7.139 1.00 11.12 N ATOM 701 CA GLY A 46 25.376 4.644 -6.515 1.00 64.23 C ATOM 702 C GLY A 46 24.648 5.621 -7.439 1.00 73.21 C ATOM 703 O GLY A 46 24.168 6.635 -6.939 1.00 63.04 O ATOM 0 H GLY A 46 25.189 2.610 -6.887 1.00 11.12 H new ATOM 0 HA2 GLY A 46 24.726 4.413 -5.671 1.00 64.23 H new ATOM 0 HA3 GLY A 46 26.260 5.139 -6.112 1.00 64.23 H new ATOM 707 N GLU A 47 24.509 5.312 -8.731 1.00 4.53 N ATOM 708 CA GLU A 47 23.709 6.021 -9.718 1.00 12.23 C ATOM 709 C GLU A 47 23.181 4.991 -10.721 1.00 35.20 C ATOM 710 O GLU A 47 23.513 4.997 -11.907 1.00 23.10 O ATOM 711 CB GLU A 47 24.537 7.106 -10.412 1.00 14.53 C ATOM 712 CG GLU A 47 24.762 8.321 -9.513 1.00 33.41 C ATOM 713 CD GLU A 47 25.214 9.544 -10.311 1.00 0.22 C ATOM 714 OE1 GLU A 47 24.443 10.073 -11.141 1.00 32.24 O ATOM 715 OE2 GLU A 47 26.366 10.000 -10.098 1.00 73.22 O ATOM 0 H GLU A 47 24.986 4.506 -9.136 1.00 4.53 H new ATOM 0 HA GLU A 47 22.872 6.527 -9.236 1.00 12.23 H new ATOM 0 HB2 GLU A 47 25.501 6.692 -10.709 1.00 14.53 H new ATOM 0 HB3 GLU A 47 24.030 7.420 -11.325 1.00 14.53 H new ATOM 0 HG2 GLU A 47 23.840 8.555 -8.981 1.00 33.41 H new ATOM 0 HG3 GLU A 47 25.512 8.081 -8.760 1.00 33.41 H new ATOM 722 N THR A 48 22.405 4.025 -10.242 1.00 42.31 N ATOM 723 CA THR A 48 21.665 3.086 -11.069 1.00 51.34 C ATOM 724 C THR A 48 20.445 2.654 -10.256 1.00 53.41 C ATOM 725 O THR A 48 20.569 1.947 -9.256 1.00 55.51 O ATOM 726 CB THR A 48 22.593 1.938 -11.520 1.00 41.24 C ATOM 727 OG1 THR A 48 23.464 2.385 -12.544 1.00 43.15 O ATOM 728 CG2 THR A 48 21.852 0.714 -12.055 1.00 63.32 C ATOM 0 H THR A 48 22.272 3.872 -9.242 1.00 42.31 H new ATOM 0 HA THR A 48 21.306 3.524 -12.000 1.00 51.34 H new ATOM 0 HB THR A 48 23.135 1.641 -10.622 1.00 41.24 H new ATOM 0 HG1 THR A 48 23.534 3.362 -12.511 1.00 43.15 H new ATOM 0 HG21 THR A 48 22.574 -0.048 -12.351 1.00 63.32 H new ATOM 0 HG22 THR A 48 21.201 0.314 -11.278 1.00 63.32 H new ATOM 0 HG23 THR A 48 21.252 1.001 -12.919 1.00 63.32 H new ATOM 736 N GLU A 49 19.267 3.119 -10.654 1.00 41.53 N ATOM 737 CA GLU A 49 17.981 2.679 -10.132 1.00 73.32 C ATOM 738 C GLU A 49 17.723 1.261 -10.654 1.00 4.10 C ATOM 739 O GLU A 49 17.418 1.081 -11.836 1.00 64.43 O ATOM 740 CB GLU A 49 16.875 3.614 -10.638 1.00 20.20 C ATOM 741 CG GLU A 49 16.832 4.991 -9.957 1.00 1.34 C ATOM 742 CD GLU A 49 15.709 5.879 -10.520 1.00 72.33 C ATOM 743 OE1 GLU A 49 14.722 5.348 -11.098 1.00 72.34 O ATOM 744 OE2 GLU A 49 15.811 7.126 -10.428 1.00 43.12 O ATOM 0 H GLU A 49 19.179 3.837 -11.373 1.00 41.53 H new ATOM 0 HA GLU A 49 17.987 2.693 -9.042 1.00 73.32 H new ATOM 0 HB2 GLU A 49 17.004 3.759 -11.711 1.00 20.20 H new ATOM 0 HB3 GLU A 49 15.912 3.124 -10.496 1.00 20.20 H new ATOM 0 HG2 GLU A 49 16.687 4.860 -8.885 1.00 1.34 H new ATOM 0 HG3 GLU A 49 17.791 5.491 -10.091 1.00 1.34 H new ATOM 751 N LYS A 50 17.863 0.231 -9.818 1.00 44.41 N ATOM 752 CA LYS A 50 17.500 -1.130 -10.211 1.00 12.13 C ATOM 753 C LYS A 50 16.064 -1.395 -9.812 1.00 52.41 C ATOM 754 O LYS A 50 15.725 -1.367 -8.623 1.00 61.44 O ATOM 755 CB LYS A 50 18.438 -2.189 -9.629 1.00 15.43 C ATOM 756 CG LYS A 50 19.858 -2.003 -10.174 1.00 20.23 C ATOM 757 CD LYS A 50 20.586 -3.338 -10.363 1.00 0.30 C ATOM 758 CE LYS A 50 22.095 -3.086 -10.377 1.00 42.32 C ATOM 759 NZ LYS A 50 22.893 -4.314 -10.574 1.00 42.43 N ATOM 0 H LYS A 50 18.224 0.313 -8.868 1.00 44.41 H new ATOM 0 HA LYS A 50 17.603 -1.205 -11.293 1.00 12.13 H new ATOM 0 HB2 LYS A 50 18.447 -2.118 -8.541 1.00 15.43 H new ATOM 0 HB3 LYS A 50 18.073 -3.185 -9.880 1.00 15.43 H new ATOM 0 HG2 LYS A 50 19.813 -1.478 -11.128 1.00 20.23 H new ATOM 0 HG3 LYS A 50 20.428 -1.374 -9.490 1.00 20.23 H new ATOM 0 HD2 LYS A 50 20.327 -4.025 -9.558 1.00 0.30 H new ATOM 0 HD3 LYS A 50 20.274 -3.808 -11.296 1.00 0.30 H new ATOM 0 HE2 LYS A 50 22.330 -2.377 -11.171 1.00 42.32 H new ATOM 0 HE3 LYS A 50 22.387 -2.619 -9.436 1.00 42.32 H new ATOM 0 HZ1 LYS A 50 23.905 -4.074 -10.574 1.00 42.43 H new ATOM 0 HZ2 LYS A 50 22.696 -4.984 -9.803 1.00 42.43 H new ATOM 0 HZ3 LYS A 50 22.641 -4.750 -11.484 1.00 42.43 H new ATOM 773 N THR A 51 15.223 -1.661 -10.806 1.00 15.14 N ATOM 774 CA THR A 51 13.839 -2.030 -10.591 1.00 32.20 C ATOM 775 C THR A 51 13.745 -3.518 -10.269 1.00 40.33 C ATOM 776 O THR A 51 14.011 -4.358 -11.133 1.00 51.34 O ATOM 777 CB THR A 51 12.973 -1.616 -11.786 1.00 71.13 C ATOM 778 OG1 THR A 51 13.648 -1.798 -13.022 1.00 60.52 O ATOM 779 CG2 THR A 51 12.616 -0.145 -11.619 1.00 0.03 C ATOM 0 H THR A 51 15.491 -1.625 -11.790 1.00 15.14 H new ATOM 0 HA THR A 51 13.444 -1.489 -9.731 1.00 32.20 H new ATOM 0 HB THR A 51 12.082 -2.244 -11.807 1.00 71.13 H new ATOM 0 HG1 THR A 51 13.062 -1.524 -13.758 1.00 60.52 H new ATOM 0 HG21 THR A 51 11.999 0.177 -12.458 1.00 0.03 H new ATOM 0 HG22 THR A 51 12.065 -0.008 -10.689 1.00 0.03 H new ATOM 0 HG23 THR A 51 13.529 0.450 -11.591 1.00 0.03 H new ATOM 787 N PHE A 52 13.409 -3.848 -9.024 1.00 41.13 N ATOM 788 CA PHE A 52 13.206 -5.233 -8.572 1.00 60.32 C ATOM 789 C PHE A 52 11.718 -5.599 -8.700 1.00 33.51 C ATOM 790 O PHE A 52 10.886 -4.691 -8.740 1.00 55.24 O ATOM 791 CB PHE A 52 13.723 -5.409 -7.133 1.00 4.03 C ATOM 792 CG PHE A 52 15.228 -5.532 -7.022 1.00 0.00 C ATOM 793 CD1 PHE A 52 16.025 -4.380 -6.881 1.00 54.05 C ATOM 794 CD2 PHE A 52 15.833 -6.803 -7.048 1.00 31.43 C ATOM 795 CE1 PHE A 52 17.422 -4.495 -6.774 1.00 15.40 C ATOM 796 CE2 PHE A 52 17.230 -6.917 -6.964 1.00 15.41 C ATOM 797 CZ PHE A 52 18.023 -5.765 -6.846 1.00 31.41 C ATOM 0 H PHE A 52 13.267 -3.157 -8.288 1.00 41.13 H new ATOM 0 HA PHE A 52 13.777 -5.915 -9.202 1.00 60.32 H new ATOM 0 HB2 PHE A 52 13.395 -4.559 -6.535 1.00 4.03 H new ATOM 0 HB3 PHE A 52 13.265 -6.299 -6.701 1.00 4.03 H new ATOM 0 HD1 PHE A 52 15.562 -3.405 -6.855 1.00 54.05 H new ATOM 0 HD2 PHE A 52 15.223 -7.690 -7.133 1.00 31.43 H new ATOM 0 HE1 PHE A 52 18.031 -3.613 -6.637 1.00 15.40 H new ATOM 0 HE2 PHE A 52 17.695 -7.892 -6.990 1.00 15.41 H new ATOM 0 HZ PHE A 52 19.099 -5.854 -6.810 1.00 31.41 H new ATOM 807 N PRO A 53 11.337 -6.891 -8.778 1.00 13.23 N ATOM 808 CA PRO A 53 9.957 -7.288 -9.062 1.00 63.43 C ATOM 809 C PRO A 53 9.081 -7.258 -7.804 1.00 73.52 C ATOM 810 O PRO A 53 9.489 -7.781 -6.763 1.00 23.24 O ATOM 811 CB PRO A 53 10.070 -8.694 -9.657 1.00 62.15 C ATOM 812 CG PRO A 53 11.300 -9.279 -8.963 1.00 24.33 C ATOM 813 CD PRO A 53 12.210 -8.062 -8.774 1.00 15.13 C ATOM 0 HA PRO A 53 9.468 -6.598 -9.750 1.00 63.43 H new ATOM 0 HB2 PRO A 53 9.177 -9.287 -9.458 1.00 62.15 H new ATOM 0 HB3 PRO A 53 10.197 -8.663 -10.739 1.00 62.15 H new ATOM 0 HG2 PRO A 53 11.043 -9.741 -8.010 1.00 24.33 H new ATOM 0 HG3 PRO A 53 11.777 -10.048 -9.571 1.00 24.33 H new ATOM 0 HD2 PRO A 53 12.762 -8.132 -7.837 1.00 15.13 H new ATOM 0 HD3 PRO A 53 12.947 -8.000 -9.575 1.00 15.13 H new ATOM 821 N PHE A 54 7.880 -6.677 -7.899 1.00 61.13 N ATOM 822 CA PHE A 54 6.847 -6.568 -6.861 1.00 14.22 C ATOM 823 C PHE A 54 6.147 -7.911 -6.564 1.00 14.41 C ATOM 824 O PHE A 54 4.932 -8.031 -6.662 1.00 71.25 O ATOM 825 CB PHE A 54 5.887 -5.405 -7.214 1.00 51.23 C ATOM 826 CG PHE A 54 5.451 -5.239 -8.657 1.00 72.55 C ATOM 827 CD1 PHE A 54 5.021 -6.324 -9.442 1.00 53.41 C ATOM 828 CD2 PHE A 54 5.498 -3.956 -9.218 1.00 54.14 C ATOM 829 CE1 PHE A 54 4.784 -6.141 -10.816 1.00 54.32 C ATOM 830 CE2 PHE A 54 5.262 -3.764 -10.587 1.00 60.54 C ATOM 831 CZ PHE A 54 4.949 -4.869 -11.393 1.00 63.25 C ATOM 0 H PHE A 54 7.581 -6.237 -8.769 1.00 61.13 H new ATOM 0 HA PHE A 54 7.320 -6.320 -5.911 1.00 14.22 H new ATOM 0 HB2 PHE A 54 4.989 -5.521 -6.608 1.00 51.23 H new ATOM 0 HB3 PHE A 54 6.364 -4.476 -6.903 1.00 51.23 H new ATOM 0 HD1 PHE A 54 4.873 -7.294 -8.991 1.00 53.41 H new ATOM 0 HD2 PHE A 54 5.718 -3.106 -8.589 1.00 54.14 H new ATOM 0 HE1 PHE A 54 4.476 -6.976 -11.427 1.00 54.32 H new ATOM 0 HE2 PHE A 54 5.321 -2.775 -11.017 1.00 60.54 H new ATOM 0 HZ PHE A 54 4.834 -4.742 -12.459 1.00 63.25 H new ATOM 841 N THR A 55 6.892 -8.960 -6.227 1.00 71.31 N ATOM 842 CA THR A 55 6.324 -10.288 -5.987 1.00 61.34 C ATOM 843 C THR A 55 5.622 -10.379 -4.618 1.00 13.13 C ATOM 844 O THR A 55 5.790 -9.502 -3.767 1.00 4.43 O ATOM 845 CB THR A 55 7.436 -11.331 -6.150 1.00 44.34 C ATOM 846 OG1 THR A 55 8.481 -11.092 -5.231 1.00 24.32 O ATOM 847 CG2 THR A 55 8.031 -11.280 -7.558 1.00 23.43 C ATOM 0 H THR A 55 7.905 -8.916 -6.112 1.00 71.31 H new ATOM 0 HA THR A 55 5.543 -10.487 -6.721 1.00 61.34 H new ATOM 0 HB THR A 55 6.989 -12.308 -5.969 1.00 44.34 H new ATOM 0 HG1 THR A 55 9.181 -11.768 -5.348 1.00 24.32 H new ATOM 0 HG21 THR A 55 8.817 -12.029 -7.648 1.00 23.43 H new ATOM 0 HG22 THR A 55 7.250 -11.484 -8.291 1.00 23.43 H new ATOM 0 HG23 THR A 55 8.450 -10.290 -7.740 1.00 23.43 H new ATOM 855 N LYS A 56 4.897 -11.476 -4.340 1.00 4.43 N ATOM 856 CA LYS A 56 4.249 -11.757 -3.049 1.00 55.21 C ATOM 857 C LYS A 56 5.230 -11.769 -1.866 1.00 20.50 C ATOM 858 O LYS A 56 4.802 -11.745 -0.715 1.00 73.25 O ATOM 859 CB LYS A 56 3.497 -13.102 -3.127 1.00 21.43 C ATOM 860 CG LYS A 56 2.431 -13.217 -4.243 1.00 42.11 C ATOM 861 CD LYS A 56 0.985 -13.445 -3.762 1.00 15.40 C ATOM 862 CE LYS A 56 0.738 -14.739 -2.965 1.00 23.34 C ATOM 863 NZ LYS A 56 1.111 -15.970 -3.696 1.00 21.23 N ATOM 0 H LYS A 56 4.742 -12.213 -5.028 1.00 4.43 H new ATOM 0 HA LYS A 56 3.549 -10.942 -2.862 1.00 55.21 H new ATOM 0 HB2 LYS A 56 4.229 -13.898 -3.267 1.00 21.43 H new ATOM 0 HB3 LYS A 56 3.011 -13.281 -2.168 1.00 21.43 H new ATOM 0 HG2 LYS A 56 2.457 -12.306 -4.840 1.00 42.11 H new ATOM 0 HG3 LYS A 56 2.709 -14.039 -4.903 1.00 42.11 H new ATOM 0 HD2 LYS A 56 0.691 -12.598 -3.142 1.00 15.40 H new ATOM 0 HD3 LYS A 56 0.329 -13.446 -4.632 1.00 15.40 H new ATOM 0 HE2 LYS A 56 1.303 -14.695 -2.034 1.00 23.34 H new ATOM 0 HE3 LYS A 56 -0.317 -14.793 -2.695 1.00 23.34 H new ATOM 0 HZ1 LYS A 56 0.918 -16.800 -3.100 1.00 21.23 H new ATOM 0 HZ2 LYS A 56 0.554 -16.036 -4.572 1.00 21.23 H new ATOM 0 HZ3 LYS A 56 2.124 -15.941 -3.931 1.00 21.23 H new ATOM 877 N GLU A 57 6.537 -11.812 -2.126 1.00 41.41 N ATOM 878 CA GLU A 57 7.621 -11.747 -1.155 1.00 15.02 C ATOM 879 C GLU A 57 7.544 -10.424 -0.390 1.00 3.21 C ATOM 880 O GLU A 57 7.542 -10.399 0.838 1.00 21.43 O ATOM 881 CB GLU A 57 8.941 -11.818 -1.938 1.00 15.33 C ATOM 882 CG GLU A 57 10.202 -11.960 -1.063 1.00 62.22 C ATOM 883 CD GLU A 57 10.511 -13.395 -0.600 1.00 72.53 C ATOM 884 OE1 GLU A 57 10.322 -14.328 -1.417 1.00 72.14 O ATOM 885 OE2 GLU A 57 11.044 -13.590 0.519 1.00 3.41 O ATOM 0 H GLU A 57 6.885 -11.899 -3.081 1.00 41.41 H new ATOM 0 HA GLU A 57 7.553 -12.566 -0.439 1.00 15.02 H new ATOM 0 HB2 GLU A 57 8.895 -12.663 -2.625 1.00 15.33 H new ATOM 0 HB3 GLU A 57 9.036 -10.918 -2.545 1.00 15.33 H new ATOM 0 HG2 GLU A 57 11.058 -11.582 -1.621 1.00 62.22 H new ATOM 0 HG3 GLU A 57 10.089 -11.326 -0.183 1.00 62.22 H new ATOM 892 N LYS A 58 7.487 -9.307 -1.120 1.00 40.35 N ATOM 893 CA LYS A 58 7.393 -7.974 -0.543 1.00 53.23 C ATOM 894 C LYS A 58 5.920 -7.643 -0.408 1.00 15.02 C ATOM 895 O LYS A 58 5.392 -6.778 -1.104 1.00 1.13 O ATOM 896 CB LYS A 58 8.176 -6.932 -1.352 1.00 53.02 C ATOM 897 CG LYS A 58 7.821 -6.861 -2.835 1.00 1.01 C ATOM 898 CD LYS A 58 9.092 -7.011 -3.649 1.00 72.44 C ATOM 899 CE LYS A 58 9.510 -8.481 -3.657 1.00 74.35 C ATOM 900 NZ LYS A 58 10.744 -8.678 -4.425 1.00 73.24 N ATOM 0 H LYS A 58 7.505 -9.309 -2.140 1.00 40.35 H new ATOM 0 HA LYS A 58 7.861 -7.953 0.441 1.00 53.23 H new ATOM 0 HB2 LYS A 58 8.010 -5.951 -0.908 1.00 53.02 H new ATOM 0 HB3 LYS A 58 9.240 -7.148 -1.259 1.00 53.02 H new ATOM 0 HG2 LYS A 58 7.113 -7.649 -3.092 1.00 1.01 H new ATOM 0 HG3 LYS A 58 7.337 -5.911 -3.062 1.00 1.01 H new ATOM 0 HD2 LYS A 58 8.929 -6.661 -4.668 1.00 72.44 H new ATOM 0 HD3 LYS A 58 9.886 -6.397 -3.224 1.00 72.44 H new ATOM 0 HE2 LYS A 58 9.657 -8.825 -2.633 1.00 74.35 H new ATOM 0 HE3 LYS A 58 8.711 -9.086 -4.086 1.00 74.35 H new ATOM 0 HZ1 LYS A 58 11.022 -9.679 -4.385 1.00 73.24 H new ATOM 0 HZ2 LYS A 58 10.584 -8.403 -5.415 1.00 73.24 H new ATOM 0 HZ3 LYS A 58 11.502 -8.092 -4.021 1.00 73.24 H new ATOM 914 N TRP A 59 5.257 -8.380 0.469 1.00 15.13 N ATOM 915 CA TRP A 59 3.944 -8.010 0.958 1.00 3.23 C ATOM 916 C TRP A 59 4.027 -7.768 2.469 1.00 60.41 C ATOM 917 O TRP A 59 3.824 -8.707 3.241 1.00 20.20 O ATOM 918 CB TRP A 59 2.905 -9.048 0.548 1.00 24.21 C ATOM 919 CG TRP A 59 1.504 -8.559 0.720 1.00 53.05 C ATOM 920 CD1 TRP A 59 0.729 -8.738 1.810 1.00 42.41 C ATOM 921 CD2 TRP A 59 0.734 -7.705 -0.176 1.00 21.14 C ATOM 922 NE1 TRP A 59 -0.483 -8.104 1.620 1.00 33.54 N ATOM 923 CE2 TRP A 59 -0.557 -7.495 0.385 1.00 2.13 C ATOM 924 CE3 TRP A 59 0.991 -7.109 -1.424 1.00 24.34 C ATOM 925 CZ2 TRP A 59 -1.550 -6.761 -0.287 1.00 34.20 C ATOM 926 CZ3 TRP A 59 0.017 -6.362 -2.103 1.00 14.20 C ATOM 927 CH2 TRP A 59 -1.255 -6.193 -1.537 1.00 54.11 C ATOM 0 H TRP A 59 5.616 -9.251 0.860 1.00 15.13 H new ATOM 0 HA TRP A 59 3.610 -7.078 0.503 1.00 3.23 H new ATOM 0 HB2 TRP A 59 3.064 -9.323 -0.495 1.00 24.21 H new ATOM 0 HB3 TRP A 59 3.046 -9.951 1.141 1.00 24.21 H new ATOM 0 HD1 TRP A 59 1.012 -9.291 2.693 1.00 42.41 H new ATOM 0 HE1 TRP A 59 -1.234 -8.088 2.310 1.00 33.54 H new ATOM 0 HE3 TRP A 59 1.966 -7.230 -1.872 1.00 24.34 H new ATOM 0 HZ2 TRP A 59 -2.528 -6.635 0.153 1.00 34.20 H new ATOM 0 HZ3 TRP A 59 0.246 -5.918 -3.060 1.00 14.20 H new ATOM 0 HH2 TRP A 59 -2.008 -5.625 -2.063 1.00 54.11 H new ATOM 938 N PRO A 60 4.399 -6.555 2.908 1.00 22.21 N ATOM 939 CA PRO A 60 4.038 -6.102 4.243 1.00 71.41 C ATOM 940 C PRO A 60 2.513 -6.101 4.351 1.00 21.41 C ATOM 941 O PRO A 60 1.817 -5.708 3.413 1.00 1.04 O ATOM 942 CB PRO A 60 4.636 -4.700 4.413 1.00 51.01 C ATOM 943 CG PRO A 60 5.238 -4.328 3.061 1.00 61.45 C ATOM 944 CD PRO A 60 4.856 -5.442 2.096 1.00 72.24 C ATOM 0 HA PRO A 60 4.423 -6.749 5.031 1.00 71.41 H new ATOM 0 HB2 PRO A 60 3.870 -3.983 4.709 1.00 51.01 H new ATOM 0 HB3 PRO A 60 5.397 -4.693 5.193 1.00 51.01 H new ATOM 0 HG2 PRO A 60 4.854 -3.368 2.716 1.00 61.45 H new ATOM 0 HG3 PRO A 60 6.321 -4.231 3.132 1.00 61.45 H new ATOM 0 HD2 PRO A 60 4.072 -5.112 1.414 1.00 72.24 H new ATOM 0 HD3 PRO A 60 5.709 -5.734 1.484 1.00 72.24 H new ATOM 952 N LEU A 61 1.982 -6.593 5.463 1.00 40.03 N ATOM 953 CA LEU A 61 0.562 -6.548 5.774 1.00 52.23 C ATOM 954 C LEU A 61 0.207 -5.121 6.171 1.00 52.21 C ATOM 955 O LEU A 61 0.578 -4.673 7.257 1.00 40.22 O ATOM 956 CB LEU A 61 0.242 -7.529 6.910 1.00 50.03 C ATOM 957 CG LEU A 61 0.402 -9.001 6.495 1.00 63.34 C ATOM 958 CD1 LEU A 61 0.368 -9.881 7.740 1.00 63.52 C ATOM 959 CD2 LEU A 61 -0.695 -9.445 5.522 1.00 22.42 C ATOM 0 H LEU A 61 2.540 -7.044 6.188 1.00 40.03 H new ATOM 0 HA LEU A 61 -0.028 -6.842 4.906 1.00 52.23 H new ATOM 0 HB2 LEU A 61 0.897 -7.323 7.756 1.00 50.03 H new ATOM 0 HB3 LEU A 61 -0.780 -7.362 7.250 1.00 50.03 H new ATOM 0 HG LEU A 61 1.359 -9.104 5.983 1.00 63.34 H new ATOM 0 HD11 LEU A 61 0.481 -10.926 7.450 1.00 63.52 H new ATOM 0 HD12 LEU A 61 1.183 -9.599 8.407 1.00 63.52 H new ATOM 0 HD13 LEU A 61 -0.584 -9.748 8.254 1.00 63.52 H new ATOM 0 HD21 LEU A 61 -0.543 -10.491 5.255 1.00 22.42 H new ATOM 0 HD22 LEU A 61 -1.670 -9.329 5.995 1.00 22.42 H new ATOM 0 HD23 LEU A 61 -0.653 -8.831 4.622 1.00 22.42 H new ATOM 971 N LEU A 62 -0.470 -4.382 5.289 1.00 4.00 N ATOM 972 CA LEU A 62 -0.950 -3.048 5.641 1.00 63.35 C ATOM 973 C LEU A 62 -2.149 -3.168 6.584 1.00 32.50 C ATOM 974 O LEU A 62 -2.764 -4.235 6.691 1.00 51.03 O ATOM 975 CB LEU A 62 -1.287 -2.211 4.391 1.00 41.34 C ATOM 976 CG LEU A 62 -0.275 -1.097 4.049 1.00 41.03 C ATOM 977 CD1 LEU A 62 -0.014 -0.119 5.196 1.00 62.21 C ATOM 978 CD2 LEU A 62 1.060 -1.663 3.566 1.00 11.11 C ATOM 0 H LEU A 62 -0.695 -4.681 4.340 1.00 4.00 H new ATOM 0 HA LEU A 62 -0.151 -2.516 6.157 1.00 63.35 H new ATOM 0 HB2 LEU A 62 -1.366 -2.882 3.536 1.00 41.34 H new ATOM 0 HB3 LEU A 62 -2.268 -1.757 4.532 1.00 41.34 H new ATOM 0 HG LEU A 62 -0.753 -0.540 3.243 1.00 41.03 H new ATOM 0 HD11 LEU A 62 0.708 0.633 4.876 1.00 62.21 H new ATOM 0 HD12 LEU A 62 -0.947 0.370 5.477 1.00 62.21 H new ATOM 0 HD13 LEU A 62 0.384 -0.662 6.054 1.00 62.21 H new ATOM 0 HD21 LEU A 62 1.741 -0.843 3.337 1.00 11.11 H new ATOM 0 HD22 LEU A 62 1.494 -2.288 4.346 1.00 11.11 H new ATOM 0 HD23 LEU A 62 0.898 -2.262 2.670 1.00 11.11 H new ATOM 990 N ASP A 63 -2.478 -2.064 7.251 1.00 55.15 N ATOM 991 CA ASP A 63 -3.325 -2.002 8.441 1.00 14.43 C ATOM 992 C ASP A 63 -4.272 -0.802 8.396 1.00 22.21 C ATOM 993 O ASP A 63 -4.299 -0.055 7.415 1.00 13.42 O ATOM 994 CB ASP A 63 -2.441 -1.946 9.698 1.00 51.24 C ATOM 995 CG ASP A 63 -1.420 -0.812 9.688 1.00 51.25 C ATOM 996 OD1 ASP A 63 -1.846 0.363 9.584 1.00 53.13 O ATOM 997 OD2 ASP A 63 -0.212 -1.129 9.749 1.00 14.40 O ATOM 0 H ASP A 63 -2.145 -1.144 6.963 1.00 55.15 H new ATOM 0 HA ASP A 63 -3.942 -2.900 8.471 1.00 14.43 H new ATOM 0 HB2 ASP A 63 -3.080 -1.838 10.575 1.00 51.24 H new ATOM 0 HB3 ASP A 63 -1.914 -2.895 9.802 1.00 51.24 H new ATOM 1002 N SER A 64 -5.080 -0.641 9.446 1.00 34.14 N ATOM 1003 CA SER A 64 -6.053 0.436 9.579 1.00 53.05 C ATOM 1004 C SER A 64 -5.416 1.744 10.043 1.00 71.52 C ATOM 1005 O SER A 64 -5.986 2.811 9.819 1.00 21.11 O ATOM 1006 CB SER A 64 -7.101 0.033 10.622 1.00 62.14 C ATOM 1007 OG SER A 64 -7.837 -1.093 10.190 1.00 21.53 O ATOM 0 H SER A 64 -5.073 -1.274 10.246 1.00 34.14 H new ATOM 0 HA SER A 64 -6.494 0.596 8.595 1.00 53.05 H new ATOM 0 HB2 SER A 64 -6.610 -0.190 11.569 1.00 62.14 H new ATOM 0 HB3 SER A 64 -7.779 0.867 10.803 1.00 62.14 H new ATOM 0 HG SER A 64 -8.499 -1.333 10.872 1.00 21.53 H new ATOM 1013 N GLU A 65 -4.269 1.685 10.709 1.00 22.11 N ATOM 1014 CA GLU A 65 -3.733 2.812 11.467 1.00 64.23 C ATOM 1015 C GLU A 65 -2.914 3.705 10.535 1.00 44.13 C ATOM 1016 O GLU A 65 -2.886 4.920 10.731 1.00 40.21 O ATOM 1017 CB GLU A 65 -3.031 2.279 12.744 1.00 24.42 C ATOM 1018 CG GLU A 65 -3.998 1.313 13.469 1.00 54.11 C ATOM 1019 CD GLU A 65 -3.810 1.078 14.971 1.00 33.52 C ATOM 1020 OE1 GLU A 65 -2.703 0.715 15.429 1.00 45.33 O ATOM 1021 OE2 GLU A 65 -4.835 1.149 15.698 1.00 65.51 O ATOM 0 H GLU A 65 -3.681 0.852 10.739 1.00 22.11 H new ATOM 0 HA GLU A 65 -4.509 3.476 11.849 1.00 64.23 H new ATOM 0 HB2 GLU A 65 -2.107 1.764 12.481 1.00 24.42 H new ATOM 0 HB3 GLU A 65 -2.759 3.106 13.400 1.00 24.42 H new ATOM 0 HG2 GLU A 65 -5.012 1.683 13.316 1.00 54.11 H new ATOM 0 HG3 GLU A 65 -3.934 0.345 12.972 1.00 54.11 H new ATOM 1028 N THR A 66 -2.428 3.135 9.429 1.00 4.22 N ATOM 1029 CA THR A 66 -1.959 3.830 8.242 1.00 35.40 C ATOM 1030 C THR A 66 -3.104 4.587 7.533 1.00 31.42 C ATOM 1031 O THR A 66 -2.860 5.600 6.877 1.00 1.34 O ATOM 1032 CB THR A 66 -1.338 2.780 7.292 1.00 15.40 C ATOM 1033 OG1 THR A 66 -0.401 1.933 7.943 1.00 22.24 O ATOM 1034 CG2 THR A 66 -0.633 3.452 6.110 1.00 11.01 C ATOM 0 H THR A 66 -2.350 2.122 9.340 1.00 4.22 H new ATOM 0 HA THR A 66 -1.218 4.576 8.529 1.00 35.40 H new ATOM 0 HB THR A 66 -2.173 2.173 6.942 1.00 15.40 H new ATOM 0 HG1 THR A 66 -0.873 1.179 8.355 1.00 22.24 H new ATOM 0 HG21 THR A 66 -0.206 2.689 5.459 1.00 11.01 H new ATOM 0 HG22 THR A 66 -1.353 4.047 5.548 1.00 11.01 H new ATOM 0 HG23 THR A 66 0.162 4.099 6.481 1.00 11.01 H new ATOM 1042 N MET A 67 -4.359 4.119 7.610 1.00 51.21 N ATOM 1043 CA MET A 67 -5.489 4.657 6.838 1.00 73.31 C ATOM 1044 C MET A 67 -6.081 5.872 7.552 1.00 32.34 C ATOM 1045 O MET A 67 -7.270 5.907 7.882 1.00 62.32 O ATOM 1046 CB MET A 67 -6.554 3.578 6.554 1.00 40.13 C ATOM 1047 CG MET A 67 -5.998 2.398 5.754 1.00 34.43 C ATOM 1048 SD MET A 67 -5.283 2.800 4.133 1.00 63.43 S ATOM 1049 CE MET A 67 -6.773 3.189 3.190 1.00 72.14 C ATOM 0 H MET A 67 -4.621 3.344 8.220 1.00 51.21 H new ATOM 0 HA MET A 67 -5.117 4.982 5.866 1.00 73.31 H new ATOM 0 HB2 MET A 67 -6.958 3.214 7.499 1.00 40.13 H new ATOM 0 HB3 MET A 67 -7.382 4.026 6.005 1.00 40.13 H new ATOM 0 HG2 MET A 67 -5.233 1.906 6.354 1.00 34.43 H new ATOM 0 HG3 MET A 67 -6.800 1.675 5.606 1.00 34.43 H new ATOM 0 HE1 MET A 67 -6.539 3.195 2.125 1.00 72.14 H new ATOM 0 HE2 MET A 67 -7.536 2.437 3.389 1.00 72.14 H new ATOM 0 HE3 MET A 67 -7.144 4.170 3.485 1.00 72.14 H new ATOM 1059 N LYS A 68 -5.237 6.864 7.820 1.00 61.35 N ATOM 1060 CA LYS A 68 -5.574 8.104 8.493 1.00 54.04 C ATOM 1061 C LYS A 68 -5.140 9.263 7.610 1.00 64.23 C ATOM 1062 O LYS A 68 -4.014 9.290 7.106 1.00 34.34 O ATOM 1063 CB LYS A 68 -4.944 8.128 9.901 1.00 35.13 C ATOM 1064 CG LYS A 68 -5.945 7.728 10.990 1.00 43.33 C ATOM 1065 CD LYS A 68 -6.228 6.219 11.037 1.00 41.23 C ATOM 1066 CE LYS A 68 -7.722 5.917 10.882 1.00 51.13 C ATOM 1067 NZ LYS A 68 -7.993 4.465 10.847 1.00 23.30 N ATOM 0 H LYS A 68 -4.252 6.818 7.559 1.00 61.35 H new ATOM 0 HA LYS A 68 -6.649 8.193 8.646 1.00 54.04 H new ATOM 0 HB2 LYS A 68 -4.091 7.450 9.927 1.00 35.13 H new ATOM 0 HB3 LYS A 68 -4.563 9.128 10.110 1.00 35.13 H new ATOM 0 HG2 LYS A 68 -5.563 8.048 11.959 1.00 43.33 H new ATOM 0 HG3 LYS A 68 -6.882 8.260 10.825 1.00 43.33 H new ATOM 0 HD2 LYS A 68 -5.672 5.720 10.244 1.00 41.23 H new ATOM 0 HD3 LYS A 68 -5.871 5.811 11.982 1.00 41.23 H new ATOM 0 HE2 LYS A 68 -8.271 6.368 11.709 1.00 51.13 H new ATOM 0 HE3 LYS A 68 -8.092 6.377 9.965 1.00 51.13 H new ATOM 0 HZ1 LYS A 68 -8.750 4.270 10.161 1.00 23.30 H new ATOM 0 HZ2 LYS A 68 -7.130 3.958 10.564 1.00 23.30 H new ATOM 0 HZ3 LYS A 68 -8.289 4.144 11.791 1.00 23.30 H new ATOM 1081 N GLU A 69 -6.062 10.194 7.387 1.00 32.32 N ATOM 1082 CA GLU A 69 -5.875 11.390 6.589 1.00 11.34 C ATOM 1083 C GLU A 69 -5.579 12.558 7.538 1.00 11.11 C ATOM 1084 O GLU A 69 -6.439 12.889 8.359 1.00 3.23 O ATOM 1085 CB GLU A 69 -7.148 11.673 5.760 1.00 23.24 C ATOM 1086 CG GLU A 69 -7.483 10.647 4.661 1.00 23.32 C ATOM 1087 CD GLU A 69 -8.468 9.541 5.072 1.00 71.54 C ATOM 1088 OE1 GLU A 69 -8.088 8.654 5.872 1.00 75.45 O ATOM 1089 OE2 GLU A 69 -9.570 9.449 4.483 1.00 41.42 O ATOM 0 H GLU A 69 -7.002 10.127 7.778 1.00 32.32 H new ATOM 0 HA GLU A 69 -5.043 11.259 5.897 1.00 11.34 H new ATOM 0 HB2 GLU A 69 -7.996 11.734 6.443 1.00 23.24 H new ATOM 0 HB3 GLU A 69 -7.043 12.653 5.294 1.00 23.24 H new ATOM 0 HG2 GLU A 69 -7.897 11.179 3.804 1.00 23.32 H new ATOM 0 HG3 GLU A 69 -6.556 10.180 4.329 1.00 23.32 H new ATOM 1096 N GLU A 70 -4.408 13.194 7.422 1.00 40.03 N ATOM 1097 CA GLU A 70 -4.021 14.413 8.143 1.00 61.12 C ATOM 1098 C GLU A 70 -3.041 15.195 7.244 1.00 20.11 C ATOM 1099 O GLU A 70 -2.467 14.624 6.312 1.00 52.11 O ATOM 1100 CB GLU A 70 -3.346 14.035 9.481 1.00 54.45 C ATOM 1101 CG GLU A 70 -3.290 15.136 10.560 1.00 60.53 C ATOM 1102 CD GLU A 70 -4.637 15.375 11.255 1.00 62.23 C ATOM 1103 OE1 GLU A 70 -5.170 14.443 11.895 1.00 4.30 O ATOM 1104 OE2 GLU A 70 -5.176 16.507 11.132 1.00 32.10 O ATOM 0 H GLU A 70 -3.674 12.860 6.798 1.00 40.03 H new ATOM 0 HA GLU A 70 -4.894 15.026 8.368 1.00 61.12 H new ATOM 0 HB2 GLU A 70 -3.872 13.176 9.897 1.00 54.45 H new ATOM 0 HB3 GLU A 70 -2.326 13.713 9.269 1.00 54.45 H new ATOM 0 HG2 GLU A 70 -2.546 14.863 11.309 1.00 60.53 H new ATOM 0 HG3 GLU A 70 -2.955 16.067 10.102 1.00 60.53 H new ATOM 1111 N ARG A 71 -2.828 16.486 7.522 1.00 11.13 N ATOM 1112 CA ARG A 71 -1.993 17.424 6.778 1.00 31.24 C ATOM 1113 C ARG A 71 -1.047 18.134 7.756 1.00 1.11 C ATOM 1114 O ARG A 71 -1.259 19.294 8.109 1.00 1.10 O ATOM 1115 CB ARG A 71 -2.931 18.398 6.042 1.00 60.43 C ATOM 1116 CG ARG A 71 -2.197 19.096 4.900 1.00 1.22 C ATOM 1117 CD ARG A 71 -2.818 20.433 4.490 1.00 2.34 C ATOM 1118 NE ARG A 71 -4.177 20.281 3.942 1.00 11.11 N ATOM 1119 CZ ARG A 71 -5.088 21.259 3.855 1.00 2.11 C ATOM 1120 NH1 ARG A 71 -4.835 22.467 4.357 1.00 74.23 N ATOM 1121 NH2 ARG A 71 -6.262 21.034 3.280 1.00 43.04 N ATOM 0 H ARG A 71 -3.267 16.929 8.329 1.00 11.13 H new ATOM 0 HA ARG A 71 -1.368 16.923 6.038 1.00 31.24 H new ATOM 0 HB2 ARG A 71 -3.791 17.856 5.650 1.00 60.43 H new ATOM 0 HB3 ARG A 71 -3.314 19.140 6.742 1.00 60.43 H new ATOM 0 HG2 ARG A 71 -1.161 19.263 5.195 1.00 1.22 H new ATOM 0 HG3 ARG A 71 -2.179 18.434 4.034 1.00 1.22 H new ATOM 0 HD2 ARG A 71 -2.851 21.095 5.355 1.00 2.34 H new ATOM 0 HD3 ARG A 71 -2.182 20.912 3.746 1.00 2.34 H new ATOM 0 HE ARG A 71 -4.445 19.358 3.602 1.00 11.11 H new ATOM 0 HH11 ARG A 71 -3.941 22.653 4.812 1.00 74.23 H new ATOM 0 HH12 ARG A 71 -5.535 23.206 4.286 1.00 74.23 H new ATOM 0 HH21 ARG A 71 -6.476 20.112 2.901 1.00 43.04 H new ATOM 0 HH22 ARG A 71 -6.951 21.783 3.217 1.00 43.04 H new ATOM 1135 N ILE A 72 -0.042 17.421 8.251 1.00 61.31 N ATOM 1136 CA ILE A 72 0.937 17.894 9.219 1.00 4.22 C ATOM 1137 C ILE A 72 1.831 18.944 8.546 1.00 61.32 C ATOM 1138 O ILE A 72 2.768 18.612 7.822 1.00 21.50 O ATOM 1139 CB ILE A 72 1.763 16.716 9.799 1.00 3.04 C ATOM 1140 CG1 ILE A 72 0.904 15.483 10.178 1.00 35.31 C ATOM 1141 CG2 ILE A 72 2.498 17.203 11.058 1.00 3.13 C ATOM 1142 CD1 ILE A 72 0.914 14.407 9.086 1.00 4.12 C ATOM 0 H ILE A 72 0.119 16.452 7.975 1.00 61.31 H new ATOM 0 HA ILE A 72 0.425 18.357 10.063 1.00 4.22 H new ATOM 0 HB ILE A 72 2.453 16.398 9.017 1.00 3.04 H new ATOM 0 HG12 ILE A 72 1.277 15.056 11.109 1.00 35.31 H new ATOM 0 HG13 ILE A 72 -0.122 15.801 10.362 1.00 35.31 H new ATOM 0 HG21 ILE A 72 3.083 16.385 11.477 1.00 3.13 H new ATOM 0 HG22 ILE A 72 3.162 18.027 10.796 1.00 3.13 H new ATOM 0 HG23 ILE A 72 1.771 17.543 11.795 1.00 3.13 H new ATOM 0 HD11 ILE A 72 0.298 13.564 9.400 1.00 4.12 H new ATOM 0 HD12 ILE A 72 0.515 14.824 8.161 1.00 4.12 H new ATOM 0 HD13 ILE A 72 1.936 14.067 8.920 1.00 4.12 H new ATOM 1154 N THR A 73 1.555 20.223 8.773 1.00 20.34 N ATOM 1155 CA THR A 73 2.454 21.294 8.371 1.00 75.55 C ATOM 1156 C THR A 73 3.696 21.216 9.269 1.00 3.03 C ATOM 1157 O THR A 73 3.556 21.102 10.490 1.00 3.30 O ATOM 1158 CB THR A 73 1.681 22.628 8.394 1.00 11.14 C ATOM 1159 OG1 THR A 73 2.497 23.717 8.024 1.00 3.42 O ATOM 1160 CG2 THR A 73 0.949 22.972 9.697 1.00 40.42 C ATOM 0 H THR A 73 0.706 20.544 9.238 1.00 20.34 H new ATOM 0 HA THR A 73 2.816 21.203 7.347 1.00 75.55 H new ATOM 0 HB THR A 73 0.900 22.458 7.653 1.00 11.14 H new ATOM 0 HG1 THR A 73 1.971 24.543 8.049 1.00 3.42 H new ATOM 0 HG21 THR A 73 0.444 23.932 9.588 1.00 40.42 H new ATOM 0 HG22 THR A 73 0.213 22.198 9.916 1.00 40.42 H new ATOM 0 HG23 THR A 73 1.668 23.031 10.514 1.00 40.42 H new ATOM 1168 N GLN A 74 4.904 21.210 8.696 1.00 40.24 N ATOM 1169 CA GLN A 74 6.166 21.206 9.419 1.00 44.41 C ATOM 1170 C GLN A 74 7.080 22.308 8.904 1.00 0.22 C ATOM 1171 O GLN A 74 6.899 22.831 7.803 1.00 15.42 O ATOM 1172 CB GLN A 74 6.872 19.845 9.311 1.00 33.10 C ATOM 1173 CG GLN A 74 5.921 18.671 9.568 1.00 23.30 C ATOM 1174 CD GLN A 74 6.642 17.337 9.772 1.00 15.41 C ATOM 1175 OE1 GLN A 74 7.785 17.283 10.215 1.00 53.31 O ATOM 1176 NE2 GLN A 74 5.984 16.231 9.471 1.00 4.44 N ATOM 0 H GLN A 74 5.027 21.208 7.683 1.00 40.24 H new ATOM 0 HA GLN A 74 5.943 21.390 10.470 1.00 44.41 H new ATOM 0 HB2 GLN A 74 7.310 19.744 8.318 1.00 33.10 H new ATOM 0 HB3 GLN A 74 7.693 19.807 10.027 1.00 33.10 H new ATOM 0 HG2 GLN A 74 5.318 18.888 10.450 1.00 23.30 H new ATOM 0 HG3 GLN A 74 5.234 18.579 8.727 1.00 23.30 H new ATOM 0 HE21 GLN A 74 5.034 16.287 9.103 1.00 4.44 H new ATOM 0 HE22 GLN A 74 6.426 15.322 9.606 1.00 4.44 H new ATOM 1185 N GLU A 75 8.111 22.612 9.689 1.00 0.34 N ATOM 1186 CA GLU A 75 9.050 23.701 9.434 1.00 43.21 C ATOM 1187 C GLU A 75 10.454 23.177 9.091 1.00 13.14 C ATOM 1188 O GLU A 75 11.348 23.956 8.753 1.00 72.14 O ATOM 1189 CB GLU A 75 9.081 24.631 10.647 1.00 40.32 C ATOM 1190 CG GLU A 75 7.717 25.269 10.933 1.00 63.52 C ATOM 1191 CD GLU A 75 7.097 25.967 9.720 1.00 4.32 C ATOM 1192 OE1 GLU A 75 7.655 26.968 9.223 1.00 3.42 O ATOM 1193 OE2 GLU A 75 6.034 25.506 9.241 1.00 40.14 O ATOM 0 H GLU A 75 8.322 22.094 10.542 1.00 0.34 H new ATOM 0 HA GLU A 75 8.710 24.260 8.562 1.00 43.21 H new ATOM 0 HB2 GLU A 75 9.407 24.070 11.523 1.00 40.32 H new ATOM 0 HB3 GLU A 75 9.818 25.417 10.480 1.00 40.32 H new ATOM 0 HG2 GLU A 75 7.032 24.498 11.287 1.00 63.52 H new ATOM 0 HG3 GLU A 75 7.827 25.993 11.741 1.00 63.52 H new ATOM 1200 N GLU A 76 10.650 21.859 9.160 1.00 24.10 N ATOM 1201 CA GLU A 76 11.917 21.160 8.952 1.00 73.21 C ATOM 1202 C GLU A 76 11.750 20.015 7.943 1.00 73.33 C ATOM 1203 O GLU A 76 12.386 18.963 8.061 1.00 12.42 O ATOM 1204 CB GLU A 76 12.474 20.668 10.298 1.00 55.04 C ATOM 1205 CG GLU A 76 12.732 21.802 11.303 1.00 15.33 C ATOM 1206 CD GLU A 76 13.503 21.334 12.541 1.00 72.45 C ATOM 1207 OE1 GLU A 76 13.984 20.182 12.591 1.00 32.23 O ATOM 1208 OE2 GLU A 76 13.725 22.140 13.471 1.00 60.22 O ATOM 0 H GLU A 76 9.887 21.217 9.374 1.00 24.10 H new ATOM 0 HA GLU A 76 12.641 21.854 8.526 1.00 73.21 H new ATOM 0 HB2 GLU A 76 11.772 19.958 10.735 1.00 55.04 H new ATOM 0 HB3 GLU A 76 13.405 20.129 10.122 1.00 55.04 H new ATOM 0 HG2 GLU A 76 13.292 22.597 10.811 1.00 15.33 H new ATOM 0 HG3 GLU A 76 11.779 22.229 11.614 1.00 15.33 H new ATOM 1215 N GLY A 77 10.873 20.181 6.952 1.00 55.13 N ATOM 1216 CA GLY A 77 10.692 19.175 5.920 1.00 51.42 C ATOM 1217 C GLY A 77 9.753 19.660 4.838 1.00 60.22 C ATOM 1218 O GLY A 77 10.160 19.767 3.681 1.00 2.01 O ATOM 0 H GLY A 77 10.280 21.004 6.847 1.00 55.13 H new ATOM 0 HA2 GLY A 77 11.657 18.924 5.481 1.00 51.42 H new ATOM 0 HA3 GLY A 77 10.297 18.262 6.365 1.00 51.42 H new ATOM 1222 N GLY A 78 8.517 19.961 5.221 1.00 74.54 N ATOM 1223 CA GLY A 78 7.461 20.314 4.302 1.00 61.34 C ATOM 1224 C GLY A 78 6.107 20.211 4.986 1.00 40.03 C ATOM 1225 O GLY A 78 6.016 20.115 6.212 1.00 63.34 O ATOM 0 H GLY A 78 8.224 19.964 6.198 1.00 74.54 H new ATOM 0 HA2 GLY A 78 7.614 21.329 3.935 1.00 61.34 H new ATOM 0 HA3 GLY A 78 7.489 19.654 3.435 1.00 61.34 H new ATOM 1229 N ILE A 79 5.041 20.160 4.195 1.00 54.44 N ATOM 1230 CA ILE A 79 3.724 19.760 4.660 1.00 2.01 C ATOM 1231 C ILE A 79 3.627 18.259 4.445 1.00 20.33 C ATOM 1232 O ILE A 79 3.428 17.837 3.313 1.00 31.34 O ATOM 1233 CB ILE A 79 2.623 20.563 3.938 1.00 72.33 C ATOM 1234 CG1 ILE A 79 2.815 22.082 4.148 1.00 62.34 C ATOM 1235 CG2 ILE A 79 1.237 20.121 4.441 1.00 52.14 C ATOM 1236 CD1 ILE A 79 1.828 22.908 3.323 1.00 40.22 C ATOM 0 H ILE A 79 5.070 20.398 3.204 1.00 54.44 H new ATOM 0 HA ILE A 79 3.578 19.978 5.718 1.00 2.01 H new ATOM 0 HB ILE A 79 2.694 20.362 2.869 1.00 72.33 H new ATOM 0 HG12 ILE A 79 2.691 22.320 5.205 1.00 62.34 H new ATOM 0 HG13 ILE A 79 3.834 22.359 3.877 1.00 62.34 H new ATOM 0 HG21 ILE A 79 0.464 20.692 3.927 1.00 52.14 H new ATOM 0 HG22 ILE A 79 1.098 19.059 4.239 1.00 52.14 H new ATOM 0 HG23 ILE A 79 1.166 20.298 5.514 1.00 52.14 H new ATOM 0 HD11 ILE A 79 2.001 23.969 3.504 1.00 40.22 H new ATOM 0 HD12 ILE A 79 1.969 22.692 2.264 1.00 40.22 H new ATOM 0 HD13 ILE A 79 0.809 22.653 3.613 1.00 40.22 H new ATOM 1248 N TYR A 80 3.842 17.453 5.485 1.00 61.41 N ATOM 1249 CA TYR A 80 3.621 16.019 5.387 1.00 32.22 C ATOM 1250 C TYR A 80 2.116 15.821 5.369 1.00 74.22 C ATOM 1251 O TYR A 80 1.437 16.192 6.326 1.00 63.15 O ATOM 1252 CB TYR A 80 4.269 15.245 6.544 1.00 55.23 C ATOM 1253 CG TYR A 80 4.664 13.844 6.114 1.00 1.42 C ATOM 1254 CD1 TYR A 80 5.847 13.667 5.375 1.00 1.00 C ATOM 1255 CD2 TYR A 80 3.838 12.734 6.380 1.00 14.24 C ATOM 1256 CE1 TYR A 80 6.210 12.399 4.899 1.00 42.41 C ATOM 1257 CE2 TYR A 80 4.195 11.457 5.906 1.00 4.41 C ATOM 1258 CZ TYR A 80 5.379 11.286 5.152 1.00 11.40 C ATOM 1259 OH TYR A 80 5.721 10.059 4.680 1.00 23.54 O ATOM 0 H TYR A 80 4.167 17.771 6.398 1.00 61.41 H new ATOM 0 HA TYR A 80 4.087 15.626 4.483 1.00 32.22 H new ATOM 0 HB2 TYR A 80 5.150 15.782 6.896 1.00 55.23 H new ATOM 0 HB3 TYR A 80 3.574 15.189 7.382 1.00 55.23 H new ATOM 0 HD1 TYR A 80 6.483 14.516 5.172 1.00 1.00 H new ATOM 0 HD2 TYR A 80 2.929 12.863 6.949 1.00 14.24 H new ATOM 0 HE1 TYR A 80 7.125 12.274 4.339 1.00 42.41 H new ATOM 0 HE2 TYR A 80 3.564 10.607 6.119 1.00 4.41 H new ATOM 0 HH TYR A 80 5.041 9.405 4.945 1.00 23.54 H new ATOM 1269 N VAL A 81 1.559 15.291 4.293 1.00 55.03 N ATOM 1270 CA VAL A 81 0.133 15.061 4.180 1.00 42.23 C ATOM 1271 C VAL A 81 -0.127 13.673 3.632 1.00 53.01 C ATOM 1272 O VAL A 81 0.638 13.139 2.830 1.00 60.42 O ATOM 1273 CB VAL A 81 -0.563 16.242 3.491 1.00 43.23 C ATOM 1274 CG1 VAL A 81 0.115 16.823 2.267 1.00 33.41 C ATOM 1275 CG2 VAL A 81 -2.031 15.942 3.139 1.00 41.03 C ATOM 0 H VAL A 81 2.089 15.007 3.469 1.00 55.03 H new ATOM 0 HA VAL A 81 -0.346 15.045 5.159 1.00 42.23 H new ATOM 0 HB VAL A 81 -0.494 17.007 4.264 1.00 43.23 H new ATOM 0 HG11 VAL A 81 -0.481 17.649 1.879 1.00 33.41 H new ATOM 0 HG12 VAL A 81 1.106 17.186 2.538 1.00 33.41 H new ATOM 0 HG13 VAL A 81 0.208 16.052 1.502 1.00 33.41 H new ATOM 0 HG21 VAL A 81 -2.474 16.812 2.654 1.00 41.03 H new ATOM 0 HG22 VAL A 81 -2.076 15.088 2.464 1.00 41.03 H new ATOM 0 HG23 VAL A 81 -2.584 15.714 4.050 1.00 41.03 H new ATOM 1285 N SER A 82 -1.235 13.109 4.096 1.00 75.33 N ATOM 1286 CA SER A 82 -1.773 11.845 3.664 1.00 71.24 C ATOM 1287 C SER A 82 -3.193 12.173 3.212 1.00 42.04 C ATOM 1288 O SER A 82 -4.046 12.557 4.026 1.00 72.53 O ATOM 1289 CB SER A 82 -1.719 10.823 4.811 1.00 43.42 C ATOM 1290 OG SER A 82 -0.574 11.016 5.630 1.00 63.33 O ATOM 0 H SER A 82 -1.803 13.550 4.819 1.00 75.33 H new ATOM 0 HA SER A 82 -1.209 11.383 2.854 1.00 71.24 H new ATOM 0 HB2 SER A 82 -2.620 10.909 5.418 1.00 43.42 H new ATOM 0 HB3 SER A 82 -1.707 9.814 4.400 1.00 43.42 H new ATOM 0 HG SER A 82 -0.571 10.351 6.350 1.00 63.33 H new ATOM 1296 N LYS A 83 -3.450 12.138 1.907 1.00 3.00 N ATOM 1297 CA LYS A 83 -4.776 12.387 1.352 1.00 22.14 C ATOM 1298 C LYS A 83 -4.973 11.453 0.166 1.00 24.14 C ATOM 1299 O LYS A 83 -4.111 10.636 -0.161 1.00 51.12 O ATOM 1300 CB LYS A 83 -4.976 13.887 1.016 1.00 72.14 C ATOM 1301 CG LYS A 83 -4.168 14.377 -0.190 1.00 15.22 C ATOM 1302 CD LYS A 83 -4.387 15.853 -0.571 1.00 42.05 C ATOM 1303 CE LYS A 83 -3.631 16.802 0.361 1.00 44.21 C ATOM 1304 NZ LYS A 83 -3.511 18.168 -0.192 1.00 63.35 N ATOM 0 H LYS A 83 -2.741 11.935 1.202 1.00 3.00 H new ATOM 0 HA LYS A 83 -5.552 12.168 2.086 1.00 22.14 H new ATOM 0 HB2 LYS A 83 -6.034 14.067 0.827 1.00 72.14 H new ATOM 0 HB3 LYS A 83 -4.703 14.482 1.887 1.00 72.14 H new ATOM 0 HG2 LYS A 83 -3.109 14.225 0.017 1.00 15.22 H new ATOM 0 HG3 LYS A 83 -4.417 13.756 -1.050 1.00 15.22 H new ATOM 0 HD2 LYS A 83 -4.059 16.015 -1.598 1.00 42.05 H new ATOM 0 HD3 LYS A 83 -5.452 16.083 -0.536 1.00 42.05 H new ATOM 0 HE2 LYS A 83 -4.144 16.847 1.322 1.00 44.21 H new ATOM 0 HE3 LYS A 83 -2.635 16.402 0.550 1.00 44.21 H new ATOM 0 HZ1 LYS A 83 -2.991 18.770 0.478 1.00 63.35 H new ATOM 0 HZ2 LYS A 83 -2.998 18.133 -1.096 1.00 63.35 H new ATOM 0 HZ3 LYS A 83 -4.460 18.564 -0.348 1.00 63.35 H new ATOM 1318 N PHE A 84 -6.150 11.515 -0.444 1.00 60.52 N ATOM 1319 CA PHE A 84 -6.338 10.885 -1.741 1.00 21.22 C ATOM 1320 C PHE A 84 -6.027 11.909 -2.828 1.00 20.23 C ATOM 1321 O PHE A 84 -6.394 13.078 -2.667 1.00 22.31 O ATOM 1322 CB PHE A 84 -7.764 10.334 -1.871 1.00 2.34 C ATOM 1323 CG PHE A 84 -8.069 9.212 -0.901 1.00 22.32 C ATOM 1324 CD1 PHE A 84 -8.412 9.496 0.434 1.00 42.35 C ATOM 1325 CD2 PHE A 84 -7.978 7.874 -1.322 1.00 35.54 C ATOM 1326 CE1 PHE A 84 -8.590 8.446 1.346 1.00 35.30 C ATOM 1327 CE2 PHE A 84 -8.185 6.825 -0.412 1.00 53.32 C ATOM 1328 CZ PHE A 84 -8.462 7.113 0.931 1.00 11.34 C ATOM 0 H PHE A 84 -6.973 11.986 -0.069 1.00 60.52 H new ATOM 0 HA PHE A 84 -5.660 10.038 -1.849 1.00 21.22 H new ATOM 0 HB2 PHE A 84 -8.474 11.145 -1.711 1.00 2.34 H new ATOM 0 HB3 PHE A 84 -7.915 9.975 -2.889 1.00 2.34 H new ATOM 0 HD1 PHE A 84 -8.538 10.519 0.755 1.00 42.35 H new ATOM 0 HD2 PHE A 84 -7.747 7.651 -2.353 1.00 35.54 H new ATOM 0 HE1 PHE A 84 -8.828 8.666 2.376 1.00 35.30 H new ATOM 0 HE2 PHE A 84 -8.131 5.799 -0.746 1.00 53.32 H new ATOM 0 HZ PHE A 84 -8.577 6.310 1.644 1.00 11.34 H new ATOM 1338 N THR A 85 -5.427 11.497 -3.945 1.00 21.23 N ATOM 1339 CA THR A 85 -5.461 12.315 -5.161 1.00 51.14 C ATOM 1340 C THR A 85 -6.881 12.287 -5.752 1.00 20.23 C ATOM 1341 O THR A 85 -7.343 13.273 -6.330 1.00 54.11 O ATOM 1342 CB THR A 85 -4.422 11.844 -6.203 1.00 71.45 C ATOM 1343 OG1 THR A 85 -4.871 10.658 -6.806 1.00 33.24 O ATOM 1344 CG2 THR A 85 -3.020 11.570 -5.638 1.00 60.34 C ATOM 0 H THR A 85 -4.919 10.617 -4.035 1.00 21.23 H new ATOM 0 HA THR A 85 -5.197 13.338 -4.895 1.00 51.14 H new ATOM 0 HB THR A 85 -4.330 12.670 -6.908 1.00 71.45 H new ATOM 0 HG1 THR A 85 -4.300 10.445 -7.574 1.00 33.24 H new ATOM 0 HG21 THR A 85 -2.361 11.245 -6.443 1.00 60.34 H new ATOM 0 HG22 THR A 85 -2.624 12.481 -5.190 1.00 60.34 H new ATOM 0 HG23 THR A 85 -3.079 10.789 -4.880 1.00 60.34 H new ATOM 1352 N LEU A 86 -7.577 11.149 -5.602 1.00 51.23 N ATOM 1353 CA LEU A 86 -8.718 10.771 -6.419 1.00 12.05 C ATOM 1354 C LEU A 86 -9.821 10.194 -5.541 1.00 13.43 C ATOM 1355 O LEU A 86 -9.570 9.329 -4.695 1.00 62.53 O ATOM 1356 CB LEU A 86 -8.259 9.738 -7.461 1.00 35.23 C ATOM 1357 CG LEU A 86 -9.249 9.584 -8.626 1.00 22.55 C ATOM 1358 CD1 LEU A 86 -9.120 10.751 -9.613 1.00 62.44 C ATOM 1359 CD2 LEU A 86 -8.978 8.260 -9.345 1.00 51.14 C ATOM 0 H LEU A 86 -7.348 10.456 -4.889 1.00 51.23 H new ATOM 0 HA LEU A 86 -9.117 11.648 -6.930 1.00 12.05 H new ATOM 0 HB2 LEU A 86 -7.286 10.033 -7.854 1.00 35.23 H new ATOM 0 HB3 LEU A 86 -8.126 8.772 -6.974 1.00 35.23 H new ATOM 0 HG LEU A 86 -10.264 9.588 -8.228 1.00 22.55 H new ATOM 0 HD11 LEU A 86 -9.831 10.618 -10.428 1.00 62.44 H new ATOM 0 HD12 LEU A 86 -9.329 11.688 -9.098 1.00 62.44 H new ATOM 0 HD13 LEU A 86 -8.107 10.777 -10.016 1.00 62.44 H new ATOM 0 HD21 LEU A 86 -9.678 8.146 -10.173 1.00 51.14 H new ATOM 0 HD22 LEU A 86 -7.958 8.257 -9.729 1.00 51.14 H new ATOM 0 HD23 LEU A 86 -9.105 7.434 -8.646 1.00 51.14 H new ATOM 1371 N ASN A 87 -11.052 10.648 -5.769 1.00 23.45 N ATOM 1372 CA ASN A 87 -12.235 10.290 -4.998 1.00 21.12 C ATOM 1373 C ASN A 87 -13.271 9.778 -5.997 1.00 23.45 C ATOM 1374 O ASN A 87 -14.352 10.341 -6.132 1.00 55.32 O ATOM 1375 CB ASN A 87 -12.734 11.485 -4.154 1.00 0.12 C ATOM 1376 CG ASN A 87 -11.624 12.280 -3.470 1.00 51.24 C ATOM 1377 OD1 ASN A 87 -11.174 13.288 -4.014 1.00 42.10 O ATOM 1378 ND2 ASN A 87 -11.135 11.865 -2.314 1.00 60.13 N ATOM 0 H ASN A 87 -11.258 11.300 -6.526 1.00 23.45 H new ATOM 0 HA ASN A 87 -12.019 9.508 -4.270 1.00 21.12 H new ATOM 0 HB2 ASN A 87 -13.302 12.157 -4.797 1.00 0.12 H new ATOM 0 HB3 ASN A 87 -13.421 11.115 -3.393 1.00 0.12 H new ATOM 0 HD21 ASN A 87 -10.378 12.381 -1.865 1.00 60.13 H new ATOM 0 HD22 ASN A 87 -11.514 11.028 -1.871 1.00 60.13 H new ATOM 1385 N GLU A 88 -12.906 8.760 -6.777 1.00 54.22 N ATOM 1386 CA GLU A 88 -13.690 8.256 -7.903 1.00 72.42 C ATOM 1387 C GLU A 88 -14.502 7.018 -7.492 1.00 2.12 C ATOM 1388 O GLU A 88 -14.225 6.400 -6.458 1.00 35.15 O ATOM 1389 CB GLU A 88 -12.720 7.971 -9.067 1.00 13.22 C ATOM 1390 CG GLU A 88 -12.550 9.202 -9.963 1.00 55.42 C ATOM 1391 CD GLU A 88 -13.541 9.252 -11.122 1.00 71.53 C ATOM 1392 OE1 GLU A 88 -13.278 8.561 -12.129 1.00 43.31 O ATOM 1393 OE2 GLU A 88 -14.491 10.071 -11.081 1.00 20.21 O ATOM 0 H GLU A 88 -12.033 8.250 -6.639 1.00 54.22 H new ATOM 0 HA GLU A 88 -14.421 8.997 -8.227 1.00 72.42 H new ATOM 0 HB2 GLU A 88 -11.750 7.671 -8.670 1.00 13.22 H new ATOM 0 HB3 GLU A 88 -13.094 7.136 -9.659 1.00 13.22 H new ATOM 0 HG2 GLU A 88 -12.665 10.101 -9.358 1.00 55.42 H new ATOM 0 HG3 GLU A 88 -11.536 9.214 -10.362 1.00 55.42 H new ATOM 1400 N PRO A 89 -15.506 6.628 -8.299 1.00 74.50 N ATOM 1401 CA PRO A 89 -16.436 5.556 -7.962 1.00 24.13 C ATOM 1402 C PRO A 89 -15.729 4.207 -7.828 1.00 4.11 C ATOM 1403 O PRO A 89 -15.888 3.521 -6.817 1.00 52.01 O ATOM 1404 CB PRO A 89 -17.496 5.556 -9.073 1.00 24.53 C ATOM 1405 CG PRO A 89 -16.894 6.354 -10.222 1.00 2.41 C ATOM 1406 CD PRO A 89 -15.913 7.287 -9.533 1.00 72.40 C ATOM 0 HA PRO A 89 -16.896 5.722 -6.988 1.00 24.13 H new ATOM 0 HB2 PRO A 89 -17.734 4.539 -9.386 1.00 24.53 H new ATOM 0 HB3 PRO A 89 -18.425 6.009 -8.727 1.00 24.53 H new ATOM 0 HG2 PRO A 89 -16.393 5.706 -10.941 1.00 2.41 H new ATOM 0 HG3 PRO A 89 -17.657 6.908 -10.769 1.00 2.41 H new ATOM 0 HD2 PRO A 89 -15.051 7.482 -10.171 1.00 72.40 H new ATOM 0 HD3 PRO A 89 -16.378 8.250 -9.322 1.00 72.40 H new ATOM 1414 N LYS A 90 -14.953 3.826 -8.845 1.00 12.45 N ATOM 1415 CA LYS A 90 -14.304 2.518 -8.954 1.00 74.13 C ATOM 1416 C LYS A 90 -12.777 2.594 -8.851 1.00 4.42 C ATOM 1417 O LYS A 90 -12.120 1.560 -8.946 1.00 3.34 O ATOM 1418 CB LYS A 90 -14.751 1.836 -10.263 1.00 52.00 C ATOM 1419 CG LYS A 90 -15.847 0.778 -10.072 1.00 74.33 C ATOM 1420 CD LYS A 90 -17.288 1.283 -9.975 1.00 64.32 C ATOM 1421 CE LYS A 90 -17.724 1.695 -8.561 1.00 71.34 C ATOM 1422 NZ LYS A 90 -18.823 0.851 -8.046 1.00 74.51 N ATOM 0 H LYS A 90 -14.753 4.436 -9.638 1.00 12.45 H new ATOM 0 HA LYS A 90 -14.621 1.915 -8.103 1.00 74.13 H new ATOM 0 HB2 LYS A 90 -15.112 2.598 -10.953 1.00 52.00 H new ATOM 0 HB3 LYS A 90 -13.885 1.367 -10.731 1.00 52.00 H new ATOM 0 HG2 LYS A 90 -15.789 0.076 -10.904 1.00 74.33 H new ATOM 0 HG3 LYS A 90 -15.622 0.217 -9.165 1.00 74.33 H new ATOM 0 HD2 LYS A 90 -17.406 2.137 -10.641 1.00 64.32 H new ATOM 0 HD3 LYS A 90 -17.958 0.503 -10.335 1.00 64.32 H new ATOM 0 HE2 LYS A 90 -16.871 1.629 -7.886 1.00 71.34 H new ATOM 0 HE3 LYS A 90 -18.043 2.737 -8.570 1.00 71.34 H new ATOM 0 HZ1 LYS A 90 -19.084 1.166 -7.090 1.00 74.51 H new ATOM 0 HZ2 LYS A 90 -19.648 0.933 -8.674 1.00 74.51 H new ATOM 0 HZ3 LYS A 90 -18.512 -0.141 -8.011 1.00 74.51 H new ATOM 1436 N HIS A 91 -12.204 3.780 -8.633 1.00 41.10 N ATOM 1437 CA HIS A 91 -10.767 3.995 -8.523 1.00 2.25 C ATOM 1438 C HIS A 91 -10.539 4.879 -7.301 1.00 63.22 C ATOM 1439 O HIS A 91 -11.250 5.866 -7.111 1.00 3.31 O ATOM 1440 CB HIS A 91 -10.248 4.639 -9.818 1.00 24.41 C ATOM 1441 CG HIS A 91 -8.747 4.647 -10.014 1.00 1.03 C ATOM 1442 ND1 HIS A 91 -8.110 5.192 -11.104 1.00 72.44 N ATOM 1443 CD2 HIS A 91 -7.781 4.049 -9.242 1.00 12.21 C ATOM 1444 CE1 HIS A 91 -6.807 4.895 -11.008 1.00 71.33 C ATOM 1445 NE2 HIS A 91 -6.550 4.220 -9.879 1.00 34.22 N ATOM 0 H HIS A 91 -12.745 4.638 -8.526 1.00 41.10 H new ATOM 0 HA HIS A 91 -10.220 3.061 -8.394 1.00 2.25 H new ATOM 0 HB2 HIS A 91 -10.700 4.119 -10.663 1.00 24.41 H new ATOM 0 HB3 HIS A 91 -10.602 5.669 -9.852 1.00 24.41 H new ATOM 0 HD2 HIS A 91 -7.945 3.536 -8.306 1.00 12.21 H new ATOM 0 HE1 HIS A 91 -6.063 5.164 -11.743 1.00 71.33 H new ATOM 0 HE2 HIS A 91 -5.640 3.897 -9.551 1.00 34.22 H new ATOM 1453 N LYS A 92 -9.577 4.529 -6.453 1.00 13.23 N ATOM 1454 CA LYS A 92 -9.283 5.251 -5.226 1.00 54.22 C ATOM 1455 C LYS A 92 -7.770 5.267 -5.076 1.00 21.34 C ATOM 1456 O LYS A 92 -7.139 4.207 -5.123 1.00 12.44 O ATOM 1457 CB LYS A 92 -9.996 4.536 -4.070 1.00 33.42 C ATOM 1458 CG LYS A 92 -10.186 5.405 -2.821 1.00 55.02 C ATOM 1459 CD LYS A 92 -11.660 5.674 -2.492 1.00 3.02 C ATOM 1460 CE LYS A 92 -12.349 6.489 -3.593 1.00 23.54 C ATOM 1461 NZ LYS A 92 -13.724 6.842 -3.199 1.00 60.33 N ATOM 0 H LYS A 92 -8.972 3.722 -6.604 1.00 13.23 H new ATOM 0 HA LYS A 92 -9.638 6.281 -5.234 1.00 54.22 H new ATOM 0 HB2 LYS A 92 -10.972 4.195 -4.414 1.00 33.42 H new ATOM 0 HB3 LYS A 92 -9.425 3.648 -3.799 1.00 33.42 H new ATOM 0 HG2 LYS A 92 -9.714 4.915 -1.970 1.00 55.02 H new ATOM 0 HG3 LYS A 92 -9.673 6.356 -2.966 1.00 55.02 H new ATOM 0 HD2 LYS A 92 -12.182 4.726 -2.361 1.00 3.02 H new ATOM 0 HD3 LYS A 92 -11.729 6.210 -1.545 1.00 3.02 H new ATOM 0 HE2 LYS A 92 -11.778 7.396 -3.791 1.00 23.54 H new ATOM 0 HE3 LYS A 92 -12.367 5.915 -4.519 1.00 23.54 H new ATOM 0 HZ1 LYS A 92 -14.172 7.393 -3.959 1.00 60.33 H new ATOM 0 HZ2 LYS A 92 -14.271 5.973 -3.033 1.00 60.33 H new ATOM 0 HZ3 LYS A 92 -13.701 7.409 -2.327 1.00 60.33 H new ATOM 1475 N ILE A 93 -7.188 6.455 -4.936 1.00 21.42 N ATOM 1476 CA ILE A 93 -5.746 6.659 -4.958 1.00 2.42 C ATOM 1477 C ILE A 93 -5.382 7.395 -3.680 1.00 53.43 C ATOM 1478 O ILE A 93 -5.712 8.575 -3.562 1.00 71.54 O ATOM 1479 CB ILE A 93 -5.337 7.446 -6.220 1.00 42.21 C ATOM 1480 CG1 ILE A 93 -5.646 6.627 -7.492 1.00 54.44 C ATOM 1481 CG2 ILE A 93 -3.865 7.873 -6.086 1.00 4.03 C ATOM 1482 CD1 ILE A 93 -5.291 7.362 -8.787 1.00 11.30 C ATOM 0 H ILE A 93 -7.716 7.317 -4.802 1.00 21.42 H new ATOM 0 HA ILE A 93 -5.208 5.712 -5.000 1.00 2.42 H new ATOM 0 HB ILE A 93 -5.925 8.359 -6.317 1.00 42.21 H new ATOM 0 HG12 ILE A 93 -5.095 5.687 -7.453 1.00 54.44 H new ATOM 0 HG13 ILE A 93 -6.706 6.375 -7.505 1.00 54.44 H new ATOM 0 HG21 ILE A 93 -3.566 8.430 -6.974 1.00 4.03 H new ATOM 0 HG22 ILE A 93 -3.748 8.504 -5.205 1.00 4.03 H new ATOM 0 HG23 ILE A 93 -3.237 6.988 -5.985 1.00 4.03 H new ATOM 0 HD11 ILE A 93 -5.533 6.731 -9.642 1.00 11.30 H new ATOM 0 HD12 ILE A 93 -5.861 8.289 -8.847 1.00 11.30 H new ATOM 0 HD13 ILE A 93 -4.225 7.591 -8.795 1.00 11.30 H new ATOM 1494 N PHE A 94 -4.755 6.704 -2.733 1.00 32.23 N ATOM 1495 CA PHE A 94 -4.314 7.199 -1.442 1.00 20.23 C ATOM 1496 C PHE A 94 -2.798 7.313 -1.526 1.00 35.51 C ATOM 1497 O PHE A 94 -2.126 6.343 -1.892 1.00 64.42 O ATOM 1498 CB PHE A 94 -4.750 6.200 -0.345 1.00 73.43 C ATOM 1499 CG PHE A 94 -4.596 6.625 1.107 1.00 24.14 C ATOM 1500 CD1 PHE A 94 -4.939 7.926 1.522 1.00 42.11 C ATOM 1501 CD2 PHE A 94 -4.126 5.703 2.066 1.00 33.21 C ATOM 1502 CE1 PHE A 94 -4.745 8.323 2.856 1.00 2.02 C ATOM 1503 CE2 PHE A 94 -3.955 6.094 3.407 1.00 3.13 C ATOM 1504 CZ PHE A 94 -4.256 7.408 3.803 1.00 32.51 C ATOM 0 H PHE A 94 -4.528 5.718 -2.860 1.00 32.23 H new ATOM 0 HA PHE A 94 -4.749 8.167 -1.192 1.00 20.23 H new ATOM 0 HB2 PHE A 94 -5.799 5.956 -0.513 1.00 73.43 H new ATOM 0 HB3 PHE A 94 -4.183 5.280 -0.486 1.00 73.43 H new ATOM 0 HD1 PHE A 94 -5.354 8.624 0.810 1.00 42.11 H new ATOM 0 HD2 PHE A 94 -3.896 4.690 1.769 1.00 33.21 H new ATOM 0 HE1 PHE A 94 -4.973 9.336 3.154 1.00 2.02 H new ATOM 0 HE2 PHE A 94 -3.592 5.382 4.133 1.00 3.13 H new ATOM 0 HZ PHE A 94 -4.112 7.713 4.829 1.00 32.51 H new ATOM 1514 N GLU A 95 -2.262 8.481 -1.213 1.00 4.33 N ATOM 1515 CA GLU A 95 -0.828 8.725 -1.194 1.00 33.44 C ATOM 1516 C GLU A 95 -0.458 9.441 0.104 1.00 34.13 C ATOM 1517 O GLU A 95 -1.345 9.956 0.805 1.00 73.51 O ATOM 1518 CB GLU A 95 -0.406 9.457 -2.475 1.00 52.02 C ATOM 1519 CG GLU A 95 -1.239 10.694 -2.878 1.00 75.42 C ATOM 1520 CD GLU A 95 -1.183 11.920 -1.956 1.00 24.54 C ATOM 1521 OE1 GLU A 95 -0.094 12.265 -1.429 1.00 32.33 O ATOM 1522 OE2 GLU A 95 -2.223 12.592 -1.870 1.00 41.44 O ATOM 0 H GLU A 95 -2.818 9.298 -0.961 1.00 4.33 H new ATOM 0 HA GLU A 95 -0.266 7.791 -1.196 1.00 33.44 H new ATOM 0 HB2 GLU A 95 0.632 9.769 -2.361 1.00 52.02 H new ATOM 0 HB3 GLU A 95 -0.436 8.744 -3.299 1.00 52.02 H new ATOM 0 HG2 GLU A 95 -0.918 11.006 -3.872 1.00 75.42 H new ATOM 0 HG3 GLU A 95 -2.281 10.384 -2.962 1.00 75.42 H new ATOM 1529 N ALA A 96 0.815 9.373 0.498 1.00 21.23 N ATOM 1530 CA ALA A 96 1.333 10.222 1.557 1.00 31.12 C ATOM 1531 C ALA A 96 2.803 10.541 1.323 1.00 20.34 C ATOM 1532 O ALA A 96 3.574 9.692 0.856 1.00 71.54 O ATOM 1533 CB ALA A 96 1.151 9.587 2.943 1.00 11.41 C ATOM 0 H ALA A 96 1.502 8.736 0.095 1.00 21.23 H new ATOM 0 HA ALA A 96 0.757 11.147 1.533 1.00 31.12 H new ATOM 0 HB1 ALA A 96 1.552 10.255 3.705 1.00 11.41 H new ATOM 0 HB2 ALA A 96 0.090 9.419 3.130 1.00 11.41 H new ATOM 0 HB3 ALA A 96 1.681 8.635 2.980 1.00 11.41 H new ATOM 1539 N GLY A 97 3.184 11.752 1.715 1.00 24.34 N ATOM 1540 CA GLY A 97 4.525 12.299 1.585 1.00 21.44 C ATOM 1541 C GLY A 97 4.503 13.783 1.925 1.00 71.44 C ATOM 1542 O GLY A 97 3.463 14.322 2.314 1.00 73.24 O ATOM 0 H GLY A 97 2.535 12.407 2.152 1.00 24.34 H new ATOM 0 HA2 GLY A 97 5.210 11.773 2.250 1.00 21.44 H new ATOM 0 HA3 GLY A 97 4.892 12.153 0.569 1.00 21.44 H new ATOM 1546 N TYR A 98 5.641 14.457 1.780 1.00 43.03 N ATOM 1547 CA TYR A 98 5.664 15.908 1.758 1.00 75.45 C ATOM 1548 C TYR A 98 4.958 16.395 0.498 1.00 62.15 C ATOM 1549 O TYR A 98 5.169 15.851 -0.587 1.00 32.42 O ATOM 1550 CB TYR A 98 7.103 16.425 1.859 1.00 73.24 C ATOM 1551 CG TYR A 98 7.641 16.388 3.275 1.00 54.03 C ATOM 1552 CD1 TYR A 98 6.952 17.104 4.260 1.00 44.22 C ATOM 1553 CD2 TYR A 98 8.793 15.659 3.627 1.00 75.34 C ATOM 1554 CE1 TYR A 98 7.377 17.099 5.593 1.00 31.44 C ATOM 1555 CE2 TYR A 98 9.229 15.637 4.964 1.00 35.31 C ATOM 1556 CZ TYR A 98 8.515 16.350 5.956 1.00 35.14 C ATOM 1557 OH TYR A 98 8.938 16.365 7.246 1.00 64.15 O ATOM 0 H TYR A 98 6.556 14.018 1.676 1.00 43.03 H new ATOM 0 HA TYR A 98 5.131 16.305 2.622 1.00 75.45 H new ATOM 0 HB2 TYR A 98 7.746 15.825 1.215 1.00 73.24 H new ATOM 0 HB3 TYR A 98 7.144 17.448 1.486 1.00 73.24 H new ATOM 0 HD1 TYR A 98 6.075 17.672 3.986 1.00 44.22 H new ATOM 0 HD2 TYR A 98 9.342 15.117 2.871 1.00 75.34 H new ATOM 0 HE1 TYR A 98 6.837 17.665 6.338 1.00 31.44 H new ATOM 0 HE2 TYR A 98 10.111 15.075 5.234 1.00 35.31 H new ATOM 0 HH TYR A 98 9.733 15.799 7.336 1.00 64.15 H new ATOM 1567 N GLU A 99 4.125 17.426 0.638 1.00 54.42 N ATOM 1568 CA GLU A 99 3.258 17.924 -0.428 1.00 35.41 C ATOM 1569 C GLU A 99 4.070 18.386 -1.645 1.00 51.35 C ATOM 1570 O GLU A 99 3.584 18.336 -2.776 1.00 20.54 O ATOM 1571 CB GLU A 99 2.408 19.067 0.149 1.00 21.11 C ATOM 1572 CG GLU A 99 1.058 19.293 -0.537 1.00 4.12 C ATOM 1573 CD GLU A 99 1.129 19.862 -1.954 1.00 41.31 C ATOM 1574 OE1 GLU A 99 1.734 20.937 -2.180 1.00 73.43 O ATOM 1575 OE2 GLU A 99 0.432 19.331 -2.853 1.00 11.04 O ATOM 0 H GLU A 99 4.033 17.947 1.510 1.00 54.42 H new ATOM 0 HA GLU A 99 2.610 17.123 -0.783 1.00 35.41 H new ATOM 0 HB2 GLU A 99 2.230 18.867 1.206 1.00 21.11 H new ATOM 0 HB3 GLU A 99 2.984 19.990 0.092 1.00 21.11 H new ATOM 0 HG2 GLU A 99 0.524 18.344 -0.571 1.00 4.12 H new ATOM 0 HG3 GLU A 99 0.466 19.970 0.079 1.00 4.12 H new ATOM 1582 N GLU A 100 5.318 18.802 -1.423 1.00 61.35 N ATOM 1583 CA GLU A 100 6.249 19.297 -2.431 1.00 20.22 C ATOM 1584 C GLU A 100 7.540 18.463 -2.405 1.00 44.13 C ATOM 1585 O GLU A 100 8.632 18.996 -2.623 1.00 14.02 O ATOM 1586 CB GLU A 100 6.477 20.810 -2.223 1.00 12.12 C ATOM 1587 CG GLU A 100 5.201 21.602 -2.542 1.00 63.21 C ATOM 1588 CD GLU A 100 5.347 23.104 -2.322 1.00 4.13 C ATOM 1589 OE1 GLU A 100 5.905 23.820 -3.180 1.00 34.42 O ATOM 1590 OE2 GLU A 100 4.800 23.620 -1.319 1.00 13.13 O ATOM 0 H GLU A 100 5.724 18.802 -0.487 1.00 61.35 H new ATOM 0 HA GLU A 100 5.834 19.181 -3.432 1.00 20.22 H new ATOM 0 HB2 GLU A 100 6.780 20.999 -1.193 1.00 12.12 H new ATOM 0 HB3 GLU A 100 7.292 21.151 -2.862 1.00 12.12 H new ATOM 0 HG2 GLU A 100 4.920 21.420 -3.579 1.00 63.21 H new ATOM 0 HG3 GLU A 100 4.387 21.229 -1.921 1.00 63.21 H new ATOM 1597 N SER A 101 7.445 17.161 -2.118 1.00 1.21 N ATOM 1598 CA SER A 101 8.546 16.213 -2.243 1.00 13.03 C ATOM 1599 C SER A 101 8.028 14.845 -2.680 1.00 42.43 C ATOM 1600 O SER A 101 6.887 14.722 -3.123 1.00 53.22 O ATOM 1601 CB SER A 101 9.375 16.173 -0.950 1.00 2.01 C ATOM 1602 OG SER A 101 10.726 16.488 -1.218 1.00 62.42 O ATOM 0 H SER A 101 6.581 16.732 -1.786 1.00 1.21 H new ATOM 0 HA SER A 101 9.225 16.546 -3.028 1.00 13.03 H new ATOM 0 HB2 SER A 101 8.967 16.880 -0.228 1.00 2.01 H new ATOM 0 HB3 SER A 101 9.309 15.183 -0.499 1.00 2.01 H new ATOM 0 HG SER A 101 11.240 16.460 -0.384 1.00 62.42 H new ATOM 1608 N GLU A 102 8.905 13.845 -2.679 1.00 40.35 N ATOM 1609 CA GLU A 102 8.549 12.477 -3.035 1.00 74.41 C ATOM 1610 C GLU A 102 7.684 11.848 -1.935 1.00 52.41 C ATOM 1611 O GLU A 102 7.535 12.402 -0.845 1.00 52.23 O ATOM 1612 CB GLU A 102 9.795 11.667 -3.367 1.00 22.21 C ATOM 1613 CG GLU A 102 10.374 12.037 -4.739 1.00 22.31 C ATOM 1614 CD GLU A 102 11.770 11.472 -4.984 1.00 34.12 C ATOM 1615 OE1 GLU A 102 12.714 11.972 -4.332 1.00 41.41 O ATOM 1616 OE2 GLU A 102 11.917 10.540 -5.808 1.00 55.23 O ATOM 0 H GLU A 102 9.887 13.963 -2.430 1.00 40.35 H new ATOM 0 HA GLU A 102 7.942 12.481 -3.940 1.00 74.41 H new ATOM 0 HB2 GLU A 102 10.550 11.832 -2.599 1.00 22.21 H new ATOM 0 HB3 GLU A 102 9.551 10.605 -3.351 1.00 22.21 H new ATOM 0 HG2 GLU A 102 9.702 11.675 -5.517 1.00 22.31 H new ATOM 0 HG3 GLU A 102 10.409 13.123 -4.829 1.00 22.31 H new ATOM 1623 N VAL A 103 7.104 10.686 -2.213 1.00 74.42 N ATOM 1624 CA VAL A 103 6.226 9.954 -1.304 1.00 62.22 C ATOM 1625 C VAL A 103 7.007 9.142 -0.269 1.00 71.53 C ATOM 1626 O VAL A 103 8.222 8.976 -0.376 1.00 33.30 O ATOM 1627 CB VAL A 103 5.293 9.039 -2.129 1.00 61.21 C ATOM 1628 CG1 VAL A 103 4.081 9.844 -2.575 1.00 75.24 C ATOM 1629 CG2 VAL A 103 5.964 8.386 -3.354 1.00 22.30 C ATOM 0 H VAL A 103 7.235 10.211 -3.106 1.00 74.42 H new ATOM 0 HA VAL A 103 5.634 10.679 -0.745 1.00 62.22 H new ATOM 0 HB VAL A 103 5.007 8.215 -1.475 1.00 61.21 H new ATOM 0 HG11 VAL A 103 3.416 9.207 -3.158 1.00 75.24 H new ATOM 0 HG12 VAL A 103 3.550 10.218 -1.699 1.00 75.24 H new ATOM 0 HG13 VAL A 103 4.408 10.685 -3.187 1.00 75.24 H new ATOM 0 HG21 VAL A 103 5.239 7.761 -3.876 1.00 22.30 H new ATOM 0 HG22 VAL A 103 6.325 9.163 -4.028 1.00 22.30 H new ATOM 0 HG23 VAL A 103 6.802 7.772 -3.025 1.00 22.30 H new ATOM 1639 N ASP A 104 6.278 8.572 0.696 1.00 64.14 N ATOM 1640 CA ASP A 104 6.694 7.363 1.414 1.00 62.33 C ATOM 1641 C ASP A 104 5.675 6.233 1.238 1.00 11.34 C ATOM 1642 O ASP A 104 5.917 5.097 1.637 1.00 71.52 O ATOM 1643 CB ASP A 104 6.890 7.648 2.903 1.00 73.21 C ATOM 1644 CG ASP A 104 7.868 6.705 3.622 1.00 32.32 C ATOM 1645 OD1 ASP A 104 8.751 6.083 2.974 1.00 51.41 O ATOM 1646 OD2 ASP A 104 7.818 6.674 4.874 1.00 51.44 O ATOM 0 H ASP A 104 5.377 8.939 1.003 1.00 64.14 H new ATOM 0 HA ASP A 104 7.645 7.046 0.986 1.00 62.33 H new ATOM 0 HB2 ASP A 104 7.246 8.672 3.018 1.00 73.21 H new ATOM 0 HB3 ASP A 104 5.921 7.589 3.399 1.00 73.21 H new ATOM 1651 N LEU A 105 4.497 6.530 0.673 1.00 2.31 N ATOM 1652 CA LEU A 105 3.346 5.640 0.708 1.00 0.02 C ATOM 1653 C LEU A 105 2.509 5.836 -0.558 1.00 22.34 C ATOM 1654 O LEU A 105 2.124 6.962 -0.885 1.00 3.23 O ATOM 1655 CB LEU A 105 2.548 5.968 1.982 1.00 14.34 C ATOM 1656 CG LEU A 105 1.405 4.996 2.314 1.00 73.14 C ATOM 1657 CD1 LEU A 105 1.900 3.588 2.662 1.00 4.21 C ATOM 1658 CD2 LEU A 105 0.612 5.533 3.511 1.00 44.05 C ATOM 0 H LEU A 105 4.322 7.404 0.177 1.00 2.31 H new ATOM 0 HA LEU A 105 3.648 4.593 0.734 1.00 0.02 H new ATOM 0 HB2 LEU A 105 3.238 5.992 2.826 1.00 14.34 H new ATOM 0 HB3 LEU A 105 2.132 6.970 1.881 1.00 14.34 H new ATOM 0 HG LEU A 105 0.785 4.924 1.420 1.00 73.14 H new ATOM 0 HD11 LEU A 105 1.047 2.948 2.887 1.00 4.21 H new ATOM 0 HD12 LEU A 105 2.450 3.176 1.816 1.00 4.21 H new ATOM 0 HD13 LEU A 105 2.556 3.637 3.531 1.00 4.21 H new ATOM 0 HD21 LEU A 105 -0.199 4.845 3.748 1.00 44.05 H new ATOM 0 HD22 LEU A 105 1.273 5.626 4.373 1.00 44.05 H new ATOM 0 HD23 LEU A 105 0.198 6.511 3.264 1.00 44.05 H new ATOM 1670 N ARG A 106 2.233 4.754 -1.291 1.00 44.04 N ATOM 1671 CA ARG A 106 1.266 4.713 -2.388 1.00 75.52 C ATOM 1672 C ARG A 106 0.536 3.386 -2.261 1.00 62.45 C ATOM 1673 O ARG A 106 1.165 2.332 -2.392 1.00 11.34 O ATOM 1674 CB ARG A 106 1.911 4.745 -3.787 1.00 4.31 C ATOM 1675 CG ARG A 106 2.738 5.974 -4.167 1.00 35.34 C ATOM 1676 CD ARG A 106 1.858 7.200 -4.424 1.00 33.40 C ATOM 1677 NE ARG A 106 2.494 8.113 -5.393 1.00 53.14 N ATOM 1678 CZ ARG A 106 1.932 8.640 -6.490 1.00 14.21 C ATOM 1679 NH1 ARG A 106 0.667 8.374 -6.820 1.00 52.01 N ATOM 1680 NH2 ARG A 106 2.645 9.450 -7.260 1.00 20.23 N ATOM 0 H ARG A 106 2.691 3.856 -1.132 1.00 44.04 H new ATOM 0 HA ARG A 106 0.627 5.592 -2.309 1.00 75.52 H new ATOM 0 HB2 ARG A 106 2.553 3.869 -3.879 1.00 4.31 H new ATOM 0 HB3 ARG A 106 1.116 4.636 -4.524 1.00 4.31 H new ATOM 0 HG2 ARG A 106 3.445 6.196 -3.368 1.00 35.34 H new ATOM 0 HG3 ARG A 106 3.324 5.755 -5.059 1.00 35.34 H new ATOM 0 HD2 ARG A 106 0.886 6.882 -4.802 1.00 33.40 H new ATOM 0 HD3 ARG A 106 1.679 7.726 -3.487 1.00 33.40 H new ATOM 0 HE ARG A 106 3.464 8.370 -5.209 1.00 53.14 H new ATOM 0 HH11 ARG A 106 0.105 7.758 -6.232 1.00 52.01 H new ATOM 0 HH12 ARG A 106 0.261 8.787 -7.660 1.00 52.01 H new ATOM 0 HH21 ARG A 106 3.611 9.667 -7.015 1.00 20.23 H new ATOM 0 HH22 ARG A 106 2.227 9.857 -8.097 1.00 20.23 H new ATOM 1694 N VAL A 107 -0.770 3.407 -2.026 1.00 51.15 N ATOM 1695 CA VAL A 107 -1.581 2.193 -2.033 1.00 13.43 C ATOM 1696 C VAL A 107 -2.869 2.535 -2.758 1.00 63.32 C ATOM 1697 O VAL A 107 -3.660 3.357 -2.290 1.00 21.44 O ATOM 1698 CB VAL A 107 -1.820 1.612 -0.622 1.00 51.15 C ATOM 1699 CG1 VAL A 107 -2.121 0.112 -0.761 1.00 51.14 C ATOM 1700 CG2 VAL A 107 -0.621 1.752 0.317 1.00 75.43 C ATOM 0 H VAL A 107 -1.295 4.258 -1.826 1.00 51.15 H new ATOM 0 HA VAL A 107 -1.054 1.392 -2.551 1.00 13.43 H new ATOM 0 HB VAL A 107 -2.645 2.177 -0.189 1.00 51.15 H new ATOM 0 HG11 VAL A 107 -2.293 -0.318 0.226 1.00 51.14 H new ATOM 0 HG12 VAL A 107 -3.010 -0.025 -1.376 1.00 51.14 H new ATOM 0 HG13 VAL A 107 -1.274 -0.387 -1.231 1.00 51.14 H new ATOM 0 HG21 VAL A 107 -0.867 1.321 1.288 1.00 75.43 H new ATOM 0 HG22 VAL A 107 0.236 1.228 -0.106 1.00 75.43 H new ATOM 0 HG23 VAL A 107 -0.376 2.807 0.440 1.00 75.43 H new ATOM 1710 N GLU A 108 -3.057 1.967 -3.947 1.00 32.41 N ATOM 1711 CA GLU A 108 -4.118 2.380 -4.850 1.00 0.22 C ATOM 1712 C GLU A 108 -5.029 1.185 -5.140 1.00 54.03 C ATOM 1713 O GLU A 108 -4.613 0.026 -5.023 1.00 62.42 O ATOM 1714 CB GLU A 108 -3.539 3.072 -6.098 1.00 2.20 C ATOM 1715 CG GLU A 108 -2.591 4.229 -5.706 1.00 33.10 C ATOM 1716 CD GLU A 108 -2.162 5.125 -6.869 1.00 60.34 C ATOM 1717 OE1 GLU A 108 -2.719 5.032 -7.978 1.00 61.11 O ATOM 1718 OE2 GLU A 108 -1.248 5.962 -6.655 1.00 62.15 O ATOM 0 H GLU A 108 -2.477 1.209 -4.307 1.00 32.41 H new ATOM 0 HA GLU A 108 -4.747 3.138 -4.384 1.00 0.22 H new ATOM 0 HB2 GLU A 108 -2.998 2.344 -6.703 1.00 2.20 H new ATOM 0 HB3 GLU A 108 -4.352 3.457 -6.714 1.00 2.20 H new ATOM 0 HG2 GLU A 108 -3.083 4.845 -4.953 1.00 33.10 H new ATOM 0 HG3 GLU A 108 -1.699 3.808 -5.241 1.00 33.10 H new ATOM 1725 N PHE A 109 -6.294 1.462 -5.470 1.00 51.32 N ATOM 1726 CA PHE A 109 -7.394 0.503 -5.426 1.00 24.34 C ATOM 1727 C PHE A 109 -8.265 0.698 -6.660 1.00 72.34 C ATOM 1728 O PHE A 109 -8.804 1.788 -6.865 1.00 43.22 O ATOM 1729 CB PHE A 109 -8.222 0.733 -4.144 1.00 22.11 C ATOM 1730 CG PHE A 109 -7.429 0.660 -2.853 1.00 13.04 C ATOM 1731 CD1 PHE A 109 -6.524 -0.394 -2.630 1.00 40.31 C ATOM 1732 CD2 PHE A 109 -7.518 1.706 -1.918 1.00 52.22 C ATOM 1733 CE1 PHE A 109 -5.633 -0.339 -1.547 1.00 52.33 C ATOM 1734 CE2 PHE A 109 -6.625 1.762 -0.836 1.00 35.34 C ATOM 1735 CZ PHE A 109 -5.658 0.759 -0.671 1.00 55.25 C ATOM 0 H PHE A 109 -6.586 2.388 -5.784 1.00 51.32 H new ATOM 0 HA PHE A 109 -7.007 -0.516 -5.415 1.00 24.34 H new ATOM 0 HB2 PHE A 109 -8.698 1.711 -4.207 1.00 22.11 H new ATOM 0 HB3 PHE A 109 -9.020 -0.008 -4.106 1.00 22.11 H new ATOM 0 HD1 PHE A 109 -6.515 -1.246 -3.293 1.00 40.31 H new ATOM 0 HD2 PHE A 109 -8.275 2.468 -2.032 1.00 52.22 H new ATOM 0 HE1 PHE A 109 -4.928 -1.141 -1.387 1.00 52.33 H new ATOM 0 HE2 PHE A 109 -6.683 2.578 -0.130 1.00 35.34 H new ATOM 0 HZ PHE A 109 -4.934 0.831 0.128 1.00 55.25 H new ATOM 1745 N GLU A 110 -8.409 -0.346 -7.474 1.00 74.55 N ATOM 1746 CA GLU A 110 -9.301 -0.372 -8.622 1.00 24.54 C ATOM 1747 C GLU A 110 -10.206 -1.587 -8.468 1.00 60.13 C ATOM 1748 O GLU A 110 -9.733 -2.716 -8.261 1.00 41.15 O ATOM 1749 CB GLU A 110 -8.515 -0.446 -9.942 1.00 61.41 C ATOM 1750 CG GLU A 110 -7.901 0.894 -10.383 1.00 13.02 C ATOM 1751 CD GLU A 110 -6.904 0.773 -11.558 1.00 54.23 C ATOM 1752 OE1 GLU A 110 -6.204 -0.265 -11.691 1.00 42.13 O ATOM 1753 OE2 GLU A 110 -6.755 1.744 -12.332 1.00 55.25 O ATOM 0 H GLU A 110 -7.894 -1.217 -7.347 1.00 74.55 H new ATOM 0 HA GLU A 110 -9.888 0.545 -8.658 1.00 24.54 H new ATOM 0 HB2 GLU A 110 -7.718 -1.182 -9.837 1.00 61.41 H new ATOM 0 HB3 GLU A 110 -9.179 -0.806 -10.728 1.00 61.41 H new ATOM 0 HG2 GLU A 110 -8.704 1.573 -10.670 1.00 13.02 H new ATOM 0 HG3 GLU A 110 -7.391 1.346 -9.532 1.00 13.02 H new ATOM 1760 N LEU A 111 -11.512 -1.356 -8.596 1.00 74.34 N ATOM 1761 CA LEU A 111 -12.425 -2.425 -8.975 1.00 35.23 C ATOM 1762 C LEU A 111 -12.048 -2.836 -10.394 1.00 41.10 C ATOM 1763 O LEU A 111 -11.838 -1.976 -11.249 1.00 0.04 O ATOM 1764 CB LEU A 111 -13.887 -1.955 -8.918 1.00 55.02 C ATOM 1765 CG LEU A 111 -14.890 -3.129 -8.967 1.00 20.42 C ATOM 1766 CD1 LEU A 111 -15.101 -3.744 -7.581 1.00 43.42 C ATOM 1767 CD2 LEU A 111 -16.258 -2.692 -9.487 1.00 64.53 C ATOM 0 H LEU A 111 -11.954 -0.449 -8.444 1.00 74.34 H new ATOM 0 HA LEU A 111 -12.341 -3.265 -8.285 1.00 35.23 H new ATOM 0 HB2 LEU A 111 -14.046 -1.384 -8.003 1.00 55.02 H new ATOM 0 HB3 LEU A 111 -14.081 -1.281 -9.752 1.00 55.02 H new ATOM 0 HG LEU A 111 -14.453 -3.862 -9.645 1.00 20.42 H new ATOM 0 HD11 LEU A 111 -15.812 -4.567 -7.653 1.00 43.42 H new ATOM 0 HD12 LEU A 111 -14.151 -4.118 -7.200 1.00 43.42 H new ATOM 0 HD13 LEU A 111 -15.491 -2.986 -6.902 1.00 43.42 H new ATOM 0 HD21 LEU A 111 -16.931 -3.549 -9.505 1.00 64.53 H new ATOM 0 HD22 LEU A 111 -16.667 -1.922 -8.832 1.00 64.53 H new ATOM 0 HD23 LEU A 111 -16.153 -2.292 -10.496 1.00 64.53 H new ATOM 1779 N GLN A 112 -11.925 -4.135 -10.641 1.00 24.22 N ATOM 1780 CA GLN A 112 -11.768 -4.652 -11.989 1.00 55.44 C ATOM 1781 C GLN A 112 -13.141 -5.068 -12.515 1.00 34.44 C ATOM 1782 O GLN A 112 -14.056 -5.343 -11.732 1.00 12.21 O ATOM 1783 CB GLN A 112 -10.815 -5.844 -11.939 1.00 41.45 C ATOM 1784 CG GLN A 112 -9.438 -5.517 -11.348 1.00 74.23 C ATOM 1785 CD GLN A 112 -8.723 -4.327 -11.982 1.00 54.03 C ATOM 1786 OE1 GLN A 112 -8.606 -4.222 -13.201 1.00 40.42 O ATOM 1787 NE2 GLN A 112 -8.134 -3.464 -11.175 1.00 14.10 N ATOM 0 H GLN A 112 -11.932 -4.852 -9.916 1.00 24.22 H new ATOM 0 HA GLN A 112 -11.354 -3.897 -12.657 1.00 55.44 H new ATOM 0 HB2 GLN A 112 -11.273 -6.638 -11.349 1.00 41.45 H new ATOM 0 HB3 GLN A 112 -10.683 -6.233 -12.949 1.00 41.45 H new ATOM 0 HG2 GLN A 112 -9.555 -5.324 -10.282 1.00 74.23 H new ATOM 0 HG3 GLN A 112 -8.801 -6.396 -11.445 1.00 74.23 H new ATOM 0 HE21 GLN A 112 -8.236 -3.559 -10.165 1.00 14.10 H new ATOM 0 HE22 GLN A 112 -7.576 -2.703 -11.562 1.00 14.10 H new ATOM 1796 N ALA A 113 -13.248 -5.295 -13.824 1.00 11.25 N ATOM 1797 CA ALA A 113 -14.372 -6.002 -14.441 1.00 71.11 C ATOM 1798 C ALA A 113 -14.484 -7.464 -13.958 1.00 3.41 C ATOM 1799 O ALA A 113 -15.422 -8.171 -14.311 1.00 63.43 O ATOM 1800 CB ALA A 113 -14.232 -5.916 -15.961 1.00 21.14 C ATOM 0 H ALA A 113 -12.545 -4.988 -14.497 1.00 11.25 H new ATOM 0 HA ALA A 113 -15.301 -5.521 -14.134 1.00 71.11 H new ATOM 0 HB1 ALA A 113 -15.064 -6.439 -16.433 1.00 21.14 H new ATOM 0 HB2 ALA A 113 -14.240 -4.870 -16.268 1.00 21.14 H new ATOM 0 HB3 ALA A 113 -13.293 -6.377 -16.267 1.00 21.14 H new ATOM 1806 N ASP A 114 -13.539 -7.911 -13.127 1.00 54.23 N ATOM 1807 CA ASP A 114 -13.532 -9.157 -12.355 1.00 52.43 C ATOM 1808 C ASP A 114 -14.572 -9.102 -11.219 1.00 13.01 C ATOM 1809 O ASP A 114 -15.008 -10.114 -10.676 1.00 64.52 O ATOM 1810 CB ASP A 114 -12.117 -9.306 -11.768 1.00 0.43 C ATOM 1811 CG ASP A 114 -11.703 -10.741 -11.460 1.00 33.41 C ATOM 1812 OD1 ASP A 114 -12.248 -11.341 -10.514 1.00 62.21 O ATOM 1813 OD2 ASP A 114 -10.733 -11.208 -12.104 1.00 41.42 O ATOM 0 H ASP A 114 -12.691 -7.368 -12.963 1.00 54.23 H new ATOM 0 HA ASP A 114 -13.789 -10.004 -12.991 1.00 52.43 H new ATOM 0 HB2 ASP A 114 -11.401 -8.878 -12.469 1.00 0.43 H new ATOM 0 HB3 ASP A 114 -12.055 -8.720 -10.851 1.00 0.43 H new ATOM 1818 N GLY A 115 -14.994 -7.893 -10.837 1.00 52.00 N ATOM 1819 CA GLY A 115 -16.024 -7.645 -9.840 1.00 52.40 C ATOM 1820 C GLY A 115 -15.493 -7.607 -8.407 1.00 40.13 C ATOM 1821 O GLY A 115 -16.267 -7.301 -7.495 1.00 34.41 O ATOM 0 H GLY A 115 -14.610 -7.034 -11.231 1.00 52.00 H new ATOM 0 HA2 GLY A 115 -16.512 -6.696 -10.063 1.00 52.40 H new ATOM 0 HA3 GLY A 115 -16.786 -8.421 -9.916 1.00 52.40 H new ATOM 1825 N LYS A 116 -14.204 -7.892 -8.169 1.00 64.33 N ATOM 1826 CA LYS A 116 -13.574 -7.620 -6.881 1.00 35.13 C ATOM 1827 C LYS A 116 -12.823 -6.300 -6.982 1.00 74.50 C ATOM 1828 O LYS A 116 -12.386 -5.893 -8.063 1.00 72.40 O ATOM 1829 CB LYS A 116 -12.596 -8.743 -6.504 1.00 43.42 C ATOM 1830 CG LYS A 116 -13.272 -9.976 -5.882 1.00 51.21 C ATOM 1831 CD LYS A 116 -13.206 -11.230 -6.756 1.00 74.53 C ATOM 1832 CE LYS A 116 -14.034 -11.143 -8.040 1.00 21.32 C ATOM 1833 NZ LYS A 116 -15.472 -11.389 -7.826 1.00 34.51 N ATOM 0 H LYS A 116 -13.581 -8.312 -8.858 1.00 64.33 H new ATOM 0 HA LYS A 116 -14.341 -7.565 -6.108 1.00 35.13 H new ATOM 0 HB2 LYS A 116 -12.051 -9.051 -7.396 1.00 43.42 H new ATOM 0 HB3 LYS A 116 -11.861 -8.351 -5.801 1.00 43.42 H new ATOM 0 HG2 LYS A 116 -12.802 -10.190 -4.922 1.00 51.21 H new ATOM 0 HG3 LYS A 116 -14.317 -9.741 -5.680 1.00 51.21 H new ATOM 0 HD2 LYS A 116 -12.166 -11.421 -7.020 1.00 74.53 H new ATOM 0 HD3 LYS A 116 -13.549 -12.084 -6.173 1.00 74.53 H new ATOM 0 HE2 LYS A 116 -13.904 -10.155 -8.482 1.00 21.32 H new ATOM 0 HE3 LYS A 116 -13.652 -11.867 -8.760 1.00 21.32 H new ATOM 0 HZ1 LYS A 116 -15.976 -11.316 -8.733 1.00 34.51 H new ATOM 0 HZ2 LYS A 116 -15.606 -12.342 -7.432 1.00 34.51 H new ATOM 0 HZ3 LYS A 116 -15.850 -10.683 -7.162 1.00 34.51 H new ATOM 1847 N TRP A 117 -12.645 -5.659 -5.832 1.00 14.44 N ATOM 1848 CA TRP A 117 -11.647 -4.624 -5.651 1.00 20.32 C ATOM 1849 C TRP A 117 -10.320 -5.337 -5.457 1.00 11.01 C ATOM 1850 O TRP A 117 -10.210 -6.193 -4.576 1.00 75.14 O ATOM 1851 CB TRP A 117 -11.977 -3.786 -4.419 1.00 64.54 C ATOM 1852 CG TRP A 117 -13.057 -2.773 -4.577 1.00 2.41 C ATOM 1853 CD1 TRP A 117 -14.359 -2.972 -4.293 1.00 62.11 C ATOM 1854 CD2 TRP A 117 -12.942 -1.379 -4.997 1.00 54.21 C ATOM 1855 NE1 TRP A 117 -15.062 -1.822 -4.563 1.00 12.15 N ATOM 1856 CE2 TRP A 117 -14.247 -0.807 -5.008 1.00 0.22 C ATOM 1857 CE3 TRP A 117 -11.872 -0.537 -5.366 1.00 23.14 C ATOM 1858 CZ2 TRP A 117 -14.485 0.519 -5.397 1.00 72.40 C ATOM 1859 CZ3 TRP A 117 -12.090 0.810 -5.714 1.00 60.30 C ATOM 1860 CH2 TRP A 117 -13.392 1.339 -5.723 1.00 34.22 C ATOM 0 H TRP A 117 -13.197 -5.849 -4.995 1.00 14.44 H new ATOM 0 HA TRP A 117 -11.614 -3.952 -6.509 1.00 20.32 H new ATOM 0 HB2 TRP A 117 -12.258 -4.462 -3.611 1.00 64.54 H new ATOM 0 HB3 TRP A 117 -11.070 -3.271 -4.103 1.00 64.54 H new ATOM 0 HD1 TRP A 117 -14.783 -3.890 -3.913 1.00 62.11 H new ATOM 0 HE1 TRP A 117 -16.071 -1.732 -4.447 1.00 12.15 H new ATOM 0 HE3 TRP A 117 -10.867 -0.933 -5.382 1.00 23.14 H new ATOM 0 HZ2 TRP A 117 -15.493 0.904 -5.445 1.00 72.40 H new ATOM 0 HZ3 TRP A 117 -11.252 1.440 -5.975 1.00 60.30 H new ATOM 0 HH2 TRP A 117 -13.552 2.376 -5.980 1.00 34.22 H new ATOM 1871 N TYR A 118 -9.317 -4.974 -6.250 1.00 72.44 N ATOM 1872 CA TYR A 118 -7.985 -5.553 -6.194 1.00 44.31 C ATOM 1873 C TYR A 118 -6.981 -4.422 -6.006 1.00 71.44 C ATOM 1874 O TYR A 118 -7.143 -3.345 -6.585 1.00 20.30 O ATOM 1875 CB TYR A 118 -7.738 -6.345 -7.481 1.00 20.31 C ATOM 1876 CG TYR A 118 -8.496 -7.657 -7.637 1.00 71.41 C ATOM 1877 CD1 TYR A 118 -8.884 -8.446 -6.533 1.00 15.34 C ATOM 1878 CD2 TYR A 118 -8.750 -8.136 -8.932 1.00 0.41 C ATOM 1879 CE1 TYR A 118 -9.416 -9.732 -6.728 1.00 21.34 C ATOM 1880 CE2 TYR A 118 -9.325 -9.396 -9.139 1.00 24.12 C ATOM 1881 CZ TYR A 118 -9.593 -10.233 -8.036 1.00 14.02 C ATOM 1882 OH TYR A 118 -9.968 -11.527 -8.222 1.00 23.12 O ATOM 0 H TYR A 118 -9.413 -4.253 -6.965 1.00 72.44 H new ATOM 0 HA TYR A 118 -7.878 -6.243 -5.357 1.00 44.31 H new ATOM 0 HB2 TYR A 118 -7.989 -5.705 -8.327 1.00 20.31 H new ATOM 0 HB3 TYR A 118 -6.671 -6.559 -7.549 1.00 20.31 H new ATOM 0 HD1 TYR A 118 -8.771 -8.059 -5.531 1.00 15.34 H new ATOM 0 HD2 TYR A 118 -8.497 -7.522 -9.784 1.00 0.41 H new ATOM 0 HE1 TYR A 118 -9.690 -10.338 -5.877 1.00 21.34 H new ATOM 0 HE2 TYR A 118 -9.562 -9.726 -10.140 1.00 24.12 H new ATOM 0 HH TYR A 118 -10.655 -11.571 -8.919 1.00 23.12 H new ATOM 1892 N VAL A 119 -6.017 -4.617 -5.111 1.00 41.42 N ATOM 1893 CA VAL A 119 -4.960 -3.646 -4.843 1.00 20.30 C ATOM 1894 C VAL A 119 -4.113 -3.528 -6.111 1.00 24.41 C ATOM 1895 O VAL A 119 -3.791 -4.548 -6.717 1.00 60.52 O ATOM 1896 CB VAL A 119 -4.146 -4.100 -3.611 1.00 53.43 C ATOM 1897 CG1 VAL A 119 -2.984 -3.146 -3.308 1.00 42.23 C ATOM 1898 CG2 VAL A 119 -5.039 -4.202 -2.362 1.00 61.23 C ATOM 0 H VAL A 119 -5.947 -5.463 -4.545 1.00 41.42 H new ATOM 0 HA VAL A 119 -5.359 -2.660 -4.603 1.00 20.30 H new ATOM 0 HB VAL A 119 -3.742 -5.082 -3.856 1.00 53.43 H new ATOM 0 HG11 VAL A 119 -2.439 -3.503 -2.434 1.00 42.23 H new ATOM 0 HG12 VAL A 119 -2.312 -3.108 -4.165 1.00 42.23 H new ATOM 0 HG13 VAL A 119 -3.375 -2.148 -3.109 1.00 42.23 H new ATOM 0 HG21 VAL A 119 -4.439 -4.524 -1.511 1.00 61.23 H new ATOM 0 HG22 VAL A 119 -5.479 -3.228 -2.149 1.00 61.23 H new ATOM 0 HG23 VAL A 119 -5.833 -4.927 -2.541 1.00 61.23 H new ATOM 1908 N VAL A 120 -3.764 -2.308 -6.514 1.00 53.44 N ATOM 1909 CA VAL A 120 -3.074 -2.016 -7.775 1.00 13.14 C ATOM 1910 C VAL A 120 -1.813 -1.181 -7.556 1.00 52.01 C ATOM 1911 O VAL A 120 -1.165 -0.771 -8.523 1.00 33.34 O ATOM 1912 CB VAL A 120 -4.045 -1.362 -8.778 1.00 23.42 C ATOM 1913 CG1 VAL A 120 -4.974 -2.436 -9.339 1.00 40.03 C ATOM 1914 CG2 VAL A 120 -4.870 -0.207 -8.197 1.00 51.32 C ATOM 0 H VAL A 120 -3.957 -1.473 -5.961 1.00 53.44 H new ATOM 0 HA VAL A 120 -2.738 -2.959 -8.206 1.00 13.14 H new ATOM 0 HB VAL A 120 -3.433 -0.918 -9.563 1.00 23.42 H new ATOM 0 HG11 VAL A 120 -5.665 -1.984 -10.050 1.00 40.03 H new ATOM 0 HG12 VAL A 120 -4.383 -3.201 -9.843 1.00 40.03 H new ATOM 0 HG13 VAL A 120 -5.537 -2.891 -8.525 1.00 40.03 H new ATOM 0 HG21 VAL A 120 -5.526 0.196 -8.969 1.00 51.32 H new ATOM 0 HG22 VAL A 120 -5.471 -0.572 -7.364 1.00 51.32 H new ATOM 0 HG23 VAL A 120 -4.200 0.577 -7.845 1.00 51.32 H new ATOM 1924 N ASP A 121 -1.435 -0.972 -6.294 1.00 64.23 N ATOM 1925 CA ASP A 121 -0.135 -0.405 -5.955 1.00 73.52 C ATOM 1926 C ASP A 121 0.314 -0.866 -4.578 1.00 12.21 C ATOM 1927 O ASP A 121 -0.530 -1.213 -3.751 1.00 4.12 O ATOM 1928 CB ASP A 121 -0.145 1.127 -6.017 1.00 43.12 C ATOM 1929 CG ASP A 121 1.212 1.671 -6.457 1.00 4.14 C ATOM 1930 OD1 ASP A 121 2.061 0.883 -6.936 1.00 71.42 O ATOM 1931 OD2 ASP A 121 1.387 2.908 -6.424 1.00 61.44 O ATOM 0 H ASP A 121 -2.018 -1.190 -5.486 1.00 64.23 H new ATOM 0 HA ASP A 121 0.574 -0.766 -6.700 1.00 73.52 H new ATOM 0 HB2 ASP A 121 -0.916 1.460 -6.712 1.00 43.12 H new ATOM 0 HB3 ASP A 121 -0.402 1.531 -5.038 1.00 43.12 H new ATOM 1936 N CYS A 122 1.626 -0.910 -4.345 1.00 44.41 N ATOM 1937 CA CYS A 122 2.220 -1.432 -3.116 1.00 35.31 C ATOM 1938 C CYS A 122 3.553 -0.705 -2.881 1.00 71.41 C ATOM 1939 O CYS A 122 4.584 -1.151 -3.400 1.00 54.45 O ATOM 1940 CB CYS A 122 2.411 -2.956 -3.298 1.00 54.31 C ATOM 1941 SG CYS A 122 2.681 -3.865 -1.757 1.00 15.41 S ATOM 0 H CYS A 122 2.317 -0.578 -5.018 1.00 44.41 H new ATOM 0 HA CYS A 122 1.587 -1.264 -2.244 1.00 35.31 H new ATOM 0 HB2 CYS A 122 1.531 -3.363 -3.796 1.00 54.31 H new ATOM 0 HB3 CYS A 122 3.260 -3.127 -3.960 1.00 54.31 H new ATOM 0 HG CYS A 122 1.906 -4.908 -1.727 1.00 15.41 H new ATOM 1947 N TYR A 123 3.555 0.420 -2.162 1.00 73.44 N ATOM 1948 CA TYR A 123 4.742 1.224 -1.876 1.00 42.11 C ATOM 1949 C TYR A 123 4.579 1.827 -0.481 1.00 34.11 C ATOM 1950 O TYR A 123 3.500 2.348 -0.206 1.00 35.30 O ATOM 1951 CB TYR A 123 4.865 2.310 -2.952 1.00 24.22 C ATOM 1952 CG TYR A 123 6.213 2.993 -3.034 1.00 61.31 C ATOM 1953 CD1 TYR A 123 7.279 2.361 -3.704 1.00 13.13 C ATOM 1954 CD2 TYR A 123 6.390 4.280 -2.495 1.00 71.15 C ATOM 1955 CE1 TYR A 123 8.527 2.995 -3.807 1.00 13.43 C ATOM 1956 CE2 TYR A 123 7.629 4.934 -2.616 1.00 35.10 C ATOM 1957 CZ TYR A 123 8.715 4.282 -3.245 1.00 53.35 C ATOM 1958 OH TYR A 123 9.924 4.900 -3.356 1.00 35.12 O ATOM 0 H TYR A 123 2.705 0.807 -1.751 1.00 73.44 H new ATOM 0 HA TYR A 123 5.652 0.624 -1.893 1.00 42.11 H new ATOM 0 HB2 TYR A 123 4.643 1.864 -3.921 1.00 24.22 H new ATOM 0 HB3 TYR A 123 4.103 3.068 -2.768 1.00 24.22 H new ATOM 0 HD1 TYR A 123 7.135 1.384 -4.141 1.00 13.13 H new ATOM 0 HD2 TYR A 123 5.572 4.768 -1.986 1.00 71.15 H new ATOM 0 HE1 TYR A 123 9.343 2.502 -4.314 1.00 13.43 H new ATOM 0 HE2 TYR A 123 7.751 5.935 -2.228 1.00 35.10 H new ATOM 0 HH TYR A 123 9.885 5.776 -2.918 1.00 35.12 H new ATOM 1968 N THR A 124 5.576 1.698 0.404 1.00 61.53 N ATOM 1969 CA THR A 124 5.402 1.951 1.839 1.00 2.11 C ATOM 1970 C THR A 124 6.714 2.293 2.567 1.00 31.10 C ATOM 1971 O THR A 124 6.809 2.126 3.785 1.00 13.00 O ATOM 1972 CB THR A 124 4.678 0.723 2.438 1.00 15.24 C ATOM 1973 OG1 THR A 124 3.967 1.042 3.610 1.00 63.22 O ATOM 1974 CG2 THR A 124 5.548 -0.490 2.729 1.00 62.31 C ATOM 0 H THR A 124 6.522 1.416 0.146 1.00 61.53 H new ATOM 0 HA THR A 124 4.797 2.847 1.980 1.00 2.11 H new ATOM 0 HB THR A 124 4.001 0.440 1.632 1.00 15.24 H new ATOM 0 HG1 THR A 124 4.554 1.527 4.227 1.00 63.22 H new ATOM 0 HG21 THR A 124 4.933 -1.288 3.146 1.00 62.31 H new ATOM 0 HG22 THR A 124 6.012 -0.835 1.805 1.00 62.31 H new ATOM 0 HG23 THR A 124 6.323 -0.218 3.445 1.00 62.31 H new ATOM 1982 N GLY A 125 7.774 2.683 1.859 1.00 41.15 N ATOM 1983 CA GLY A 125 9.069 2.925 2.489 1.00 63.14 C ATOM 1984 C GLY A 125 9.890 1.653 2.642 1.00 11.23 C ATOM 1985 O GLY A 125 11.040 1.619 2.205 1.00 74.25 O ATOM 0 H GLY A 125 7.760 2.837 0.851 1.00 41.15 H new ATOM 0 HA2 GLY A 125 9.630 3.646 1.894 1.00 63.14 H new ATOM 0 HA3 GLY A 125 8.914 3.374 3.470 1.00 63.14 H new ATOM 1989 N TRP A 126 9.271 0.565 3.121 1.00 35.32 N ATOM 1990 CA TRP A 126 9.887 -0.759 3.262 1.00 41.35 C ATOM 1991 C TRP A 126 10.666 -1.206 2.027 1.00 24.20 C ATOM 1992 O TRP A 126 11.632 -1.958 2.136 1.00 53.33 O ATOM 1993 CB TRP A 126 8.809 -1.824 3.517 1.00 21.42 C ATOM 1994 CG TRP A 126 8.595 -2.185 4.949 1.00 0.34 C ATOM 1995 CD1 TRP A 126 7.423 -2.212 5.623 1.00 44.31 C ATOM 1996 CD2 TRP A 126 9.614 -2.591 5.907 1.00 71.32 C ATOM 1997 NE1 TRP A 126 7.658 -2.602 6.926 1.00 3.04 N ATOM 1998 CE2 TRP A 126 8.993 -2.846 7.161 1.00 63.35 C ATOM 1999 CE3 TRP A 126 11.011 -2.742 5.836 1.00 24.14 C ATOM 2000 CZ2 TRP A 126 9.729 -3.230 8.290 1.00 51.02 C ATOM 2001 CZ3 TRP A 126 11.762 -3.091 6.969 1.00 44.25 C ATOM 2002 CH2 TRP A 126 11.127 -3.320 8.201 1.00 60.53 C ATOM 0 H TRP A 126 8.299 0.584 3.430 1.00 35.32 H new ATOM 0 HA TRP A 126 10.579 -0.665 4.099 1.00 41.35 H new ATOM 0 HB2 TRP A 126 7.865 -1.468 3.104 1.00 21.42 H new ATOM 0 HB3 TRP A 126 9.077 -2.727 2.968 1.00 21.42 H new ATOM 0 HD1 TRP A 126 6.457 -1.967 5.208 1.00 44.31 H new ATOM 0 HE1 TRP A 126 6.928 -2.698 7.632 1.00 3.04 H new ATOM 0 HE3 TRP A 126 11.514 -2.587 4.893 1.00 24.14 H new ATOM 0 HZ2 TRP A 126 9.226 -3.454 9.219 1.00 51.02 H new ATOM 0 HZ3 TRP A 126 12.835 -3.184 6.893 1.00 44.25 H new ATOM 0 HH2 TRP A 126 11.712 -3.564 9.076 1.00 60.53 H new ATOM 2013 N TYR A 127 10.209 -0.815 0.841 1.00 60.14 N ATOM 2014 CA TYR A 127 10.836 -1.180 -0.415 1.00 31.10 C ATOM 2015 C TYR A 127 11.011 0.063 -1.294 1.00 31.21 C ATOM 2016 O TYR A 127 11.072 -0.049 -2.521 1.00 53.25 O ATOM 2017 CB TYR A 127 10.003 -2.290 -1.068 1.00 4.33 C ATOM 2018 CG TYR A 127 9.925 -3.551 -0.233 1.00 74.22 C ATOM 2019 CD1 TYR A 127 11.049 -4.395 -0.150 1.00 21.41 C ATOM 2020 CD2 TYR A 127 8.775 -3.824 0.533 1.00 40.14 C ATOM 2021 CE1 TYR A 127 11.024 -5.527 0.682 1.00 0.20 C ATOM 2022 CE2 TYR A 127 8.747 -4.954 1.368 1.00 35.50 C ATOM 2023 CZ TYR A 127 9.868 -5.807 1.440 1.00 35.31 C ATOM 2024 OH TYR A 127 9.838 -6.910 2.231 1.00 54.33 O ATOM 0 H TYR A 127 9.382 -0.228 0.729 1.00 60.14 H new ATOM 0 HA TYR A 127 11.840 -1.575 -0.259 1.00 31.10 H new ATOM 0 HB2 TYR A 127 8.994 -1.919 -1.248 1.00 4.33 H new ATOM 0 HB3 TYR A 127 10.432 -2.532 -2.040 1.00 4.33 H new ATOM 0 HD1 TYR A 127 11.934 -4.171 -0.728 1.00 21.41 H new ATOM 0 HD2 TYR A 127 7.919 -3.168 0.479 1.00 40.14 H new ATOM 0 HE1 TYR A 127 11.884 -6.178 0.741 1.00 0.20 H new ATOM 0 HE2 TYR A 127 7.866 -5.169 1.955 1.00 35.50 H new ATOM 0 HH TYR A 127 9.643 -7.700 1.684 1.00 54.33 H new ATOM 2034 N GLY A 128 11.025 1.248 -0.676 1.00 71.21 N ATOM 2035 CA GLY A 128 10.799 2.519 -1.324 1.00 54.03 C ATOM 2036 C GLY A 128 11.685 3.597 -0.745 1.00 33.42 C ATOM 2037 O GLY A 128 11.285 4.302 0.174 1.00 12.03 O ATOM 0 H GLY A 128 11.201 1.339 0.325 1.00 71.21 H new ATOM 0 HA2 GLY A 128 10.990 2.424 -2.393 1.00 54.03 H new ATOM 0 HA3 GLY A 128 9.753 2.806 -1.212 1.00 54.03 H new ATOM 2041 N TYR A 129 12.864 3.750 -1.329 1.00 62.54 N ATOM 2042 CA TYR A 129 13.756 4.879 -1.103 1.00 23.43 C ATOM 2043 C TYR A 129 14.355 4.967 0.305 1.00 53.23 C ATOM 2044 O TYR A 129 14.996 5.971 0.614 1.00 1.03 O ATOM 2045 CB TYR A 129 13.110 6.189 -1.593 1.00 23.12 C ATOM 2046 CG TYR A 129 13.857 6.773 -2.767 1.00 15.40 C ATOM 2047 CD1 TYR A 129 13.645 6.245 -4.054 1.00 52.33 C ATOM 2048 CD2 TYR A 129 14.811 7.784 -2.558 1.00 52.44 C ATOM 2049 CE1 TYR A 129 14.376 6.740 -5.147 1.00 23.42 C ATOM 2050 CE2 TYR A 129 15.542 8.291 -3.644 1.00 0.21 C ATOM 2051 CZ TYR A 129 15.321 7.772 -4.938 1.00 40.24 C ATOM 2052 OH TYR A 129 16.036 8.259 -5.985 1.00 31.11 O ATOM 0 H TYR A 129 13.238 3.072 -1.993 1.00 62.54 H new ATOM 0 HA TYR A 129 14.638 4.696 -1.716 1.00 23.43 H new ATOM 0 HB2 TYR A 129 12.075 6.000 -1.877 1.00 23.12 H new ATOM 0 HB3 TYR A 129 13.090 6.912 -0.778 1.00 23.12 H new ATOM 0 HD1 TYR A 129 12.920 5.459 -4.202 1.00 52.33 H new ATOM 0 HD2 TYR A 129 14.981 8.170 -1.564 1.00 52.44 H new ATOM 0 HE1 TYR A 129 14.218 6.337 -6.136 1.00 23.42 H new ATOM 0 HE2 TYR A 129 16.270 9.074 -3.490 1.00 0.21 H new ATOM 0 HH TYR A 129 16.639 8.964 -5.669 1.00 31.11 H new ATOM 2062 N ASP A 130 14.259 3.924 1.131 1.00 33.52 N ATOM 2063 CA ASP A 130 15.061 3.817 2.344 1.00 15.31 C ATOM 2064 C ASP A 130 16.440 3.265 1.982 1.00 33.14 C ATOM 2065 O ASP A 130 17.466 3.842 2.350 1.00 35.30 O ATOM 2066 CB ASP A 130 14.364 2.911 3.368 1.00 4.13 C ATOM 2067 CG ASP A 130 15.124 2.869 4.702 1.00 62.15 C ATOM 2068 OD1 ASP A 130 16.247 2.316 4.779 1.00 14.43 O ATOM 2069 OD2 ASP A 130 14.542 3.345 5.704 1.00 40.14 O ATOM 0 H ASP A 130 13.628 3.138 0.977 1.00 33.52 H new ATOM 0 HA ASP A 130 15.176 4.803 2.795 1.00 15.31 H new ATOM 0 HB2 ASP A 130 13.349 3.269 3.539 1.00 4.13 H new ATOM 0 HB3 ASP A 130 14.282 1.902 2.964 1.00 4.13 H new ATOM 2074 N LEU A 131 16.485 2.152 1.240 1.00 3.33 N ATOM 2075 CA LEU A 131 17.473 1.124 1.503 1.00 11.23 C ATOM 2076 C LEU A 131 18.177 0.706 0.198 1.00 74.51 C ATOM 2077 O LEU A 131 17.567 0.789 -0.875 1.00 13.30 O ATOM 2078 CB LEU A 131 16.805 0.047 2.376 1.00 61.31 C ATOM 2079 CG LEU A 131 16.025 -1.121 1.774 1.00 11.13 C ATOM 2080 CD1 LEU A 131 14.777 -0.794 0.945 1.00 74.14 C ATOM 2081 CD2 LEU A 131 17.063 -1.948 1.025 1.00 0.04 C ATOM 0 H LEU A 131 15.853 1.951 0.465 1.00 3.33 H new ATOM 0 HA LEU A 131 18.322 1.462 2.097 1.00 11.23 H new ATOM 0 HB2 LEU A 131 17.591 -0.387 2.994 1.00 61.31 H new ATOM 0 HB3 LEU A 131 16.122 0.567 3.047 1.00 61.31 H new ATOM 0 HG LEU A 131 15.546 -1.672 2.583 1.00 11.13 H new ATOM 0 HD11 LEU A 131 14.328 -1.719 0.583 1.00 74.14 H new ATOM 0 HD12 LEU A 131 14.058 -0.260 1.566 1.00 74.14 H new ATOM 0 HD13 LEU A 131 15.057 -0.170 0.096 1.00 74.14 H new ATOM 0 HD21 LEU A 131 16.579 -2.808 0.563 1.00 0.04 H new ATOM 0 HD22 LEU A 131 17.528 -1.335 0.252 1.00 0.04 H new ATOM 0 HD23 LEU A 131 17.826 -2.293 1.723 1.00 0.04 H new ATOM 2093 N PRO A 132 19.458 0.284 0.247 1.00 34.10 N ATOM 2094 CA PRO A 132 20.259 -0.003 -0.940 1.00 55.25 C ATOM 2095 C PRO A 132 19.977 -1.399 -1.503 1.00 13.40 C ATOM 2096 O PRO A 132 19.412 -2.267 -0.835 1.00 61.23 O ATOM 2097 CB PRO A 132 21.718 0.119 -0.484 1.00 13.51 C ATOM 2098 CG PRO A 132 21.658 -0.319 0.976 1.00 20.21 C ATOM 2099 CD PRO A 132 20.285 0.165 1.440 1.00 11.34 C ATOM 0 HA PRO A 132 20.021 0.689 -1.748 1.00 55.25 H new ATOM 0 HB2 PRO A 132 22.379 -0.519 -1.070 1.00 13.51 H new ATOM 0 HB3 PRO A 132 22.089 1.139 -0.585 1.00 13.51 H new ATOM 0 HG2 PRO A 132 21.756 -1.400 1.075 1.00 20.21 H new ATOM 0 HG3 PRO A 132 22.460 0.129 1.562 1.00 20.21 H new ATOM 0 HD2 PRO A 132 19.845 -0.538 2.147 1.00 11.34 H new ATOM 0 HD3 PRO A 132 20.365 1.124 1.952 1.00 11.34 H new ATOM 2107 N ILE A 133 20.478 -1.663 -2.712 1.00 72.25 N ATOM 2108 CA ILE A 133 20.380 -2.953 -3.392 1.00 24.31 C ATOM 2109 C ILE A 133 20.770 -4.149 -2.500 1.00 23.40 C ATOM 2110 O ILE A 133 20.191 -5.239 -2.634 1.00 51.53 O ATOM 2111 CB ILE A 133 21.197 -2.874 -4.698 1.00 73.31 C ATOM 2112 CG1 ILE A 133 20.929 -4.113 -5.559 1.00 23.20 C ATOM 2113 CG2 ILE A 133 22.696 -2.678 -4.439 1.00 60.11 C ATOM 2114 CD1 ILE A 133 21.407 -3.968 -7.004 1.00 32.32 C ATOM 0 H ILE A 133 20.978 -0.963 -3.260 1.00 72.25 H new ATOM 0 HA ILE A 133 19.335 -3.148 -3.634 1.00 24.31 H new ATOM 0 HB ILE A 133 20.868 -1.991 -5.245 1.00 73.31 H new ATOM 0 HG12 ILE A 133 21.422 -4.973 -5.106 1.00 23.20 H new ATOM 0 HG13 ILE A 133 19.859 -4.322 -5.558 1.00 23.20 H new ATOM 0 HG21 ILE A 133 23.226 -2.629 -5.390 1.00 60.11 H new ATOM 0 HG22 ILE A 133 22.852 -1.750 -3.888 1.00 60.11 H new ATOM 0 HG23 ILE A 133 23.077 -3.515 -3.854 1.00 60.11 H new ATOM 0 HD11 ILE A 133 21.185 -4.882 -7.554 1.00 32.32 H new ATOM 0 HD12 ILE A 133 20.895 -3.128 -7.474 1.00 32.32 H new ATOM 0 HD13 ILE A 133 22.482 -3.790 -7.015 1.00 32.32 H new ATOM 2126 N GLY A 134 21.735 -3.946 -1.598 1.00 35.34 N ATOM 2127 CA GLY A 134 22.315 -4.970 -0.750 1.00 22.24 C ATOM 2128 C GLY A 134 21.359 -5.398 0.353 1.00 21.03 C ATOM 2129 O GLY A 134 21.077 -6.590 0.490 1.00 22.31 O ATOM 0 H GLY A 134 22.144 -3.025 -1.439 1.00 35.34 H new ATOM 0 HA2 GLY A 134 22.582 -5.836 -1.356 1.00 22.24 H new ATOM 0 HA3 GLY A 134 23.237 -4.595 -0.306 1.00 22.24 H new ATOM 2133 N GLU A 135 20.818 -4.451 1.119 1.00 1.23 N ATOM 2134 CA GLU A 135 20.017 -4.789 2.292 1.00 32.23 C ATOM 2135 C GLU A 135 18.644 -5.352 1.936 1.00 62.22 C ATOM 2136 O GLU A 135 17.944 -5.827 2.832 1.00 42.42 O ATOM 2137 CB GLU A 135 19.891 -3.595 3.252 1.00 42.45 C ATOM 2138 CG GLU A 135 21.194 -3.334 4.014 1.00 24.31 C ATOM 2139 CD GLU A 135 21.749 -4.604 4.675 1.00 2.10 C ATOM 2140 OE1 GLU A 135 21.036 -5.233 5.491 1.00 54.25 O ATOM 2141 OE2 GLU A 135 22.871 -5.025 4.309 1.00 43.45 O ATOM 0 H GLU A 135 20.920 -3.450 0.949 1.00 1.23 H new ATOM 0 HA GLU A 135 20.556 -5.585 2.805 1.00 32.23 H new ATOM 0 HB2 GLU A 135 19.615 -2.704 2.688 1.00 42.45 H new ATOM 0 HB3 GLU A 135 19.087 -3.784 3.963 1.00 42.45 H new ATOM 0 HG2 GLU A 135 21.938 -2.930 3.328 1.00 24.31 H new ATOM 0 HG3 GLU A 135 21.020 -2.576 4.778 1.00 24.31 H new ATOM 2148 N LEU A 136 18.247 -5.370 0.656 1.00 61.24 N ATOM 2149 CA LEU A 136 16.940 -5.858 0.223 1.00 71.41 C ATOM 2150 C LEU A 136 16.591 -7.193 0.875 1.00 42.02 C ATOM 2151 O LEU A 136 15.562 -7.342 1.527 1.00 62.32 O ATOM 2152 CB LEU A 136 16.894 -5.992 -1.310 1.00 35.14 C ATOM 2153 CG LEU A 136 15.478 -6.391 -1.788 1.00 33.13 C ATOM 2154 CD1 LEU A 136 14.451 -5.369 -1.286 1.00 62.44 C ATOM 2155 CD2 LEU A 136 15.365 -6.590 -3.305 1.00 4.22 C ATOM 0 H LEU A 136 18.833 -5.042 -0.112 1.00 61.24 H new ATOM 0 HA LEU A 136 16.198 -5.126 0.540 1.00 71.41 H new ATOM 0 HB2 LEU A 136 17.185 -5.048 -1.770 1.00 35.14 H new ATOM 0 HB3 LEU A 136 17.616 -6.741 -1.635 1.00 35.14 H new ATOM 0 HG LEU A 136 15.266 -7.368 -1.355 1.00 33.13 H new ATOM 0 HD11 LEU A 136 13.456 -5.656 -1.626 1.00 62.44 H new ATOM 0 HD12 LEU A 136 14.468 -5.341 -0.196 1.00 62.44 H new ATOM 0 HD13 LEU A 136 14.698 -4.382 -1.678 1.00 62.44 H new ATOM 0 HD21 LEU A 136 14.342 -6.868 -3.560 1.00 4.22 H new ATOM 0 HD22 LEU A 136 15.627 -5.662 -3.814 1.00 4.22 H new ATOM 0 HD23 LEU A 136 16.045 -7.381 -3.620 1.00 4.22 H new ATOM 2167 N LYS A 137 17.491 -8.155 0.721 1.00 40.14 N ATOM 2168 CA LYS A 137 17.402 -9.491 1.304 1.00 42.44 C ATOM 2169 C LYS A 137 17.048 -9.500 2.791 1.00 72.35 C ATOM 2170 O LYS A 137 16.141 -10.219 3.208 1.00 54.42 O ATOM 2171 CB LYS A 137 18.638 -10.304 0.974 1.00 24.30 C ATOM 2172 CG LYS A 137 19.948 -9.636 1.387 1.00 20.44 C ATOM 2173 CD LYS A 137 20.711 -10.528 2.364 1.00 0.30 C ATOM 2174 CE LYS A 137 21.317 -11.759 1.674 1.00 54.53 C ATOM 2175 NZ LYS A 137 21.533 -12.863 2.631 1.00 74.02 N ATOM 0 H LYS A 137 18.336 -8.023 0.166 1.00 40.14 H new ATOM 0 HA LYS A 137 16.550 -9.983 0.834 1.00 42.44 H new ATOM 0 HB2 LYS A 137 18.565 -11.274 1.467 1.00 24.30 H new ATOM 0 HB3 LYS A 137 18.661 -10.493 -0.099 1.00 24.30 H new ATOM 0 HG2 LYS A 137 20.560 -9.443 0.506 1.00 20.44 H new ATOM 0 HG3 LYS A 137 19.742 -8.671 1.850 1.00 20.44 H new ATOM 0 HD2 LYS A 137 21.506 -9.950 2.836 1.00 0.30 H new ATOM 0 HD3 LYS A 137 20.038 -10.853 3.158 1.00 0.30 H new ATOM 0 HE2 LYS A 137 20.655 -12.093 0.875 1.00 54.53 H new ATOM 0 HE3 LYS A 137 22.265 -11.488 1.210 1.00 54.53 H new ATOM 0 HZ1 LYS A 137 21.943 -13.679 2.133 1.00 74.02 H new ATOM 0 HZ2 LYS A 137 22.184 -12.551 3.380 1.00 74.02 H new ATOM 0 HZ3 LYS A 137 20.624 -13.138 3.055 1.00 74.02 H new ATOM 2189 N GLN A 138 17.752 -8.707 3.592 1.00 31.43 N ATOM 2190 CA GLN A 138 17.497 -8.564 5.021 1.00 13.40 C ATOM 2191 C GLN A 138 16.170 -7.840 5.268 1.00 72.35 C ATOM 2192 O GLN A 138 15.385 -8.253 6.117 1.00 12.11 O ATOM 2193 CB GLN A 138 18.676 -7.826 5.677 1.00 70.44 C ATOM 2194 CG GLN A 138 18.614 -7.793 7.215 1.00 30.54 C ATOM 2195 CD GLN A 138 18.374 -9.164 7.847 1.00 3.03 C ATOM 2196 OE1 GLN A 138 19.088 -10.125 7.544 1.00 24.23 O ATOM 2197 NE2 GLN A 138 17.353 -9.282 8.680 1.00 1.20 N ATOM 0 H GLN A 138 18.529 -8.136 3.261 1.00 31.43 H new ATOM 0 HA GLN A 138 17.410 -9.552 5.474 1.00 13.40 H new ATOM 0 HB2 GLN A 138 19.607 -8.304 5.371 1.00 70.44 H new ATOM 0 HB3 GLN A 138 18.705 -6.803 5.302 1.00 70.44 H new ATOM 0 HG2 GLN A 138 19.548 -7.384 7.599 1.00 30.54 H new ATOM 0 HG3 GLN A 138 17.818 -7.115 7.524 1.00 30.54 H new ATOM 0 HE21 GLN A 138 16.784 -8.467 8.908 1.00 1.20 H new ATOM 0 HE22 GLN A 138 17.135 -10.188 9.094 1.00 1.20 H new ATOM 2206 N THR A 139 15.889 -6.780 4.516 1.00 71.42 N ATOM 2207 CA THR A 139 14.660 -5.990 4.592 1.00 1.00 C ATOM 2208 C THR A 139 13.423 -6.878 4.364 1.00 44.44 C ATOM 2209 O THR A 139 12.375 -6.681 4.972 1.00 23.34 O ATOM 2210 CB THR A 139 14.762 -4.859 3.552 1.00 75.45 C ATOM 2211 OG1 THR A 139 15.996 -4.175 3.677 1.00 14.40 O ATOM 2212 CG2 THR A 139 13.658 -3.825 3.709 1.00 41.04 C ATOM 0 H THR A 139 16.536 -6.432 3.808 1.00 71.42 H new ATOM 0 HA THR A 139 14.543 -5.556 5.585 1.00 1.00 H new ATOM 0 HB THR A 139 14.673 -5.340 2.578 1.00 75.45 H new ATOM 0 HG1 THR A 139 16.670 -4.611 3.115 1.00 14.40 H new ATOM 0 HG21 THR A 139 13.775 -3.050 2.952 1.00 41.04 H new ATOM 0 HG22 THR A 139 12.688 -4.307 3.587 1.00 41.04 H new ATOM 0 HG23 THR A 139 13.718 -3.376 4.700 1.00 41.04 H new ATOM 2220 N ILE A 140 13.561 -7.912 3.535 1.00 63.35 N ATOM 2221 CA ILE A 140 12.505 -8.872 3.275 1.00 23.20 C ATOM 2222 C ILE A 140 12.225 -9.682 4.550 1.00 3.30 C ATOM 2223 O ILE A 140 11.057 -9.949 4.841 1.00 2.31 O ATOM 2224 CB ILE A 140 12.885 -9.730 2.048 1.00 54.02 C ATOM 2225 CG1 ILE A 140 12.823 -8.928 0.727 1.00 75.44 C ATOM 2226 CG2 ILE A 140 11.945 -10.923 1.925 1.00 0.32 C ATOM 2227 CD1 ILE A 140 13.592 -9.621 -0.407 1.00 31.53 C ATOM 0 H ILE A 140 14.422 -8.103 3.022 1.00 63.35 H new ATOM 0 HA ILE A 140 11.569 -8.374 3.021 1.00 23.20 H new ATOM 0 HB ILE A 140 13.911 -10.061 2.208 1.00 54.02 H new ATOM 0 HG12 ILE A 140 11.782 -8.797 0.431 1.00 75.44 H new ATOM 0 HG13 ILE A 140 13.236 -7.932 0.888 1.00 75.44 H new ATOM 0 HG21 ILE A 140 12.225 -11.519 1.056 1.00 0.32 H new ATOM 0 HG22 ILE A 140 12.016 -11.536 2.823 1.00 0.32 H new ATOM 0 HG23 ILE A 140 10.921 -10.569 1.808 1.00 0.32 H new ATOM 0 HD11 ILE A 140 13.520 -9.021 -1.315 1.00 31.53 H new ATOM 0 HD12 ILE A 140 14.639 -9.728 -0.124 1.00 31.53 H new ATOM 0 HD13 ILE A 140 13.163 -10.606 -0.588 1.00 31.53 H new ATOM 2239 N GLN A 141 13.264 -10.080 5.297 1.00 51.44 N ATOM 2240 CA GLN A 141 13.113 -10.827 6.544 1.00 2.14 C ATOM 2241 C GLN A 141 12.376 -9.981 7.555 1.00 62.45 C ATOM 2242 O GLN A 141 11.404 -10.431 8.149 1.00 41.42 O ATOM 2243 CB GLN A 141 14.446 -11.277 7.153 1.00 24.31 C ATOM 2244 CG GLN A 141 15.401 -11.863 6.124 1.00 13.11 C ATOM 2245 CD GLN A 141 14.753 -12.927 5.228 1.00 72.42 C ATOM 2246 OE1 GLN A 141 14.149 -13.896 5.696 1.00 71.12 O ATOM 2247 NE2 GLN A 141 14.854 -12.741 3.917 1.00 73.13 N ATOM 0 H GLN A 141 14.235 -9.890 5.048 1.00 51.44 H new ATOM 0 HA GLN A 141 12.551 -11.728 6.297 1.00 2.14 H new ATOM 0 HB2 GLN A 141 14.922 -10.426 7.640 1.00 24.31 H new ATOM 0 HB3 GLN A 141 14.253 -12.020 7.927 1.00 24.31 H new ATOM 0 HG2 GLN A 141 15.788 -11.058 5.499 1.00 13.11 H new ATOM 0 HG3 GLN A 141 16.254 -12.304 6.640 1.00 13.11 H new ATOM 0 HE21 GLN A 141 15.358 -11.932 3.554 1.00 73.13 H new ATOM 0 HE22 GLN A 141 14.427 -13.407 3.273 1.00 73.13 H new ATOM 2256 N ASN A 142 12.823 -8.737 7.678 1.00 51.04 N ATOM 2257 CA ASN A 142 12.254 -7.785 8.624 1.00 25.42 C ATOM 2258 C ASN A 142 10.727 -7.703 8.477 1.00 5.13 C ATOM 2259 O ASN A 142 10.006 -7.674 9.475 1.00 14.31 O ATOM 2260 CB ASN A 142 12.857 -6.392 8.441 1.00 53.43 C ATOM 2261 CG ASN A 142 14.244 -6.195 9.032 1.00 10.14 C ATOM 2262 OD1 ASN A 142 14.396 -5.867 10.203 1.00 62.34 O ATOM 2263 ND2 ASN A 142 15.296 -6.336 8.246 1.00 5.24 N ATOM 0 H ASN A 142 13.591 -8.359 7.124 1.00 51.04 H new ATOM 0 HA ASN A 142 12.496 -8.145 9.624 1.00 25.42 H new ATOM 0 HB2 ASN A 142 12.901 -6.172 7.374 1.00 53.43 H new ATOM 0 HB3 ASN A 142 12.183 -5.662 8.889 1.00 53.43 H new ATOM 0 HD21 ASN A 142 16.233 -6.172 8.614 1.00 5.24 H new ATOM 0 HD22 ASN A 142 15.171 -6.609 7.271 1.00 5.24 H new ATOM 2270 N VAL A 143 10.224 -7.735 7.238 1.00 63.22 N ATOM 2271 CA VAL A 143 8.794 -7.636 6.959 1.00 43.24 C ATOM 2272 C VAL A 143 8.054 -8.905 7.398 1.00 54.12 C ATOM 2273 O VAL A 143 6.911 -8.827 7.842 1.00 43.41 O ATOM 2274 CB VAL A 143 8.609 -7.298 5.464 1.00 12.40 C ATOM 2275 CG1 VAL A 143 7.180 -7.496 4.951 1.00 41.13 C ATOM 2276 CG2 VAL A 143 8.990 -5.830 5.229 1.00 71.22 C ATOM 0 H VAL A 143 10.801 -7.830 6.402 1.00 63.22 H new ATOM 0 HA VAL A 143 8.346 -6.832 7.543 1.00 43.24 H new ATOM 0 HB VAL A 143 9.251 -7.989 4.918 1.00 12.40 H new ATOM 0 HG11 VAL A 143 7.134 -7.237 3.893 1.00 41.13 H new ATOM 0 HG12 VAL A 143 6.887 -8.538 5.083 1.00 41.13 H new ATOM 0 HG13 VAL A 143 6.500 -6.854 5.511 1.00 41.13 H new ATOM 0 HG21 VAL A 143 8.861 -5.585 4.175 1.00 71.22 H new ATOM 0 HG22 VAL A 143 8.349 -5.187 5.832 1.00 71.22 H new ATOM 0 HG23 VAL A 143 10.031 -5.674 5.513 1.00 71.22 H new ATOM 2286 N LYS A 144 8.667 -10.090 7.308 1.00 63.13 N ATOM 2287 CA LYS A 144 8.031 -11.325 7.780 1.00 22.51 C ATOM 2288 C LYS A 144 7.737 -11.223 9.278 1.00 64.12 C ATOM 2289 O LYS A 144 6.710 -11.717 9.742 1.00 32.30 O ATOM 2290 CB LYS A 144 8.962 -12.526 7.544 1.00 72.33 C ATOM 2291 CG LYS A 144 9.167 -12.868 6.071 1.00 25.14 C ATOM 2292 CD LYS A 144 10.417 -13.746 5.870 1.00 12.21 C ATOM 2293 CE LYS A 144 11.182 -13.251 4.644 1.00 22.11 C ATOM 2294 NZ LYS A 144 10.664 -13.817 3.376 1.00 73.11 N ATOM 0 H LYS A 144 9.599 -10.220 6.914 1.00 63.13 H new ATOM 0 HA LYS A 144 7.102 -11.465 7.227 1.00 22.51 H new ATOM 0 HB2 LYS A 144 9.931 -12.317 7.997 1.00 72.33 H new ATOM 0 HB3 LYS A 144 8.553 -13.397 8.056 1.00 72.33 H new ATOM 0 HG2 LYS A 144 8.289 -13.389 5.691 1.00 25.14 H new ATOM 0 HG3 LYS A 144 9.268 -11.950 5.493 1.00 25.14 H new ATOM 0 HD2 LYS A 144 11.054 -13.702 6.754 1.00 12.21 H new ATOM 0 HD3 LYS A 144 10.127 -14.788 5.737 1.00 12.21 H new ATOM 0 HE2 LYS A 144 11.125 -12.163 4.601 1.00 22.11 H new ATOM 0 HE3 LYS A 144 12.235 -13.511 4.749 1.00 22.11 H new ATOM 0 HZ1 LYS A 144 11.261 -13.501 2.585 1.00 73.11 H new ATOM 0 HZ2 LYS A 144 10.679 -14.856 3.428 1.00 73.11 H new ATOM 0 HZ3 LYS A 144 9.688 -13.492 3.224 1.00 73.11 H new ATOM 2308 N GLU A 145 8.665 -10.637 10.025 1.00 44.34 N ATOM 2309 CA GLU A 145 8.654 -10.486 11.465 1.00 2.33 C ATOM 2310 C GLU A 145 7.587 -9.456 11.874 1.00 41.42 C ATOM 2311 O GLU A 145 6.776 -9.748 12.751 1.00 54.45 O ATOM 2312 CB GLU A 145 10.094 -10.123 11.882 1.00 10.03 C ATOM 2313 CG GLU A 145 11.098 -11.204 11.407 1.00 24.34 C ATOM 2314 CD GLU A 145 12.588 -10.843 11.483 1.00 41.41 C ATOM 2315 OE1 GLU A 145 12.948 -9.645 11.559 1.00 32.54 O ATOM 2316 OE2 GLU A 145 13.416 -11.777 11.306 1.00 54.45 O ATOM 0 H GLU A 145 9.500 -10.228 9.606 1.00 44.34 H new ATOM 0 HA GLU A 145 8.371 -11.400 11.988 1.00 2.33 H new ATOM 0 HB2 GLU A 145 10.367 -9.157 11.458 1.00 10.03 H new ATOM 0 HB3 GLU A 145 10.148 -10.022 12.966 1.00 10.03 H new ATOM 0 HG2 GLU A 145 10.935 -12.104 12.001 1.00 24.34 H new ATOM 0 HG3 GLU A 145 10.862 -11.457 10.373 1.00 24.34 H new ATOM 2323 N GLU A 146 7.500 -8.303 11.190 1.00 53.31 N ATOM 2324 CA GLU A 146 6.392 -7.351 11.377 1.00 21.41 C ATOM 2325 C GLU A 146 5.046 -8.011 11.052 1.00 14.11 C ATOM 2326 O GLU A 146 4.086 -7.886 11.817 1.00 71.32 O ATOM 2327 CB GLU A 146 6.569 -6.102 10.503 1.00 10.31 C ATOM 2328 CG GLU A 146 7.531 -5.047 11.062 1.00 4.23 C ATOM 2329 CD GLU A 146 6.986 -3.623 10.839 1.00 74.24 C ATOM 2330 OE1 GLU A 146 6.727 -3.233 9.673 1.00 74.51 O ATOM 2331 OE2 GLU A 146 6.731 -2.891 11.824 1.00 64.14 O ATOM 0 H GLU A 146 8.188 -8.006 10.498 1.00 53.31 H new ATOM 0 HA GLU A 146 6.403 -7.048 12.424 1.00 21.41 H new ATOM 0 HB2 GLU A 146 6.926 -6.413 9.521 1.00 10.31 H new ATOM 0 HB3 GLU A 146 5.593 -5.639 10.356 1.00 10.31 H new ATOM 0 HG2 GLU A 146 7.684 -5.218 12.128 1.00 4.23 H new ATOM 0 HG3 GLU A 146 8.504 -5.147 10.581 1.00 4.23 H new ATOM 2338 N ASN A 147 4.978 -8.768 9.951 1.00 11.31 N ATOM 2339 CA ASN A 147 3.761 -9.458 9.529 1.00 13.23 C ATOM 2340 C ASN A 147 3.277 -10.450 10.586 1.00 52.31 C ATOM 2341 O ASN A 147 2.104 -10.831 10.580 1.00 73.41 O ATOM 2342 CB ASN A 147 3.980 -10.215 8.206 1.00 1.01 C ATOM 2343 CG ASN A 147 4.014 -9.322 6.975 1.00 33.13 C ATOM 2344 OD1 ASN A 147 3.707 -8.141 7.023 1.00 24.44 O ATOM 2345 ND2 ASN A 147 4.328 -9.889 5.824 1.00 52.05 N ATOM 0 H ASN A 147 5.771 -8.918 9.327 1.00 11.31 H new ATOM 0 HA ASN A 147 3.002 -8.688 9.389 1.00 13.23 H new ATOM 0 HB2 ASN A 147 4.918 -10.767 8.267 1.00 1.01 H new ATOM 0 HB3 ASN A 147 3.185 -10.951 8.085 1.00 1.01 H new ATOM 0 HD21 ASN A 147 4.315 -9.340 4.965 1.00 52.05 H new ATOM 0 HD22 ASN A 147 4.583 -10.876 5.795 1.00 52.05 H new ATOM 2352 N ALA A 148 4.162 -10.914 11.473 1.00 74.42 N ATOM 2353 CA ALA A 148 3.789 -11.812 12.548 1.00 4.22 C ATOM 2354 C ALA A 148 3.109 -11.061 13.701 1.00 72.11 C ATOM 2355 O ALA A 148 2.297 -11.660 14.405 1.00 31.12 O ATOM 2356 CB ALA A 148 5.027 -12.554 13.051 1.00 4.14 C ATOM 0 H ALA A 148 5.153 -10.673 11.459 1.00 74.42 H new ATOM 0 HA ALA A 148 3.069 -12.531 12.157 1.00 4.22 H new ATOM 0 HB1 ALA A 148 4.744 -13.228 13.859 1.00 4.14 H new ATOM 0 HB2 ALA A 148 5.463 -13.129 12.234 1.00 4.14 H new ATOM 0 HB3 ALA A 148 5.758 -11.834 13.419 1.00 4.14 H new ATOM 2362 N ALA A 149 3.417 -9.778 13.914 1.00 32.13 N ATOM 2363 CA ALA A 149 2.733 -8.954 14.907 1.00 2.44 C ATOM 2364 C ALA A 149 1.302 -8.690 14.444 1.00 23.40 C ATOM 2365 O ALA A 149 0.367 -9.105 15.121 1.00 73.33 O ATOM 2366 CB ALA A 149 3.510 -7.652 15.154 1.00 34.20 C ATOM 0 H ALA A 149 4.148 -9.284 13.401 1.00 32.13 H new ATOM 0 HA ALA A 149 2.690 -9.482 15.859 1.00 2.44 H new ATOM 0 HB1 ALA A 149 2.986 -7.051 15.897 1.00 34.20 H new ATOM 0 HB2 ALA A 149 4.510 -7.888 15.519 1.00 34.20 H new ATOM 0 HB3 ALA A 149 3.587 -7.092 14.222 1.00 34.20 H new ATOM 2372 N PHE A 150 1.124 -8.082 13.266 1.00 72.24 N ATOM 2373 CA PHE A 150 -0.201 -7.713 12.762 1.00 41.21 C ATOM 2374 C PHE A 150 -1.149 -8.920 12.719 1.00 32.22 C ATOM 2375 O PHE A 150 -2.294 -8.837 13.173 1.00 41.32 O ATOM 2376 CB PHE A 150 -0.073 -7.053 11.382 1.00 70.53 C ATOM 2377 CG PHE A 150 -1.410 -6.737 10.736 1.00 73.52 C ATOM 2378 CD1 PHE A 150 -2.059 -5.515 10.986 1.00 41.15 C ATOM 2379 CD2 PHE A 150 -2.029 -7.693 9.911 1.00 74.14 C ATOM 2380 CE1 PHE A 150 -3.311 -5.253 10.403 1.00 53.12 C ATOM 2381 CE2 PHE A 150 -3.270 -7.426 9.310 1.00 71.13 C ATOM 2382 CZ PHE A 150 -3.906 -6.198 9.550 1.00 63.22 C ATOM 0 H PHE A 150 1.890 -7.834 12.640 1.00 72.24 H new ATOM 0 HA PHE A 150 -0.640 -6.993 13.452 1.00 41.21 H new ATOM 0 HB2 PHE A 150 0.501 -6.132 11.480 1.00 70.53 H new ATOM 0 HB3 PHE A 150 0.493 -7.712 10.724 1.00 70.53 H new ATOM 0 HD1 PHE A 150 -1.596 -4.778 11.626 1.00 41.15 H new ATOM 0 HD2 PHE A 150 -1.545 -8.643 9.738 1.00 74.14 H new ATOM 0 HE1 PHE A 150 -3.817 -4.322 10.611 1.00 53.12 H new ATOM 0 HE2 PHE A 150 -3.732 -8.161 8.667 1.00 71.13 H new ATOM 0 HZ PHE A 150 -4.853 -5.979 9.079 1.00 63.22 H new ATOM 2392 N LYS A 151 -0.683 -10.070 12.208 1.00 5.20 N ATOM 2393 CA LYS A 151 -1.532 -11.258 12.124 1.00 54.11 C ATOM 2394 C LYS A 151 -1.967 -11.774 13.497 1.00 31.33 C ATOM 2395 O LYS A 151 -2.928 -12.529 13.553 1.00 13.32 O ATOM 2396 CB LYS A 151 -0.892 -12.357 11.266 1.00 43.25 C ATOM 2397 CG LYS A 151 0.100 -13.216 12.053 1.00 1.43 C ATOM 2398 CD LYS A 151 0.628 -14.414 11.266 1.00 33.33 C ATOM 2399 CE LYS A 151 1.554 -13.984 10.129 1.00 11.14 C ATOM 2400 NZ LYS A 151 2.154 -15.155 9.464 1.00 71.53 N ATOM 0 H LYS A 151 0.264 -10.198 11.852 1.00 5.20 H new ATOM 0 HA LYS A 151 -2.446 -10.949 11.617 1.00 54.11 H new ATOM 0 HB2 LYS A 151 -1.675 -12.996 10.857 1.00 43.25 H new ATOM 0 HB3 LYS A 151 -0.379 -11.900 10.420 1.00 43.25 H new ATOM 0 HG2 LYS A 151 0.941 -12.595 12.361 1.00 1.43 H new ATOM 0 HG3 LYS A 151 -0.383 -13.573 12.963 1.00 1.43 H new ATOM 0 HD2 LYS A 151 1.165 -15.082 11.939 1.00 33.33 H new ATOM 0 HD3 LYS A 151 -0.210 -14.979 10.858 1.00 33.33 H new ATOM 0 HE2 LYS A 151 0.994 -13.396 9.402 1.00 11.14 H new ATOM 0 HE3 LYS A 151 2.342 -13.341 10.521 1.00 11.14 H new ATOM 0 HZ1 LYS A 151 2.778 -14.836 8.696 1.00 71.53 H new ATOM 0 HZ2 LYS A 151 2.707 -15.701 10.155 1.00 71.53 H new ATOM 0 HZ3 LYS A 151 1.401 -15.755 9.071 1.00 71.53 H new ATOM 2414 N GLU A 152 -1.279 -11.423 14.585 1.00 14.42 N ATOM 2415 CA GLU A 152 -1.652 -11.873 15.920 1.00 1.22 C ATOM 2416 C GLU A 152 -3.032 -11.308 16.301 1.00 23.14 C ATOM 2417 O GLU A 152 -3.809 -11.962 17.001 1.00 14.20 O ATOM 2418 CB GLU A 152 -0.527 -11.500 16.902 1.00 64.25 C ATOM 2419 CG GLU A 152 -0.521 -12.359 18.176 1.00 74.53 C ATOM 2420 CD GLU A 152 -1.074 -11.645 19.410 1.00 30.41 C ATOM 2421 OE1 GLU A 152 -0.475 -10.637 19.854 1.00 1.20 O ATOM 2422 OE2 GLU A 152 -2.094 -12.107 19.973 1.00 43.25 O ATOM 0 H GLU A 152 -0.454 -10.823 14.563 1.00 14.42 H new ATOM 0 HA GLU A 152 -1.759 -12.957 15.956 1.00 1.22 H new ATOM 0 HB2 GLU A 152 0.434 -11.603 16.398 1.00 64.25 H new ATOM 0 HB3 GLU A 152 -0.630 -10.451 17.180 1.00 64.25 H new ATOM 0 HG2 GLU A 152 -1.107 -13.260 17.997 1.00 74.53 H new ATOM 0 HG3 GLU A 152 0.501 -12.679 18.381 1.00 74.53 H new ATOM 2429 N ILE A 153 -3.366 -10.126 15.773 1.00 73.21 N ATOM 2430 CA ILE A 153 -4.610 -9.402 16.008 1.00 44.15 C ATOM 2431 C ILE A 153 -5.603 -9.690 14.877 1.00 30.44 C ATOM 2432 O ILE A 153 -6.791 -9.899 15.147 1.00 3.12 O ATOM 2433 CB ILE A 153 -4.312 -7.891 16.094 1.00 73.25 C ATOM 2434 CG1 ILE A 153 -3.184 -7.595 17.115 1.00 34.44 C ATOM 2435 CG2 ILE A 153 -5.578 -7.091 16.461 1.00 65.15 C ATOM 2436 CD1 ILE A 153 -2.832 -6.114 17.271 1.00 11.30 C ATOM 0 H ILE A 153 -2.742 -9.627 15.139 1.00 73.21 H new ATOM 0 HA ILE A 153 -5.054 -9.731 16.948 1.00 44.15 H new ATOM 0 HB ILE A 153 -3.976 -7.574 15.107 1.00 73.25 H new ATOM 0 HG12 ILE A 153 -3.481 -7.988 18.087 1.00 34.44 H new ATOM 0 HG13 ILE A 153 -2.288 -8.137 16.813 1.00 34.44 H new ATOM 0 HG21 ILE A 153 -5.335 -6.030 16.514 1.00 65.15 H new ATOM 0 HG22 ILE A 153 -6.343 -7.251 15.701 1.00 65.15 H new ATOM 0 HG23 ILE A 153 -5.952 -7.426 17.428 1.00 65.15 H new ATOM 0 HD11 ILE A 153 -2.034 -6.005 18.005 1.00 11.30 H new ATOM 0 HD12 ILE A 153 -2.500 -5.716 16.312 1.00 11.30 H new ATOM 0 HD13 ILE A 153 -3.711 -5.564 17.607 1.00 11.30 H new ATOM 2448 N HIS A 154 -5.142 -9.690 13.624 1.00 70.53 N ATOM 2449 CA HIS A 154 -5.983 -9.763 12.435 1.00 62.15 C ATOM 2450 C HIS A 154 -5.487 -10.890 11.504 1.00 1.31 C ATOM 2451 O HIS A 154 -4.962 -10.602 10.428 1.00 45.13 O ATOM 2452 CB HIS A 154 -5.997 -8.368 11.786 1.00 11.00 C ATOM 2453 CG HIS A 154 -6.691 -7.300 12.612 1.00 63.44 C ATOM 2454 ND1 HIS A 154 -7.979 -7.340 13.116 1.00 5.10 N ATOM 2455 CD2 HIS A 154 -6.152 -6.089 12.962 1.00 61.35 C ATOM 2456 CE1 HIS A 154 -8.202 -6.179 13.758 1.00 23.51 C ATOM 2457 NE2 HIS A 154 -7.133 -5.370 13.663 1.00 43.45 N ATOM 0 H HIS A 154 -4.147 -9.638 13.407 1.00 70.53 H new ATOM 0 HA HIS A 154 -7.013 -10.026 12.678 1.00 62.15 H new ATOM 0 HB2 HIS A 154 -4.969 -8.056 11.601 1.00 11.00 H new ATOM 0 HB3 HIS A 154 -6.489 -8.437 10.816 1.00 11.00 H new ATOM 0 HD2 HIS A 154 -5.152 -5.749 12.738 1.00 61.35 H new ATOM 0 HE1 HIS A 154 -9.115 -5.931 14.279 1.00 23.51 H new ATOM 0 HE2 HIS A 154 -7.051 -4.421 14.028 1.00 43.45 H new ATOM 2465 N PRO A 155 -5.625 -12.170 11.898 1.00 54.45 N ATOM 2466 CA PRO A 155 -5.004 -13.313 11.224 1.00 74.12 C ATOM 2467 C PRO A 155 -5.595 -13.630 9.853 1.00 12.42 C ATOM 2468 O PRO A 155 -6.819 -13.465 9.652 1.00 21.51 O ATOM 2469 CB PRO A 155 -5.155 -14.502 12.182 1.00 53.43 C ATOM 2470 CG PRO A 155 -6.309 -14.106 13.101 1.00 45.22 C ATOM 2471 CD PRO A 155 -6.219 -12.584 13.160 1.00 42.12 C ATOM 0 HA PRO A 155 -3.961 -13.081 11.010 1.00 74.12 H new ATOM 0 HB2 PRO A 155 -5.376 -15.422 11.641 1.00 53.43 H new ATOM 0 HB3 PRO A 155 -4.239 -14.676 12.747 1.00 53.43 H new ATOM 0 HG2 PRO A 155 -7.269 -14.435 12.703 1.00 45.22 H new ATOM 0 HG3 PRO A 155 -6.204 -14.552 14.090 1.00 45.22 H new ATOM 0 HD2 PRO A 155 -7.205 -12.139 13.292 1.00 42.12 H new ATOM 0 HD3 PRO A 155 -5.609 -12.261 14.003 1.00 42.12 H new TER 2479 PRO A 155