USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 984 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 115 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 118 CYS SG : rot -15:sc= 1.04 USER MOD Set 1.3: A 119 GLN : amide:sc= -2.24! C(o=-1.2!,f=-1.9!) USER MOD Set 2.1: A 98 THR OG1 : rot -177:sc= 0 USER MOD Set 2.2: A 111 LYS NZ :NH3+ -133:sc= -2.13! (180deg=-5.96!) USER MOD Set 3.1: A 42 LYS NZ :NH3+ -175:sc= 0.208 (180deg=0) USER MOD Set 3.2: A 77 GLN : amide:sc= -2 K(o=-1.8,f=-5.3!) USER MOD Set 4.1: A 37 TYR OH : rot 0:sc= 0.969 USER MOD Set 4.2: A 39 SER OG : rot 155:sc= 0.00292 USER MOD Set 4.3: A 53 CYS SG : rot 33:sc= -0.0878 USER MOD Set 4.4: A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.0947 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0058 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS : no HE2:sc= -3.49 X(o=-3.5,f=-3.4!) USER MOD Single : A 31 SER OG : rot 37:sc= 0.183 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -161:sc= 0.133 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -20:sc= 0.341 USER MOD Single : A 47 LYS NZ :NH3+ 166:sc= -0.298 (180deg=-0.569) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 180:sc= -1.38 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.244 X(o=-0.24,f=-0.0041) USER MOD Single : A 68 THR OG1 : rot -50:sc= 0.37 USER MOD Single : A 71 CYS SG : rot 160:sc= 0.506 USER MOD Single : A 76 CYS SG : rot 180:sc= -0.579 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -158:sc=-0.00747 (180deg=-0.61) USER MOD Single : A 88 ASN : amide:sc= -0.0881 X(o=-0.088,f=-0.11) USER MOD Single : A 89 ASN : amide:sc= -4.25! C(o=-4.2!,f=-15!) USER MOD Single : A 93 GLN : amide:sc= -0.0528 X(o=-0.053,f=-0.11) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.0753) USER MOD Single : A 102 THR OG1 : rot -23:sc= 0.661 USER MOD Single : A 105 LYS NZ :NH3+ -151:sc= 1.34 (180deg=0.264) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -6:sc= -0.406 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 CYS SG : rot 29:sc= -0.233 USER MOD Single : A 120 SER OG : rot 180:sc= 0.077 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 148:sc= -0.402 (180deg=-1.42!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.157 21.985 20.857 1.00 0.00 N ATOM 2 CA GLY A 1 3.567 21.466 19.565 1.00 0.00 C ATOM 3 C GLY A 1 3.788 22.563 18.543 1.00 0.00 C ATOM 4 O GLY A 1 3.643 23.746 18.851 1.00 0.00 O ATOM 0 H1 GLY A 1 3.844 21.694 21.582 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.115 23.023 20.817 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.218 21.610 21.100 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.487 20.893 19.682 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.807 20.777 19.196 1.00 0.00 H new ATOM 8 N SER A 2 4.141 22.170 17.323 1.00 0.00 N ATOM 9 CA SER A 2 4.388 23.130 16.253 1.00 0.00 C ATOM 10 C SER A 2 3.361 22.973 15.136 1.00 0.00 C ATOM 11 O SER A 2 3.183 21.885 14.591 1.00 0.00 O ATOM 12 CB SER A 2 5.800 22.948 15.692 1.00 0.00 C ATOM 13 OG SER A 2 6.759 23.605 16.503 1.00 0.00 O ATOM 0 H SER A 2 4.262 21.194 17.051 1.00 0.00 H new ATOM 0 HA SER A 2 4.297 24.133 16.669 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.037 21.886 15.631 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.845 23.343 14.677 1.00 0.00 H new ATOM 0 HG SER A 2 7.653 23.473 16.125 1.00 0.00 H new ATOM 19 N GLU A 3 2.688 24.070 14.801 1.00 0.00 N ATOM 20 CA GLU A 3 1.677 24.054 13.750 1.00 0.00 C ATOM 21 C GLU A 3 2.189 23.320 12.515 1.00 0.00 C ATOM 22 O GLU A 3 3.395 23.234 12.285 1.00 0.00 O ATOM 23 CB GLU A 3 1.276 25.483 13.377 1.00 0.00 C ATOM 24 CG GLU A 3 0.548 26.220 14.489 1.00 0.00 C ATOM 25 CD GLU A 3 -0.718 25.510 14.929 1.00 0.00 C ATOM 26 OE1 GLU A 3 -1.657 25.410 14.112 1.00 0.00 O ATOM 27 OE2 GLU A 3 -0.769 25.055 16.091 1.00 0.00 O ATOM 0 H GLU A 3 2.825 24.980 15.242 1.00 0.00 H new ATOM 0 HA GLU A 3 0.803 23.525 14.130 1.00 0.00 H new ATOM 0 HB2 GLU A 3 2.171 26.044 13.106 1.00 0.00 H new ATOM 0 HB3 GLU A 3 0.638 25.454 12.494 1.00 0.00 H new ATOM 0 HG2 GLU A 3 1.215 26.329 15.344 1.00 0.00 H new ATOM 0 HG3 GLU A 3 0.297 27.225 14.150 1.00 0.00 H new ATOM 34 N GLY A 4 1.262 22.790 11.722 1.00 0.00 N ATOM 35 CA GLY A 4 1.638 22.068 10.520 1.00 0.00 C ATOM 36 C GLY A 4 2.051 20.638 10.807 1.00 0.00 C ATOM 37 O GLY A 4 3.198 20.376 11.165 1.00 0.00 O ATOM 0 H GLY A 4 0.258 22.848 11.891 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.800 22.068 9.823 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.460 22.589 10.029 1.00 0.00 H new ATOM 41 N ALA A 5 1.111 19.711 10.652 1.00 0.00 N ATOM 42 CA ALA A 5 1.383 18.300 10.897 1.00 0.00 C ATOM 43 C ALA A 5 0.867 17.434 9.753 1.00 0.00 C ATOM 44 O ALA A 5 0.051 17.878 8.946 1.00 0.00 O ATOM 45 CB ALA A 5 0.760 17.863 12.215 1.00 0.00 C ATOM 0 H ALA A 5 0.155 19.912 10.358 1.00 0.00 H new ATOM 0 HA ALA A 5 2.463 18.169 10.958 1.00 0.00 H new ATOM 0 HB1 ALA A 5 0.971 16.807 12.385 1.00 0.00 H new ATOM 0 HB2 ALA A 5 1.181 18.453 13.029 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -0.319 18.016 12.176 1.00 0.00 H new ATOM 51 N ALA A 6 1.350 16.198 9.688 1.00 0.00 N ATOM 52 CA ALA A 6 0.936 15.270 8.643 1.00 0.00 C ATOM 53 C ALA A 6 1.328 13.839 8.992 1.00 0.00 C ATOM 54 O ALA A 6 2.473 13.568 9.357 1.00 0.00 O ATOM 55 CB ALA A 6 1.543 15.674 7.307 1.00 0.00 C ATOM 0 H ALA A 6 2.029 15.816 10.347 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.150 15.312 8.564 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.225 14.972 6.536 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.209 16.678 7.044 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.630 15.662 7.383 1.00 0.00 H new ATOM 61 N THR A 7 0.370 12.923 8.880 1.00 0.00 N ATOM 62 CA THR A 7 0.615 11.520 9.186 1.00 0.00 C ATOM 63 C THR A 7 1.177 10.783 7.976 1.00 0.00 C ATOM 64 O THR A 7 0.655 10.902 6.867 1.00 0.00 O ATOM 65 CB THR A 7 -0.673 10.813 9.651 1.00 0.00 C ATOM 66 OG1 THR A 7 -1.741 11.093 8.739 1.00 0.00 O ATOM 67 CG2 THR A 7 -1.062 11.264 11.050 1.00 0.00 C ATOM 0 H THR A 7 -0.583 13.129 8.579 1.00 0.00 H new ATOM 0 HA THR A 7 1.346 11.496 9.994 1.00 0.00 H new ATOM 0 HB THR A 7 -0.486 9.739 9.672 1.00 0.00 H new ATOM 0 HG1 THR A 7 -2.556 10.639 9.040 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.974 10.752 11.357 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.259 11.023 11.746 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.233 12.341 11.051 1.00 0.00 H new ATOM 75 N MET A 8 2.242 10.020 8.195 1.00 0.00 N ATOM 76 CA MET A 8 2.874 9.262 7.121 1.00 0.00 C ATOM 77 C MET A 8 2.044 8.032 6.764 1.00 0.00 C ATOM 78 O MET A 8 1.036 7.744 7.408 1.00 0.00 O ATOM 79 CB MET A 8 4.286 8.837 7.529 1.00 0.00 C ATOM 80 CG MET A 8 5.326 9.930 7.346 1.00 0.00 C ATOM 81 SD MET A 8 5.795 10.160 5.620 1.00 0.00 S ATOM 82 CE MET A 8 6.193 11.906 5.606 1.00 0.00 C ATOM 0 H MET A 8 2.686 9.910 9.107 1.00 0.00 H new ATOM 0 HA MET A 8 2.936 9.906 6.243 1.00 0.00 H new ATOM 0 HB2 MET A 8 4.276 8.528 8.574 1.00 0.00 H new ATOM 0 HB3 MET A 8 4.579 7.966 6.942 1.00 0.00 H new ATOM 0 HG2 MET A 8 4.935 10.868 7.740 1.00 0.00 H new ATOM 0 HG3 MET A 8 6.213 9.684 7.930 1.00 0.00 H new ATOM 0 HE1 MET A 8 6.502 12.201 4.603 1.00 0.00 H new ATOM 0 HE2 MET A 8 5.315 12.482 5.899 1.00 0.00 H new ATOM 0 HE3 MET A 8 7.005 12.100 6.307 1.00 0.00 H new ATOM 92 N ALA A 9 2.475 7.313 5.733 1.00 0.00 N ATOM 93 CA ALA A 9 1.773 6.114 5.291 1.00 0.00 C ATOM 94 C ALA A 9 1.594 5.128 6.440 1.00 0.00 C ATOM 95 O ALA A 9 2.510 4.910 7.234 1.00 0.00 O ATOM 96 CB ALA A 9 2.522 5.457 4.141 1.00 0.00 C ATOM 0 H ALA A 9 3.307 7.540 5.188 1.00 0.00 H new ATOM 0 HA ALA A 9 0.783 6.410 4.943 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.986 4.563 3.821 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.593 6.155 3.307 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.524 5.181 4.470 1.00 0.00 H new ATOM 102 N THR A 10 0.407 4.534 6.525 1.00 0.00 N ATOM 103 CA THR A 10 0.107 3.572 7.578 1.00 0.00 C ATOM 104 C THR A 10 -0.251 2.211 6.994 1.00 0.00 C ATOM 105 O THR A 10 -1.139 2.102 6.148 1.00 0.00 O ATOM 106 CB THR A 10 -1.052 4.058 8.469 1.00 0.00 C ATOM 107 OG1 THR A 10 -1.975 4.830 7.693 1.00 0.00 O ATOM 108 CG2 THR A 10 -0.531 4.895 9.627 1.00 0.00 C ATOM 0 H THR A 10 -0.362 4.703 5.877 1.00 0.00 H new ATOM 0 HA THR A 10 1.007 3.477 8.185 1.00 0.00 H new ATOM 0 HB THR A 10 -1.561 3.183 8.875 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.710 5.134 8.266 1.00 0.00 H new ATOM 0 HG21 THR A 10 -1.368 5.227 10.242 1.00 0.00 H new ATOM 0 HG22 THR A 10 0.149 4.295 10.232 1.00 0.00 H new ATOM 0 HG23 THR A 10 0.000 5.764 9.238 1.00 0.00 H new ATOM 116 N PHE A 11 0.444 1.174 7.450 1.00 0.00 N ATOM 117 CA PHE A 11 0.199 -0.181 6.972 1.00 0.00 C ATOM 118 C PHE A 11 -0.431 -1.038 8.066 1.00 0.00 C ATOM 119 O PHE A 11 -0.275 -0.759 9.254 1.00 0.00 O ATOM 120 CB PHE A 11 1.504 -0.821 6.495 1.00 0.00 C ATOM 121 CG PHE A 11 2.284 -1.482 7.596 1.00 0.00 C ATOM 122 CD1 PHE A 11 1.869 -2.693 8.126 1.00 0.00 C ATOM 123 CD2 PHE A 11 3.433 -0.893 8.099 1.00 0.00 C ATOM 124 CE1 PHE A 11 2.585 -3.304 9.139 1.00 0.00 C ATOM 125 CE2 PHE A 11 4.153 -1.499 9.111 1.00 0.00 C ATOM 126 CZ PHE A 11 3.727 -2.706 9.632 1.00 0.00 C ATOM 0 H PHE A 11 1.182 1.247 8.151 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.496 -0.123 6.134 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.277 -1.560 5.727 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.125 -0.056 6.029 1.00 0.00 H new ATOM 0 HD1 PHE A 11 0.976 -3.165 7.744 1.00 0.00 H new ATOM 0 HD2 PHE A 11 3.770 0.051 7.696 1.00 0.00 H new ATOM 0 HE1 PHE A 11 2.251 -4.248 9.544 1.00 0.00 H new ATOM 0 HE2 PHE A 11 5.047 -1.030 9.494 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.287 -3.181 10.424 1.00 0.00 H new ATOM 136 N GLU A 12 -1.144 -2.082 7.655 1.00 0.00 N ATOM 137 CA GLU A 12 -1.799 -2.979 8.600 1.00 0.00 C ATOM 138 C GLU A 12 -1.701 -4.428 8.132 1.00 0.00 C ATOM 139 O GLU A 12 -1.841 -4.718 6.945 1.00 0.00 O ATOM 140 CB GLU A 12 -3.267 -2.587 8.777 1.00 0.00 C ATOM 141 CG GLU A 12 -4.105 -3.654 9.460 1.00 0.00 C ATOM 142 CD GLU A 12 -5.593 -3.389 9.347 1.00 0.00 C ATOM 143 OE1 GLU A 12 -6.015 -2.246 9.617 1.00 0.00 O ATOM 144 OE2 GLU A 12 -6.336 -4.327 8.987 1.00 0.00 O ATOM 0 H GLU A 12 -1.283 -2.327 6.675 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.289 -2.890 9.559 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.321 -1.667 9.359 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.697 -2.371 7.799 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -3.878 -4.625 9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.829 -3.709 10.513 1.00 0.00 H new ATOM 151 N GLU A 13 -1.459 -5.334 9.075 1.00 0.00 N ATOM 152 CA GLU A 13 -1.341 -6.752 8.759 1.00 0.00 C ATOM 153 C GLU A 13 -2.632 -7.494 9.094 1.00 0.00 C ATOM 154 O GLU A 13 -3.048 -7.546 10.252 1.00 0.00 O ATOM 155 CB GLU A 13 -0.170 -7.372 9.524 1.00 0.00 C ATOM 156 CG GLU A 13 0.452 -8.567 8.822 1.00 0.00 C ATOM 157 CD GLU A 13 -0.580 -9.441 8.133 1.00 0.00 C ATOM 158 OE1 GLU A 13 -1.140 -10.335 8.800 1.00 0.00 O ATOM 159 OE2 GLU A 13 -0.826 -9.229 6.927 1.00 0.00 O ATOM 0 H GLU A 13 -1.341 -5.111 10.063 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.156 -6.845 7.689 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.596 -6.612 9.677 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.514 -7.680 10.511 1.00 0.00 H new ATOM 0 HG2 GLU A 13 1.175 -8.216 8.086 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.002 -9.165 9.549 1.00 0.00 H new ATOM 166 N VAL A 14 -3.261 -8.065 8.073 1.00 0.00 N ATOM 167 CA VAL A 14 -4.505 -8.804 8.258 1.00 0.00 C ATOM 168 C VAL A 14 -4.356 -10.252 7.804 1.00 0.00 C ATOM 169 O VAL A 14 -4.214 -10.529 6.613 1.00 0.00 O ATOM 170 CB VAL A 14 -5.666 -8.152 7.484 1.00 0.00 C ATOM 171 CG1 VAL A 14 -6.930 -8.988 7.614 1.00 0.00 C ATOM 172 CG2 VAL A 14 -5.902 -6.732 7.977 1.00 0.00 C ATOM 0 H VAL A 14 -2.930 -8.031 7.109 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.731 -8.781 9.324 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.397 -8.106 6.429 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.740 -8.512 7.061 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.751 -9.984 7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.207 -9.068 8.665 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.726 -6.286 7.420 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.150 -6.752 9.038 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.999 -6.140 7.827 1.00 0.00 H new ATOM 182 N SER A 15 -4.390 -11.173 8.762 1.00 0.00 N ATOM 183 CA SER A 15 -4.256 -12.594 8.461 1.00 0.00 C ATOM 184 C SER A 15 -5.600 -13.194 8.062 1.00 0.00 C ATOM 185 O SER A 15 -6.589 -13.067 8.785 1.00 0.00 O ATOM 186 CB SER A 15 -3.689 -13.341 9.670 1.00 0.00 C ATOM 187 OG SER A 15 -3.871 -14.740 9.535 1.00 0.00 O ATOM 0 H SER A 15 -4.509 -10.961 9.753 1.00 0.00 H new ATOM 0 HA SER A 15 -3.568 -12.700 7.622 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.627 -13.117 9.775 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.179 -12.993 10.579 1.00 0.00 H new ATOM 0 HG SER A 15 -3.499 -15.195 10.319 1.00 0.00 H new ATOM 193 N VAL A 16 -5.629 -13.849 6.905 1.00 0.00 N ATOM 194 CA VAL A 16 -6.851 -14.470 6.409 1.00 0.00 C ATOM 195 C VAL A 16 -6.551 -15.790 5.708 1.00 0.00 C ATOM 196 O VAL A 16 -5.405 -16.073 5.356 1.00 0.00 O ATOM 197 CB VAL A 16 -7.597 -13.541 5.432 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.163 -12.336 6.168 1.00 0.00 C ATOM 199 CG2 VAL A 16 -6.674 -13.103 4.306 1.00 0.00 C ATOM 0 H VAL A 16 -4.820 -13.963 6.294 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.485 -14.658 7.276 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.429 -14.093 4.995 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.686 -11.691 5.462 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.859 -12.673 6.936 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.350 -11.779 6.634 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.217 -12.447 3.625 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -5.821 -12.568 4.722 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.322 -13.980 3.762 1.00 0.00 H new ATOM 209 N LEU A 17 -7.588 -16.597 5.508 1.00 0.00 N ATOM 210 CA LEU A 17 -7.436 -17.889 4.848 1.00 0.00 C ATOM 211 C LEU A 17 -8.583 -18.142 3.875 1.00 0.00 C ATOM 212 O LEU A 17 -9.752 -17.977 4.222 1.00 0.00 O ATOM 213 CB LEU A 17 -7.376 -19.010 5.886 1.00 0.00 C ATOM 214 CG LEU A 17 -6.853 -20.358 5.389 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.236 -21.147 6.534 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.971 -21.154 4.732 1.00 0.00 C ATOM 0 H LEU A 17 -8.543 -16.379 5.793 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.503 -17.874 4.285 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -6.745 -18.680 6.711 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.378 -19.158 6.290 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.079 -20.173 4.644 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.869 -22.103 6.161 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.407 -20.582 6.960 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -6.989 -21.322 7.303 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.581 -22.110 4.384 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.767 -21.328 5.456 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -8.367 -20.594 3.885 1.00 0.00 H new ATOM 228 N GLY A 18 -8.240 -18.545 2.656 1.00 0.00 N ATOM 229 CA GLY A 18 -9.253 -18.817 1.652 1.00 0.00 C ATOM 230 C GLY A 18 -9.642 -17.577 0.870 1.00 0.00 C ATOM 231 O GLY A 18 -9.134 -16.486 1.130 1.00 0.00 O ATOM 0 H GLY A 18 -7.279 -18.688 2.345 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.883 -19.576 0.963 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.138 -19.230 2.136 1.00 0.00 H new ATOM 235 N PHE A 19 -10.543 -17.745 -0.091 1.00 0.00 N ATOM 236 CA PHE A 19 -10.998 -16.631 -0.915 1.00 0.00 C ATOM 237 C PHE A 19 -12.093 -15.840 -0.206 1.00 0.00 C ATOM 238 O PHE A 19 -12.151 -14.615 -0.306 1.00 0.00 O ATOM 239 CB PHE A 19 -11.514 -17.143 -2.262 1.00 0.00 C ATOM 240 CG PHE A 19 -11.870 -16.046 -3.224 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.982 -15.249 -3.005 1.00 0.00 C ATOM 242 CD2 PHE A 19 -11.093 -15.811 -4.346 1.00 0.00 C ATOM 243 CE1 PHE A 19 -13.312 -14.239 -3.889 1.00 0.00 C ATOM 244 CE2 PHE A 19 -11.417 -14.802 -5.234 1.00 0.00 C ATOM 245 CZ PHE A 19 -12.528 -14.015 -5.004 1.00 0.00 C ATOM 0 H PHE A 19 -10.973 -18.641 -0.319 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.149 -15.969 -1.086 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.754 -17.780 -2.715 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.392 -17.766 -2.093 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.598 -15.419 -2.134 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.223 -16.424 -4.530 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -14.182 -13.625 -3.708 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.803 -14.630 -6.105 1.00 0.00 H new ATOM 0 HZ PHE A 19 -12.784 -13.225 -5.695 1.00 0.00 H new ATOM 255 N GLU A 20 -12.958 -16.551 0.511 1.00 0.00 N ATOM 256 CA GLU A 20 -14.052 -15.915 1.236 1.00 0.00 C ATOM 257 C GLU A 20 -13.522 -14.873 2.216 1.00 0.00 C ATOM 258 O GLU A 20 -13.791 -13.680 2.075 1.00 0.00 O ATOM 259 CB GLU A 20 -14.874 -16.965 1.987 1.00 0.00 C ATOM 260 CG GLU A 20 -15.482 -18.023 1.081 1.00 0.00 C ATOM 261 CD GLU A 20 -16.555 -18.839 1.776 1.00 0.00 C ATOM 262 OE1 GLU A 20 -16.199 -19.708 2.599 1.00 0.00 O ATOM 263 OE2 GLU A 20 -17.750 -18.608 1.498 1.00 0.00 O ATOM 0 H GLU A 20 -12.922 -17.566 0.605 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.692 -15.414 0.510 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.238 -17.453 2.725 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.673 -16.465 2.535 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -15.910 -17.541 0.202 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.695 -18.690 0.728 1.00 0.00 H new ATOM 270 N GLU A 21 -12.767 -15.332 3.209 1.00 0.00 N ATOM 271 CA GLU A 21 -12.200 -14.440 4.213 1.00 0.00 C ATOM 272 C GLU A 21 -11.416 -13.308 3.554 1.00 0.00 C ATOM 273 O GLU A 21 -11.559 -12.142 3.923 1.00 0.00 O ATOM 274 CB GLU A 21 -11.290 -15.219 5.165 1.00 0.00 C ATOM 275 CG GLU A 21 -12.044 -15.975 6.245 1.00 0.00 C ATOM 276 CD GLU A 21 -11.209 -16.203 7.490 1.00 0.00 C ATOM 277 OE1 GLU A 21 -10.304 -17.062 7.448 1.00 0.00 O ATOM 278 OE2 GLU A 21 -11.460 -15.522 8.506 1.00 0.00 O ATOM 0 H GLU A 21 -12.534 -16.316 3.340 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.022 -14.006 4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.694 -15.926 4.587 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.594 -14.526 5.637 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.943 -15.419 6.512 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -12.370 -16.937 5.850 1.00 0.00 H new ATOM 285 N PHE A 22 -10.586 -13.661 2.578 1.00 0.00 N ATOM 286 CA PHE A 22 -9.778 -12.677 1.868 1.00 0.00 C ATOM 287 C PHE A 22 -10.634 -11.502 1.405 1.00 0.00 C ATOM 288 O PHE A 22 -10.394 -10.356 1.786 1.00 0.00 O ATOM 289 CB PHE A 22 -9.087 -13.324 0.666 1.00 0.00 C ATOM 290 CG PHE A 22 -8.656 -12.337 -0.381 1.00 0.00 C ATOM 291 CD1 PHE A 22 -7.986 -11.178 -0.025 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.922 -12.568 -1.721 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.589 -10.267 -0.987 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.527 -11.662 -2.687 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.859 -10.510 -2.319 1.00 0.00 C ATOM 0 H PHE A 22 -10.455 -14.622 2.261 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.020 -12.303 2.556 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.214 -13.877 1.013 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.765 -14.048 0.214 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.771 -10.984 1.015 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.444 -13.467 -2.014 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.068 -9.366 -0.697 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.740 -11.854 -3.728 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.549 -9.801 -3.072 1.00 0.00 H new ATOM 305 N ASP A 23 -11.633 -11.795 0.580 1.00 0.00 N ATOM 306 CA ASP A 23 -12.526 -10.764 0.064 1.00 0.00 C ATOM 307 C ASP A 23 -13.021 -9.861 1.190 1.00 0.00 C ATOM 308 O ASP A 23 -12.888 -8.639 1.124 1.00 0.00 O ATOM 309 CB ASP A 23 -13.716 -11.403 -0.654 1.00 0.00 C ATOM 310 CG ASP A 23 -14.472 -10.411 -1.517 1.00 0.00 C ATOM 311 OD1 ASP A 23 -13.829 -9.494 -2.069 1.00 0.00 O ATOM 312 OD2 ASP A 23 -15.706 -10.553 -1.640 1.00 0.00 O ATOM 0 H ASP A 23 -11.845 -12.738 0.254 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.967 -10.156 -0.647 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.363 -12.226 -1.276 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.395 -11.830 0.084 1.00 0.00 H new ATOM 317 N LYS A 24 -13.594 -10.470 2.222 1.00 0.00 N ATOM 318 CA LYS A 24 -14.110 -9.723 3.363 1.00 0.00 C ATOM 319 C LYS A 24 -13.095 -8.688 3.838 1.00 0.00 C ATOM 320 O LYS A 24 -13.439 -7.530 4.072 1.00 0.00 O ATOM 321 CB LYS A 24 -14.457 -10.676 4.509 1.00 0.00 C ATOM 322 CG LYS A 24 -15.467 -10.106 5.489 1.00 0.00 C ATOM 323 CD LYS A 24 -16.888 -10.246 4.970 1.00 0.00 C ATOM 324 CE LYS A 24 -17.909 -9.872 6.034 1.00 0.00 C ATOM 325 NZ LYS A 24 -19.302 -10.162 5.592 1.00 0.00 N ATOM 0 H LYS A 24 -13.713 -11.481 2.292 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.014 -9.202 3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -14.851 -11.603 4.093 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.544 -10.931 5.048 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.376 -10.619 6.446 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.247 -9.054 5.669 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.022 -9.609 4.096 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.059 -11.272 4.645 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -17.697 -10.422 6.951 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.816 -8.812 6.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.968 -9.893 6.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -19.514 -9.617 4.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -19.398 -11.178 5.391 1.00 0.00 H new ATOM 339 N ALA A 25 -11.844 -9.113 3.978 1.00 0.00 N ATOM 340 CA ALA A 25 -10.779 -8.222 4.422 1.00 0.00 C ATOM 341 C ALA A 25 -10.564 -7.086 3.428 1.00 0.00 C ATOM 342 O ALA A 25 -10.288 -5.951 3.818 1.00 0.00 O ATOM 343 CB ALA A 25 -9.488 -9.002 4.623 1.00 0.00 C ATOM 0 H ALA A 25 -11.543 -10.069 3.790 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.078 -7.784 5.374 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -8.701 -8.324 4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -9.643 -9.774 5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.194 -9.467 3.682 1.00 0.00 H new ATOM 349 N VAL A 26 -10.692 -7.398 2.143 1.00 0.00 N ATOM 350 CA VAL A 26 -10.512 -6.402 1.093 1.00 0.00 C ATOM 351 C VAL A 26 -11.619 -5.356 1.132 1.00 0.00 C ATOM 352 O VAL A 26 -11.377 -4.190 1.444 1.00 0.00 O ATOM 353 CB VAL A 26 -10.487 -7.056 -0.302 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.443 -5.993 -1.389 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.305 -8.005 -0.425 1.00 0.00 C ATOM 0 H VAL A 26 -10.920 -8.332 1.803 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.553 -5.918 1.277 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.402 -7.634 -0.429 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.426 -6.473 -2.367 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.325 -5.357 -1.312 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.546 -5.385 -1.267 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.303 -8.458 -1.417 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.377 -7.452 -0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.386 -8.787 0.330 1.00 0.00 H new ATOM 365 N LYS A 27 -12.838 -5.780 0.814 1.00 0.00 N ATOM 366 CA LYS A 27 -13.986 -4.880 0.815 1.00 0.00 C ATOM 367 C LYS A 27 -13.989 -4.003 2.062 1.00 0.00 C ATOM 368 O LYS A 27 -14.532 -2.898 2.053 1.00 0.00 O ATOM 369 CB LYS A 27 -15.287 -5.682 0.739 1.00 0.00 C ATOM 370 CG LYS A 27 -15.383 -6.573 -0.487 1.00 0.00 C ATOM 371 CD LYS A 27 -15.641 -5.762 -1.747 1.00 0.00 C ATOM 372 CE LYS A 27 -15.907 -6.662 -2.944 1.00 0.00 C ATOM 373 NZ LYS A 27 -16.712 -5.972 -3.989 1.00 0.00 N ATOM 0 H LYS A 27 -13.056 -6.741 0.552 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.912 -4.235 -0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.376 -6.299 1.633 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.130 -4.991 0.742 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -14.458 -7.139 -0.600 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.185 -7.298 -0.349 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -16.495 -5.103 -1.589 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.781 -5.125 -1.953 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.959 -6.987 -3.372 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.432 -7.559 -2.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.872 -6.619 -4.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -17.628 -5.684 -3.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -16.200 -5.130 -4.322 1.00 0.00 H new ATOM 387 N GLU A 28 -13.378 -4.501 3.133 1.00 0.00 N ATOM 388 CA GLU A 28 -13.310 -3.760 4.387 1.00 0.00 C ATOM 389 C GLU A 28 -12.451 -2.508 4.234 1.00 0.00 C ATOM 390 O GLU A 28 -12.864 -1.409 4.606 1.00 0.00 O ATOM 391 CB GLU A 28 -12.746 -4.647 5.499 1.00 0.00 C ATOM 392 CG GLU A 28 -13.806 -5.445 6.238 1.00 0.00 C ATOM 393 CD GLU A 28 -14.825 -4.561 6.930 1.00 0.00 C ATOM 394 OE1 GLU A 28 -15.822 -4.184 6.280 1.00 0.00 O ATOM 395 OE2 GLU A 28 -14.625 -4.247 8.122 1.00 0.00 O ATOM 0 H GLU A 28 -12.923 -5.414 3.157 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.322 -3.454 4.654 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.019 -5.336 5.069 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.210 -4.022 6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -14.318 -6.101 5.534 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -13.324 -6.085 6.977 1.00 0.00 H new ATOM 402 N HIS A 29 -11.254 -2.683 3.685 1.00 0.00 N ATOM 403 CA HIS A 29 -10.336 -1.568 3.482 1.00 0.00 C ATOM 404 C HIS A 29 -10.392 -1.073 2.040 1.00 0.00 C ATOM 405 O HIS A 29 -9.431 -0.492 1.536 1.00 0.00 O ATOM 406 CB HIS A 29 -8.908 -1.985 3.836 1.00 0.00 C ATOM 407 CG HIS A 29 -8.828 -2.922 5.001 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.086 -2.533 6.298 1.00 0.00 N ATOM 409 CD2 HIS A 29 -8.520 -4.239 5.058 1.00 0.00 C ATOM 410 CE1 HIS A 29 -8.937 -3.570 7.104 1.00 0.00 C ATOM 411 NE2 HIS A 29 -8.595 -4.617 6.376 1.00 0.00 N ATOM 0 H HIS A 29 -10.897 -3.586 3.373 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.642 -0.753 4.139 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.451 -2.459 2.967 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.322 -1.093 4.057 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -9.350 -1.592 6.590 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -8.263 -4.874 4.223 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.072 -3.562 8.175 1.00 0.00 H new ATOM 420 N GLU A 30 -11.522 -1.309 1.382 1.00 0.00 N ATOM 421 CA GLU A 30 -11.702 -0.888 -0.003 1.00 0.00 C ATOM 422 C GLU A 30 -11.489 0.617 -0.146 1.00 0.00 C ATOM 423 O GLU A 30 -11.247 1.118 -1.243 1.00 0.00 O ATOM 424 CB GLU A 30 -13.099 -1.266 -0.497 1.00 0.00 C ATOM 425 CG GLU A 30 -14.222 -0.627 0.303 1.00 0.00 C ATOM 426 CD GLU A 30 -14.638 0.722 -0.251 1.00 0.00 C ATOM 427 OE1 GLU A 30 -14.626 0.884 -1.489 1.00 0.00 O ATOM 428 OE2 GLU A 30 -14.975 1.615 0.553 1.00 0.00 O ATOM 0 H GLU A 30 -12.327 -1.789 1.785 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.958 -1.402 -0.612 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -13.197 -0.973 -1.542 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.208 -2.350 -0.458 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -15.084 -1.294 0.310 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.903 -0.508 1.339 1.00 0.00 H new ATOM 435 N SER A 31 -11.583 1.331 0.971 1.00 0.00 N ATOM 436 CA SER A 31 -11.406 2.778 0.971 1.00 0.00 C ATOM 437 C SER A 31 -9.939 3.146 0.769 1.00 0.00 C ATOM 438 O SER A 31 -9.617 4.097 0.057 1.00 0.00 O ATOM 439 CB SER A 31 -11.918 3.376 2.282 1.00 0.00 C ATOM 440 OG SER A 31 -13.293 3.706 2.190 1.00 0.00 O ATOM 0 H SER A 31 -11.781 0.931 1.888 1.00 0.00 H new ATOM 0 HA SER A 31 -11.983 3.190 0.143 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.765 2.665 3.094 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.342 4.268 2.527 1.00 0.00 H new ATOM 0 HG SER A 31 -13.757 3.028 1.655 1.00 0.00 H new ATOM 446 N LYS A 32 -9.053 2.384 1.402 1.00 0.00 N ATOM 447 CA LYS A 32 -7.619 2.627 1.293 1.00 0.00 C ATOM 448 C LYS A 32 -6.933 1.499 0.529 1.00 0.00 C ATOM 449 O LYS A 32 -7.502 0.422 0.347 1.00 0.00 O ATOM 450 CB LYS A 32 -6.998 2.767 2.685 1.00 0.00 C ATOM 451 CG LYS A 32 -7.197 1.545 3.565 1.00 0.00 C ATOM 452 CD LYS A 32 -8.471 1.650 4.385 1.00 0.00 C ATOM 453 CE LYS A 32 -8.345 0.910 5.708 1.00 0.00 C ATOM 454 NZ LYS A 32 -7.791 1.782 6.780 1.00 0.00 N ATOM 0 H LYS A 32 -9.303 1.593 1.996 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.473 3.556 0.742 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.930 2.959 2.580 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -7.430 3.636 3.181 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.236 0.650 2.943 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.342 1.433 4.232 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -8.698 2.699 4.574 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.306 1.241 3.816 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.324 0.539 6.011 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.701 0.040 5.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.721 1.241 7.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.846 2.116 6.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.419 2.599 6.922 1.00 0.00 H new ATOM 468 N THR A 33 -5.706 1.753 0.085 1.00 0.00 N ATOM 469 CA THR A 33 -4.942 0.759 -0.659 1.00 0.00 C ATOM 470 C THR A 33 -4.914 -0.576 0.076 1.00 0.00 C ATOM 471 O THR A 33 -4.933 -0.618 1.307 1.00 0.00 O ATOM 472 CB THR A 33 -3.496 1.229 -0.903 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.496 2.431 -1.681 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.691 0.155 -1.620 1.00 0.00 C ATOM 0 H THR A 33 -5.220 2.638 0.228 1.00 0.00 H new ATOM 0 HA THR A 33 -5.441 0.631 -1.620 1.00 0.00 H new ATOM 0 HB THR A 33 -3.033 1.423 0.064 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.614 2.556 -2.090 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.673 0.510 -1.781 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.668 -0.749 -1.012 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.155 -0.066 -2.581 1.00 0.00 H new ATOM 482 N ILE A 34 -4.866 -1.664 -0.684 1.00 0.00 N ATOM 483 CA ILE A 34 -4.833 -3.001 -0.103 1.00 0.00 C ATOM 484 C ILE A 34 -3.763 -3.862 -0.767 1.00 0.00 C ATOM 485 O ILE A 34 -3.506 -3.738 -1.964 1.00 0.00 O ATOM 486 CB ILE A 34 -6.196 -3.705 -0.233 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.278 -2.908 0.499 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.114 -5.122 0.314 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.682 -3.224 0.031 1.00 0.00 C ATOM 0 H ILE A 34 -4.849 -1.647 -1.704 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.595 -2.880 0.954 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.462 -3.758 -1.289 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.206 -3.110 1.568 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.089 -1.843 0.362 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.085 -5.607 0.215 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.368 -5.686 -0.246 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.830 -5.090 1.366 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.397 -2.623 0.593 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.772 -2.996 -1.031 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.890 -4.281 0.194 1.00 0.00 H new ATOM 501 N PHE A 35 -3.144 -4.736 0.019 1.00 0.00 N ATOM 502 CA PHE A 35 -2.103 -5.620 -0.492 1.00 0.00 C ATOM 503 C PHE A 35 -2.362 -7.065 -0.075 1.00 0.00 C ATOM 504 O PHE A 35 -2.282 -7.406 1.105 1.00 0.00 O ATOM 505 CB PHE A 35 -0.730 -5.170 0.013 1.00 0.00 C ATOM 506 CG PHE A 35 -0.130 -4.056 -0.795 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.548 -4.324 -1.973 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.243 -2.740 -0.376 1.00 0.00 C ATOM 509 CE1 PHE A 35 1.102 -3.300 -2.718 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.309 -1.712 -1.117 1.00 0.00 C ATOM 511 CZ PHE A 35 0.981 -1.992 -2.290 1.00 0.00 C ATOM 0 H PHE A 35 -3.345 -4.851 1.012 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.118 -5.567 -1.581 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.821 -4.848 1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.051 -6.022 0.003 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.645 -5.344 -2.313 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.769 -2.515 0.540 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.629 -3.522 -3.634 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.215 -0.691 -0.779 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.411 -1.190 -2.872 1.00 0.00 H new ATOM 521 N ALA A 36 -2.675 -7.909 -1.052 1.00 0.00 N ATOM 522 CA ALA A 36 -2.945 -9.317 -0.788 1.00 0.00 C ATOM 523 C ALA A 36 -1.700 -10.167 -1.018 1.00 0.00 C ATOM 524 O ALA A 36 -1.044 -10.057 -2.054 1.00 0.00 O ATOM 525 CB ALA A 36 -4.090 -9.807 -1.662 1.00 0.00 C ATOM 0 H ALA A 36 -2.748 -7.642 -2.034 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.233 -9.417 0.259 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.281 -10.860 -1.455 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.987 -9.226 -1.446 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.824 -9.687 -2.712 1.00 0.00 H new ATOM 531 N TYR A 37 -1.380 -11.014 -0.046 1.00 0.00 N ATOM 532 CA TYR A 37 -0.212 -11.881 -0.142 1.00 0.00 C ATOM 533 C TYR A 37 -0.627 -13.347 -0.221 1.00 0.00 C ATOM 534 O TYR A 37 -0.676 -14.046 0.792 1.00 0.00 O ATOM 535 CB TYR A 37 0.709 -11.664 1.060 1.00 0.00 C ATOM 536 CG TYR A 37 1.979 -12.483 1.005 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.868 -12.353 -0.055 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.290 -13.389 2.012 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.029 -13.100 -0.110 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.449 -14.138 1.966 1.00 0.00 C ATOM 541 CZ TYR A 37 4.315 -13.991 0.903 1.00 0.00 C ATOM 542 OH TYR A 37 5.470 -14.737 0.853 1.00 0.00 O ATOM 0 H TYR A 37 -1.913 -11.119 0.817 1.00 0.00 H new ATOM 0 HA TYR A 37 0.326 -11.625 -1.055 1.00 0.00 H new ATOM 0 HB2 TYR A 37 0.970 -10.608 1.121 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.166 -11.911 1.972 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.648 -11.656 -0.850 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.613 -13.509 2.845 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.709 -12.987 -0.942 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.676 -14.836 2.759 1.00 0.00 H new ATOM 0 HH TYR A 37 5.968 -14.514 0.039 1.00 0.00 H new ATOM 552 N PHE A 38 -0.924 -13.807 -1.432 1.00 0.00 N ATOM 553 CA PHE A 38 -1.334 -15.189 -1.645 1.00 0.00 C ATOM 554 C PHE A 38 -0.149 -16.138 -1.495 1.00 0.00 C ATOM 555 O PHE A 38 0.809 -16.079 -2.265 1.00 0.00 O ATOM 556 CB PHE A 38 -1.958 -15.350 -3.033 1.00 0.00 C ATOM 557 CG PHE A 38 -2.925 -14.257 -3.386 1.00 0.00 C ATOM 558 CD1 PHE A 38 -4.134 -14.142 -2.719 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.626 -13.345 -4.385 1.00 0.00 C ATOM 560 CE1 PHE A 38 -5.027 -13.137 -3.041 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.514 -12.337 -4.711 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.717 -12.234 -4.039 1.00 0.00 C ATOM 0 H PHE A 38 -0.888 -13.242 -2.281 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.077 -15.442 -0.888 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.164 -15.376 -3.779 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.473 -16.309 -3.082 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.382 -14.846 -1.938 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.688 -13.422 -4.915 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.966 -13.058 -2.513 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.268 -11.631 -5.490 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.414 -11.449 -4.294 1.00 0.00 H new ATOM 572 N SER A 39 -0.222 -17.013 -0.496 1.00 0.00 N ATOM 573 CA SER A 39 0.846 -17.972 -0.241 1.00 0.00 C ATOM 574 C SER A 39 0.291 -19.253 0.374 1.00 0.00 C ATOM 575 O SER A 39 -0.866 -19.304 0.791 1.00 0.00 O ATOM 576 CB SER A 39 1.898 -17.362 0.687 1.00 0.00 C ATOM 577 OG SER A 39 1.407 -17.254 2.013 1.00 0.00 O ATOM 0 H SER A 39 -1.009 -17.077 0.149 1.00 0.00 H new ATOM 0 HA SER A 39 1.313 -18.220 -1.194 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.797 -17.978 0.678 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.184 -16.376 0.320 1.00 0.00 H new ATOM 0 HG SER A 39 2.159 -17.248 2.641 1.00 0.00 H new ATOM 583 N GLY A 40 1.125 -20.287 0.428 1.00 0.00 N ATOM 584 CA GLY A 40 0.700 -21.554 0.993 1.00 0.00 C ATOM 585 C GLY A 40 0.326 -21.440 2.458 1.00 0.00 C ATOM 586 O GLY A 40 0.600 -20.424 3.098 1.00 0.00 O ATOM 0 H GLY A 40 2.087 -20.270 0.090 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.155 -21.930 0.431 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.501 -22.285 0.882 1.00 0.00 H new ATOM 590 N SER A 41 -0.304 -22.482 2.989 1.00 0.00 N ATOM 591 CA SER A 41 -0.722 -22.492 4.386 1.00 0.00 C ATOM 592 C SER A 41 0.414 -22.962 5.290 1.00 0.00 C ATOM 593 O SER A 41 1.216 -23.814 4.907 1.00 0.00 O ATOM 594 CB SER A 41 -1.942 -23.397 4.569 1.00 0.00 C ATOM 595 OG SER A 41 -2.351 -23.433 5.926 1.00 0.00 O ATOM 0 H SER A 41 -0.536 -23.331 2.473 1.00 0.00 H new ATOM 0 HA SER A 41 -0.989 -21.473 4.667 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.762 -23.037 3.948 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.705 -24.406 4.230 1.00 0.00 H new ATOM 0 HG SER A 41 -3.133 -24.016 6.017 1.00 0.00 H new ATOM 601 N LYS A 42 0.476 -22.400 6.492 1.00 0.00 N ATOM 602 CA LYS A 42 1.512 -22.760 7.453 1.00 0.00 C ATOM 603 C LYS A 42 1.204 -24.103 8.107 1.00 0.00 C ATOM 604 O LYS A 42 0.058 -24.554 8.110 1.00 0.00 O ATOM 605 CB LYS A 42 1.640 -21.676 8.526 1.00 0.00 C ATOM 606 CG LYS A 42 1.549 -20.263 7.977 1.00 0.00 C ATOM 607 CD LYS A 42 1.604 -19.228 9.088 1.00 0.00 C ATOM 608 CE LYS A 42 0.933 -17.928 8.672 1.00 0.00 C ATOM 609 NZ LYS A 42 -0.550 -18.012 8.772 1.00 0.00 N ATOM 0 H LYS A 42 -0.180 -21.693 6.824 1.00 0.00 H new ATOM 0 HA LYS A 42 2.457 -22.845 6.916 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.856 -21.819 9.270 1.00 0.00 H new ATOM 0 HB3 LYS A 42 2.594 -21.796 9.040 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.367 -20.090 7.277 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.621 -20.148 7.417 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.115 -19.622 9.979 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.643 -19.033 9.354 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.294 -17.115 9.302 1.00 0.00 H new ATOM 0 HE3 LYS A 42 1.215 -17.686 7.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.973 -17.138 8.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.890 -18.824 8.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.824 -18.133 9.768 1.00 0.00 H new ATOM 623 N ASP A 43 2.232 -24.736 8.661 1.00 0.00 N ATOM 624 CA ASP A 43 2.071 -26.027 9.320 1.00 0.00 C ATOM 625 C ASP A 43 1.852 -25.847 10.819 1.00 0.00 C ATOM 626 O ASP A 43 1.752 -24.724 11.314 1.00 0.00 O ATOM 627 CB ASP A 43 3.297 -26.907 9.073 1.00 0.00 C ATOM 628 CG ASP A 43 4.493 -26.479 9.899 1.00 0.00 C ATOM 629 OD1 ASP A 43 4.484 -25.340 10.410 1.00 0.00 O ATOM 630 OD2 ASP A 43 5.440 -27.282 10.034 1.00 0.00 O ATOM 0 H ASP A 43 3.186 -24.376 8.667 1.00 0.00 H new ATOM 0 HA ASP A 43 1.193 -26.516 8.898 1.00 0.00 H new ATOM 0 HB2 ASP A 43 3.050 -27.943 9.306 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.558 -26.872 8.015 1.00 0.00 H new ATOM 635 N THR A 44 1.777 -26.963 11.539 1.00 0.00 N ATOM 636 CA THR A 44 1.568 -26.929 12.981 1.00 0.00 C ATOM 637 C THR A 44 2.635 -26.087 13.672 1.00 0.00 C ATOM 638 O THR A 44 2.499 -25.736 14.843 1.00 0.00 O ATOM 639 CB THR A 44 1.580 -28.347 13.583 1.00 0.00 C ATOM 640 OG1 THR A 44 1.341 -28.282 14.994 1.00 0.00 O ATOM 641 CG2 THR A 44 2.911 -29.036 13.321 1.00 0.00 C ATOM 0 H THR A 44 1.858 -27.901 11.146 1.00 0.00 H new ATOM 0 HA THR A 44 0.590 -26.479 13.148 1.00 0.00 H new ATOM 0 HB THR A 44 0.789 -28.926 13.106 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.539 -27.379 15.318 1.00 0.00 H new ATOM 0 HG21 THR A 44 2.895 -30.035 13.756 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.077 -29.110 12.246 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.716 -28.457 13.773 1.00 0.00 H new ATOM 649 N GLU A 45 3.696 -25.767 12.938 1.00 0.00 N ATOM 650 CA GLU A 45 4.786 -24.965 13.482 1.00 0.00 C ATOM 651 C GLU A 45 4.553 -23.480 13.221 1.00 0.00 C ATOM 652 O GLU A 45 5.071 -22.624 13.937 1.00 0.00 O ATOM 653 CB GLU A 45 6.121 -25.398 12.872 1.00 0.00 C ATOM 654 CG GLU A 45 7.315 -25.146 13.777 1.00 0.00 C ATOM 655 CD GLU A 45 7.464 -26.203 14.853 1.00 0.00 C ATOM 656 OE1 GLU A 45 7.173 -27.384 14.568 1.00 0.00 O ATOM 657 OE2 GLU A 45 7.872 -25.851 15.980 1.00 0.00 O ATOM 0 H GLU A 45 3.824 -26.050 11.967 1.00 0.00 H new ATOM 0 HA GLU A 45 4.818 -25.126 14.560 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.074 -26.461 12.634 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.270 -24.867 11.932 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.223 -25.116 13.175 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.211 -24.168 14.246 1.00 0.00 H new ATOM 664 N GLY A 46 3.768 -23.183 12.190 1.00 0.00 N ATOM 665 CA GLY A 46 3.479 -21.801 11.851 1.00 0.00 C ATOM 666 C GLY A 46 4.344 -21.289 10.717 1.00 0.00 C ATOM 667 O GLY A 46 4.709 -20.114 10.685 1.00 0.00 O ATOM 0 H GLY A 46 3.327 -23.874 11.583 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.429 -21.710 11.572 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.630 -21.175 12.730 1.00 0.00 H new ATOM 671 N LYS A 47 4.676 -22.174 9.782 1.00 0.00 N ATOM 672 CA LYS A 47 5.504 -21.807 8.640 1.00 0.00 C ATOM 673 C LYS A 47 4.988 -22.459 7.361 1.00 0.00 C ATOM 674 O LYS A 47 4.600 -23.627 7.362 1.00 0.00 O ATOM 675 CB LYS A 47 6.958 -22.219 8.884 1.00 0.00 C ATOM 676 CG LYS A 47 7.182 -23.720 8.824 1.00 0.00 C ATOM 677 CD LYS A 47 8.662 -24.063 8.803 1.00 0.00 C ATOM 678 CE LYS A 47 9.246 -24.097 10.207 1.00 0.00 C ATOM 679 NZ LYS A 47 9.133 -25.448 10.823 1.00 0.00 N ATOM 0 H LYS A 47 4.384 -23.151 9.794 1.00 0.00 H new ATOM 0 HA LYS A 47 5.454 -20.725 8.521 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.593 -21.735 8.142 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.272 -21.852 9.861 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.710 -24.194 9.685 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.701 -24.125 7.934 1.00 0.00 H new ATOM 0 HD2 LYS A 47 8.805 -25.032 8.325 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.198 -23.328 8.202 1.00 0.00 H new ATOM 0 HE2 LYS A 47 10.294 -23.801 10.171 1.00 0.00 H new ATOM 0 HE3 LYS A 47 8.730 -23.369 10.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 9.741 -25.497 11.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 8.145 -25.623 11.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 9.434 -26.169 10.136 1.00 0.00 H new ATOM 693 N SER A 48 4.987 -21.696 6.273 1.00 0.00 N ATOM 694 CA SER A 48 4.515 -22.200 4.988 1.00 0.00 C ATOM 695 C SER A 48 5.450 -23.280 4.451 1.00 0.00 C ATOM 696 O SER A 48 6.672 -23.151 4.526 1.00 0.00 O ATOM 697 CB SER A 48 4.406 -21.056 3.977 1.00 0.00 C ATOM 698 OG SER A 48 3.458 -21.356 2.967 1.00 0.00 O ATOM 0 H SER A 48 5.307 -20.728 6.255 1.00 0.00 H new ATOM 0 HA SER A 48 3.529 -22.639 5.138 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.117 -20.139 4.491 1.00 0.00 H new ATOM 0 HB3 SER A 48 5.380 -20.874 3.523 1.00 0.00 H new ATOM 0 HG SER A 48 3.406 -20.609 2.335 1.00 0.00 H new ATOM 704 N TRP A 49 4.866 -24.343 3.911 1.00 0.00 N ATOM 705 CA TRP A 49 5.646 -25.446 3.362 1.00 0.00 C ATOM 706 C TRP A 49 6.739 -24.931 2.432 1.00 0.00 C ATOM 707 O TRP A 49 7.784 -25.563 2.277 1.00 0.00 O ATOM 708 CB TRP A 49 4.735 -26.417 2.609 1.00 0.00 C ATOM 709 CG TRP A 49 3.614 -25.737 1.882 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.392 -25.401 2.391 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.612 -25.312 0.515 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.630 -24.793 1.423 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.356 -24.725 0.263 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.549 -25.368 -0.520 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.016 -24.201 -0.981 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.210 -24.847 -1.754 1.00 0.00 C ATOM 717 CH2 TRP A 49 2.953 -24.269 -1.976 1.00 0.00 C ATOM 0 H TRP A 49 3.856 -24.465 3.841 1.00 0.00 H new ATOM 0 HA TRP A 49 6.119 -25.971 4.192 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.332 -26.983 1.894 1.00 0.00 H new ATOM 0 HB3 TRP A 49 4.318 -27.135 3.315 1.00 0.00 H new ATOM 0 HD1 TRP A 49 2.072 -25.586 3.406 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.678 -24.448 1.548 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.521 -25.811 -0.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.047 -23.757 -1.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 4.926 -24.886 -2.561 1.00 0.00 H new ATOM 0 HH2 TRP A 49 2.719 -23.869 -2.952 1.00 0.00 H new ATOM 728 N CYS A 50 6.492 -23.780 1.816 1.00 0.00 N ATOM 729 CA CYS A 50 7.456 -23.180 0.901 1.00 0.00 C ATOM 730 C CYS A 50 8.504 -22.378 1.665 1.00 0.00 C ATOM 731 O CYS A 50 8.191 -21.596 2.563 1.00 0.00 O ATOM 732 CB CYS A 50 6.741 -22.279 -0.107 1.00 0.00 C ATOM 733 SG CYS A 50 7.752 -21.820 -1.534 1.00 0.00 S ATOM 0 H CYS A 50 5.632 -23.244 1.934 1.00 0.00 H new ATOM 0 HA CYS A 50 7.960 -23.984 0.365 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.843 -22.787 -0.460 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.415 -21.371 0.401 1.00 0.00 H new ATOM 0 HG CYS A 50 7.060 -21.060 -2.330 1.00 0.00 H new ATOM 739 N PRO A 51 9.780 -22.575 1.302 1.00 0.00 N ATOM 740 CA PRO A 51 10.901 -21.879 1.942 1.00 0.00 C ATOM 741 C PRO A 51 10.932 -20.393 1.602 1.00 0.00 C ATOM 742 O PRO A 51 11.044 -19.546 2.488 1.00 0.00 O ATOM 743 CB PRO A 51 12.132 -22.585 1.366 1.00 0.00 C ATOM 744 CG PRO A 51 11.676 -23.132 0.057 1.00 0.00 C ATOM 745 CD PRO A 51 10.227 -23.491 0.240 1.00 0.00 C ATOM 0 HA PRO A 51 10.838 -21.920 3.029 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.963 -21.891 1.237 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.479 -23.379 2.028 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.798 -22.396 -0.737 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.262 -24.006 -0.226 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.659 -23.348 -0.679 1.00 0.00 H new ATOM 0 HD3 PRO A 51 10.105 -24.534 0.532 1.00 0.00 H new ATOM 753 N ASP A 52 10.830 -20.084 0.314 1.00 0.00 N ATOM 754 CA ASP A 52 10.844 -18.699 -0.143 1.00 0.00 C ATOM 755 C ASP A 52 9.878 -17.847 0.674 1.00 0.00 C ATOM 756 O ASP A 52 10.286 -16.897 1.343 1.00 0.00 O ATOM 757 CB ASP A 52 10.479 -18.625 -1.626 1.00 0.00 C ATOM 758 CG ASP A 52 11.647 -18.975 -2.528 1.00 0.00 C ATOM 759 OD1 ASP A 52 12.361 -19.953 -2.221 1.00 0.00 O ATOM 760 OD2 ASP A 52 11.847 -18.272 -3.540 1.00 0.00 O ATOM 0 H ASP A 52 10.737 -20.773 -0.432 1.00 0.00 H new ATOM 0 HA ASP A 52 11.852 -18.307 -0.005 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.651 -19.305 -1.828 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.130 -17.620 -1.862 1.00 0.00 H new ATOM 765 N CYS A 53 8.597 -18.193 0.615 1.00 0.00 N ATOM 766 CA CYS A 53 7.572 -17.459 1.348 1.00 0.00 C ATOM 767 C CYS A 53 8.080 -17.046 2.726 1.00 0.00 C ATOM 768 O CYS A 53 8.142 -15.859 3.046 1.00 0.00 O ATOM 769 CB CYS A 53 6.309 -18.310 1.491 1.00 0.00 C ATOM 770 SG CYS A 53 4.873 -17.402 2.109 1.00 0.00 S ATOM 0 H CYS A 53 8.243 -18.977 0.067 1.00 0.00 H new ATOM 0 HA CYS A 53 7.332 -16.558 0.784 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.063 -18.741 0.521 1.00 0.00 H new ATOM 0 HB3 CYS A 53 6.518 -19.141 2.165 1.00 0.00 H new ATOM 0 HG CYS A 53 4.918 -16.175 1.681 1.00 0.00 H new ATOM 776 N VAL A 54 8.441 -18.034 3.538 1.00 0.00 N ATOM 777 CA VAL A 54 8.943 -17.774 4.882 1.00 0.00 C ATOM 778 C VAL A 54 10.027 -16.703 4.866 1.00 0.00 C ATOM 779 O VAL A 54 10.133 -15.899 5.792 1.00 0.00 O ATOM 780 CB VAL A 54 9.509 -19.053 5.527 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.064 -18.752 6.911 1.00 0.00 C ATOM 782 CG2 VAL A 54 8.440 -20.133 5.596 1.00 0.00 C ATOM 0 H VAL A 54 8.395 -19.022 3.289 1.00 0.00 H new ATOM 0 HA VAL A 54 8.098 -17.422 5.473 1.00 0.00 H new ATOM 0 HB VAL A 54 10.326 -19.421 4.906 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.460 -19.667 7.351 1.00 0.00 H new ATOM 0 HG12 VAL A 54 10.862 -18.014 6.830 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.269 -18.359 7.544 1.00 0.00 H new ATOM 0 HG21 VAL A 54 8.858 -21.029 6.054 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.601 -19.777 6.194 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.094 -20.368 4.589 1.00 0.00 H new ATOM 792 N GLU A 55 10.831 -16.698 3.807 1.00 0.00 N ATOM 793 CA GLU A 55 11.908 -15.725 3.671 1.00 0.00 C ATOM 794 C GLU A 55 11.405 -14.444 3.013 1.00 0.00 C ATOM 795 O GLU A 55 12.062 -13.405 3.069 1.00 0.00 O ATOM 796 CB GLU A 55 13.058 -16.315 2.851 1.00 0.00 C ATOM 797 CG GLU A 55 14.360 -15.545 2.987 1.00 0.00 C ATOM 798 CD GLU A 55 15.214 -16.040 4.139 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.889 -17.077 3.974 1.00 0.00 O ATOM 800 OE2 GLU A 55 15.205 -15.390 5.205 1.00 0.00 O ATOM 0 H GLU A 55 10.757 -17.356 3.032 1.00 0.00 H new ATOM 0 HA GLU A 55 12.271 -15.481 4.670 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.222 -17.347 3.161 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.769 -16.340 1.800 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.925 -15.628 2.059 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.139 -14.488 3.132 1.00 0.00 H new ATOM 807 N ALA A 56 10.234 -14.527 2.390 1.00 0.00 N ATOM 808 CA ALA A 56 9.641 -13.375 1.722 1.00 0.00 C ATOM 809 C ALA A 56 8.795 -12.554 2.690 1.00 0.00 C ATOM 810 O ALA A 56 8.617 -11.351 2.506 1.00 0.00 O ATOM 811 CB ALA A 56 8.800 -13.826 0.537 1.00 0.00 C ATOM 0 H ALA A 56 9.677 -15.380 2.334 1.00 0.00 H new ATOM 0 HA ALA A 56 10.450 -12.741 1.359 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.364 -12.955 0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.430 -14.363 -0.173 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.004 -14.484 0.885 1.00 0.00 H new ATOM 817 N GLU A 57 8.277 -13.214 3.722 1.00 0.00 N ATOM 818 CA GLU A 57 7.448 -12.544 4.717 1.00 0.00 C ATOM 819 C GLU A 57 8.160 -11.318 5.281 1.00 0.00 C ATOM 820 O GLU A 57 7.613 -10.215 5.320 1.00 0.00 O ATOM 821 CB GLU A 57 7.096 -13.509 5.852 1.00 0.00 C ATOM 822 CG GLU A 57 5.704 -13.294 6.422 1.00 0.00 C ATOM 823 CD GLU A 57 4.663 -13.056 5.346 1.00 0.00 C ATOM 824 OE1 GLU A 57 4.781 -13.665 4.262 1.00 0.00 O ATOM 825 OE2 GLU A 57 3.730 -12.262 5.588 1.00 0.00 O ATOM 0 H GLU A 57 8.417 -14.210 3.890 1.00 0.00 H new ATOM 0 HA GLU A 57 6.530 -12.218 4.228 1.00 0.00 H new ATOM 0 HB2 GLU A 57 7.176 -14.532 5.486 1.00 0.00 H new ATOM 0 HB3 GLU A 57 7.828 -13.399 6.652 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.419 -14.165 7.012 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.721 -12.441 7.101 1.00 0.00 H new ATOM 832 N PRO A 58 9.409 -11.512 5.728 1.00 0.00 N ATOM 833 CA PRO A 58 10.223 -10.434 6.298 1.00 0.00 C ATOM 834 C PRO A 58 10.654 -9.416 5.248 1.00 0.00 C ATOM 835 O PRO A 58 10.913 -8.255 5.564 1.00 0.00 O ATOM 836 CB PRO A 58 11.442 -11.170 6.861 1.00 0.00 C ATOM 837 CG PRO A 58 11.538 -12.418 6.053 1.00 0.00 C ATOM 838 CD PRO A 58 10.124 -12.800 5.712 1.00 0.00 C ATOM 0 HA PRO A 58 9.673 -9.859 7.043 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.346 -10.568 6.768 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.315 -11.393 7.920 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.127 -12.254 5.150 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.031 -13.210 6.616 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.062 -13.282 4.736 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.710 -13.498 6.439 1.00 0.00 H new ATOM 846 N VAL A 59 10.727 -9.858 3.996 1.00 0.00 N ATOM 847 CA VAL A 59 11.125 -8.985 2.899 1.00 0.00 C ATOM 848 C VAL A 59 9.974 -8.080 2.473 1.00 0.00 C ATOM 849 O VAL A 59 10.191 -6.962 2.004 1.00 0.00 O ATOM 850 CB VAL A 59 11.604 -9.796 1.681 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.156 -8.872 0.607 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.646 -10.822 2.101 1.00 0.00 C ATOM 0 H VAL A 59 10.515 -10.816 3.717 1.00 0.00 H new ATOM 0 HA VAL A 59 11.949 -8.373 3.264 1.00 0.00 H new ATOM 0 HB VAL A 59 10.750 -10.329 1.263 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.489 -9.464 -0.246 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.377 -8.180 0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 59 12.998 -8.309 1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 59 12.974 -11.386 1.228 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.501 -10.312 2.545 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.211 -11.504 2.832 1.00 0.00 H new ATOM 862 N ILE A 60 8.750 -8.570 2.638 1.00 0.00 N ATOM 863 CA ILE A 60 7.565 -7.805 2.272 1.00 0.00 C ATOM 864 C ILE A 60 7.117 -6.904 3.417 1.00 0.00 C ATOM 865 O ILE A 60 6.895 -5.708 3.229 1.00 0.00 O ATOM 866 CB ILE A 60 6.399 -8.730 1.874 1.00 0.00 C ATOM 867 CG1 ILE A 60 6.772 -9.556 0.641 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.143 -7.913 1.610 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.601 -10.293 0.030 1.00 0.00 C ATOM 0 H ILE A 60 8.553 -9.494 3.023 1.00 0.00 H new ATOM 0 HA ILE A 60 7.839 -7.190 1.415 1.00 0.00 H new ATOM 0 HB ILE A 60 6.199 -9.414 2.699 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.207 -8.897 -0.110 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.541 -10.278 0.916 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.327 -8.580 1.330 1.00 0.00 H new ATOM 0 HG22 ILE A 60 4.870 -7.364 2.511 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.331 -7.209 0.799 1.00 0.00 H new ATOM 0 HD11 ILE A 60 5.940 -10.857 -0.839 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.179 -10.978 0.765 1.00 0.00 H new ATOM 0 HD13 ILE A 60 4.840 -9.576 -0.277 1.00 0.00 H new ATOM 881 N ARG A 61 6.987 -7.486 4.605 1.00 0.00 N ATOM 882 CA ARG A 61 6.566 -6.736 5.782 1.00 0.00 C ATOM 883 C ARG A 61 7.562 -5.626 6.103 1.00 0.00 C ATOM 884 O ARG A 61 7.236 -4.675 6.813 1.00 0.00 O ATOM 885 CB ARG A 61 6.422 -7.671 6.984 1.00 0.00 C ATOM 886 CG ARG A 61 5.283 -8.668 6.847 1.00 0.00 C ATOM 887 CD ARG A 61 4.731 -9.073 8.205 1.00 0.00 C ATOM 888 NE ARG A 61 5.418 -10.241 8.749 1.00 0.00 N ATOM 889 CZ ARG A 61 5.472 -10.523 10.046 1.00 0.00 C ATOM 890 NH1 ARG A 61 4.881 -9.727 10.926 1.00 0.00 N ATOM 891 NH2 ARG A 61 6.117 -11.605 10.465 1.00 0.00 N ATOM 0 H ARG A 61 7.167 -8.475 4.778 1.00 0.00 H new ATOM 0 HA ARG A 61 5.599 -6.282 5.567 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.356 -8.216 7.124 1.00 0.00 H new ATOM 0 HB3 ARG A 61 6.264 -7.073 7.882 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.486 -8.231 6.245 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.635 -9.553 6.317 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.829 -8.239 8.900 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.666 -9.288 8.114 1.00 0.00 H new ATOM 0 HE ARG A 61 5.882 -10.875 8.098 1.00 0.00 H new ATOM 0 HH11 ARG A 61 4.383 -8.896 10.608 1.00 0.00 H new ATOM 0 HH12 ARG A 61 4.924 -9.946 11.921 1.00 0.00 H new ATOM 0 HH21 ARG A 61 6.572 -12.221 9.791 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.158 -11.821 11.461 1.00 0.00 H new ATOM 905 N GLU A 62 8.775 -5.755 5.577 1.00 0.00 N ATOM 906 CA GLU A 62 9.818 -4.763 5.810 1.00 0.00 C ATOM 907 C GLU A 62 9.642 -3.561 4.886 1.00 0.00 C ATOM 908 O GLU A 62 9.741 -2.413 5.317 1.00 0.00 O ATOM 909 CB GLU A 62 11.200 -5.384 5.598 1.00 0.00 C ATOM 910 CG GLU A 62 11.733 -6.114 6.820 1.00 0.00 C ATOM 911 CD GLU A 62 12.377 -5.179 7.824 1.00 0.00 C ATOM 912 OE1 GLU A 62 13.314 -4.449 7.438 1.00 0.00 O ATOM 913 OE2 GLU A 62 11.944 -5.176 8.996 1.00 0.00 O ATOM 0 H GLU A 62 9.060 -6.536 4.987 1.00 0.00 H new ATOM 0 HA GLU A 62 9.735 -4.422 6.842 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.151 -6.081 4.761 1.00 0.00 H new ATOM 0 HB3 GLU A 62 11.903 -4.599 5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 62 10.916 -6.652 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.463 -6.859 6.504 1.00 0.00 H new ATOM 920 N GLY A 63 9.380 -3.835 3.611 1.00 0.00 N ATOM 921 CA GLY A 63 9.195 -2.767 2.646 1.00 0.00 C ATOM 922 C GLY A 63 7.912 -1.994 2.876 1.00 0.00 C ATOM 923 O GLY A 63 7.812 -0.820 2.514 1.00 0.00 O ATOM 0 H GLY A 63 9.293 -4.777 3.230 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.042 -2.083 2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.187 -3.187 1.640 1.00 0.00 H new ATOM 927 N LEU A 64 6.926 -2.651 3.477 1.00 0.00 N ATOM 928 CA LEU A 64 5.642 -2.018 3.754 1.00 0.00 C ATOM 929 C LEU A 64 5.816 -0.805 4.662 1.00 0.00 C ATOM 930 O LEU A 64 4.943 0.059 4.737 1.00 0.00 O ATOM 931 CB LEU A 64 4.685 -3.021 4.401 1.00 0.00 C ATOM 932 CG LEU A 64 3.881 -3.898 3.441 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.225 -5.048 4.191 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.835 -3.069 2.710 1.00 0.00 C ATOM 0 H LEU A 64 6.992 -3.622 3.782 1.00 0.00 H new ATOM 0 HA LEU A 64 5.220 -1.681 2.807 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.262 -3.671 5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 64 3.986 -2.471 5.031 1.00 0.00 H new ATOM 0 HG LEU A 64 4.565 -4.316 2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.657 -5.662 3.492 1.00 0.00 H new ATOM 0 HD12 LEU A 64 3.993 -5.657 4.667 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.554 -4.650 4.952 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.272 -3.710 2.031 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.154 -2.621 3.434 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.328 -2.281 2.140 1.00 0.00 H new ATOM 946 N LYS A 65 6.952 -0.747 5.350 1.00 0.00 N ATOM 947 CA LYS A 65 7.244 0.361 6.251 1.00 0.00 C ATOM 948 C LYS A 65 7.793 1.559 5.482 1.00 0.00 C ATOM 949 O LYS A 65 7.854 2.671 6.006 1.00 0.00 O ATOM 950 CB LYS A 65 8.249 -0.075 7.320 1.00 0.00 C ATOM 951 CG LYS A 65 7.757 -1.224 8.184 1.00 0.00 C ATOM 952 CD LYS A 65 8.464 -1.253 9.528 1.00 0.00 C ATOM 953 CE LYS A 65 7.911 -0.196 10.472 1.00 0.00 C ATOM 954 NZ LYS A 65 8.896 0.177 11.525 1.00 0.00 N ATOM 0 H LYS A 65 7.685 -1.455 5.300 1.00 0.00 H new ATOM 0 HA LYS A 65 6.313 0.657 6.734 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.179 -0.369 6.834 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.479 0.777 7.960 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.682 -1.129 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.922 -2.168 7.664 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.351 -2.239 9.978 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.532 -1.089 9.382 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.635 0.691 9.902 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.001 -0.569 10.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.481 0.899 12.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.140 -0.664 12.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.755 0.557 11.078 1.00 0.00 H new ATOM 968 N HIS A 66 8.190 1.323 4.235 1.00 0.00 N ATOM 969 CA HIS A 66 8.732 2.383 3.392 1.00 0.00 C ATOM 970 C HIS A 66 7.678 2.891 2.413 1.00 0.00 C ATOM 971 O HIS A 66 7.952 3.761 1.586 1.00 0.00 O ATOM 972 CB HIS A 66 9.956 1.880 2.627 1.00 0.00 C ATOM 973 CG HIS A 66 11.095 1.483 3.514 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.345 2.061 3.438 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.169 0.560 4.501 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.138 1.510 4.340 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.448 0.596 4.998 1.00 0.00 N ATOM 0 H HIS A 66 8.147 0.408 3.787 1.00 0.00 H new ATOM 0 HA HIS A 66 9.031 3.209 4.037 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.666 1.025 2.017 1.00 0.00 H new ATOM 0 HB3 HIS A 66 10.293 2.660 1.944 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.370 -0.085 4.836 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.174 1.764 4.510 1.00 0.00 H new ATOM 0 HE2 HIS A 66 12.807 0.012 5.753 1.00 0.00 H new ATOM 986 N VAL A 67 6.472 2.340 2.511 1.00 0.00 N ATOM 987 CA VAL A 67 5.377 2.737 1.634 1.00 0.00 C ATOM 988 C VAL A 67 5.017 4.205 1.834 1.00 0.00 C ATOM 989 O VAL A 67 5.218 4.764 2.913 1.00 0.00 O ATOM 990 CB VAL A 67 4.123 1.875 1.875 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.383 2.346 3.118 1.00 0.00 C ATOM 992 CG2 VAL A 67 3.212 1.908 0.658 1.00 0.00 C ATOM 0 H VAL A 67 6.229 1.618 3.189 1.00 0.00 H new ATOM 0 HA VAL A 67 5.721 2.586 0.611 1.00 0.00 H new ATOM 0 HB VAL A 67 4.437 0.844 2.037 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.500 1.726 3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.039 2.266 3.985 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.079 3.385 2.989 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.331 1.294 0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.903 2.935 0.462 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.748 1.519 -0.208 1.00 0.00 H new ATOM 1002 N THR A 68 4.482 4.826 0.787 1.00 0.00 N ATOM 1003 CA THR A 68 4.094 6.230 0.847 1.00 0.00 C ATOM 1004 C THR A 68 2.592 6.394 0.649 1.00 0.00 C ATOM 1005 O THR A 68 2.120 7.466 0.272 1.00 0.00 O ATOM 1006 CB THR A 68 4.835 7.063 -0.216 1.00 0.00 C ATOM 1007 OG1 THR A 68 4.726 8.457 0.091 1.00 0.00 O ATOM 1008 CG2 THR A 68 4.268 6.798 -1.603 1.00 0.00 C ATOM 0 H THR A 68 4.308 4.378 -0.113 1.00 0.00 H new ATOM 0 HA THR A 68 4.368 6.592 1.838 1.00 0.00 H new ATOM 0 HB THR A 68 5.885 6.771 -0.208 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.787 8.682 0.260 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.807 7.397 -2.337 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.379 5.741 -1.846 1.00 0.00 H new ATOM 0 HG23 THR A 68 3.212 7.066 -1.621 1.00 0.00 H new ATOM 1016 N GLU A 69 1.845 5.324 0.906 1.00 0.00 N ATOM 1017 CA GLU A 69 0.395 5.352 0.755 1.00 0.00 C ATOM 1018 C GLU A 69 -0.277 4.469 1.803 1.00 0.00 C ATOM 1019 O GLU A 69 0.079 3.302 1.969 1.00 0.00 O ATOM 1020 CB GLU A 69 -0.003 4.890 -0.648 1.00 0.00 C ATOM 1021 CG GLU A 69 0.598 3.551 -1.041 1.00 0.00 C ATOM 1022 CD GLU A 69 -0.118 2.912 -2.216 1.00 0.00 C ATOM 1023 OE1 GLU A 69 -0.981 3.584 -2.819 1.00 0.00 O ATOM 1024 OE2 GLU A 69 0.184 1.742 -2.530 1.00 0.00 O ATOM 0 H GLU A 69 2.220 4.429 1.219 1.00 0.00 H new ATOM 0 HA GLU A 69 0.059 6.379 0.900 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.089 4.822 -0.704 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.307 5.644 -1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.650 3.689 -1.293 1.00 0.00 H new ATOM 0 HG3 GLU A 69 0.561 2.875 -0.186 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.251 5.035 2.507 1.00 0.00 N ATOM 1032 CA ASP A 70 -1.975 4.300 3.539 1.00 0.00 C ATOM 1033 C ASP A 70 -2.635 3.055 2.956 1.00 0.00 C ATOM 1034 O ASP A 70 -3.682 3.138 2.312 1.00 0.00 O ATOM 1035 CB ASP A 70 -3.031 5.197 4.187 1.00 0.00 C ATOM 1036 CG ASP A 70 -3.849 5.960 3.165 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -4.763 5.356 2.565 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -3.577 7.162 2.965 1.00 0.00 O ATOM 0 H ASP A 70 -1.558 6.000 2.382 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.259 3.988 4.299 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.696 4.587 4.798 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.541 5.904 4.857 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.018 1.902 3.187 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.545 0.638 2.683 1.00 0.00 C ATOM 1045 C CYS A 71 -2.740 -0.361 3.820 1.00 0.00 C ATOM 1046 O CYS A 71 -2.338 -0.111 4.956 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.603 0.052 1.630 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.072 -0.631 2.306 1.00 0.00 S ATOM 0 H CYS A 71 -1.153 1.816 3.720 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.514 0.834 2.224 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.128 -0.732 1.085 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.353 0.830 0.908 1.00 0.00 H new ATOM 0 HG CYS A 71 0.452 -1.455 1.447 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.362 -1.493 3.505 1.00 0.00 N ATOM 1055 CA VAL A 72 -3.612 -2.529 4.500 1.00 0.00 C ATOM 1056 C VAL A 72 -3.200 -3.901 3.978 1.00 0.00 C ATOM 1057 O VAL A 72 -3.850 -4.464 3.097 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.097 -2.571 4.906 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.348 -3.697 5.897 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -5.528 -1.233 5.486 1.00 0.00 C ATOM 0 H VAL A 72 -3.702 -1.716 2.569 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.011 -2.280 5.375 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.694 -2.764 4.015 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.403 -3.711 6.172 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.079 -4.650 5.441 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -4.742 -3.538 6.789 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.580 -1.280 5.768 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -4.926 -1.007 6.367 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.387 -0.451 4.740 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.115 -4.437 4.529 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.616 -5.744 4.119 1.00 0.00 C ATOM 1072 C PHE A 73 -2.620 -6.841 4.460 1.00 0.00 C ATOM 1073 O PHE A 73 -3.379 -6.725 5.423 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.275 -6.036 4.796 1.00 0.00 C ATOM 1075 CG PHE A 73 0.482 -7.168 4.164 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.631 -7.237 2.788 1.00 0.00 C ATOM 1077 CD2 PHE A 73 1.045 -8.165 4.945 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.326 -8.278 2.203 1.00 0.00 C ATOM 1079 CE2 PHE A 73 1.741 -9.209 4.366 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.883 -9.265 2.993 1.00 0.00 C ATOM 0 H PHE A 73 -1.565 -3.986 5.260 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.474 -5.729 3.038 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.341 -5.137 4.767 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.450 -6.269 5.846 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.199 -6.468 2.165 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.938 -8.125 6.019 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.434 -8.320 1.129 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.173 -9.980 4.986 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.428 -10.079 2.538 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.617 -7.905 3.664 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.526 -9.023 3.882 1.00 0.00 C ATOM 1092 C ILE A 74 -2.840 -10.354 3.592 1.00 0.00 C ATOM 1093 O ILE A 74 -2.579 -10.691 2.438 1.00 0.00 O ATOM 1094 CB ILE A 74 -4.784 -8.905 3.001 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.468 -7.555 3.229 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.745 -10.048 3.294 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.722 -7.366 2.405 1.00 0.00 C ATOM 0 H ILE A 74 -1.996 -8.016 2.863 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.821 -8.990 4.931 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.484 -8.967 1.955 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -5.719 -7.458 4.285 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -4.765 -6.756 2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.629 -9.951 2.664 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.254 -10.999 3.086 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.041 -10.014 4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.153 -6.388 2.618 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.474 -7.431 1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.444 -8.143 2.657 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.553 -11.107 4.648 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.897 -12.401 4.508 1.00 0.00 C ATOM 1111 C TYR A 75 -2.917 -13.502 4.231 1.00 0.00 C ATOM 1112 O TYR A 75 -3.497 -14.074 5.154 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.103 -12.734 5.773 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.206 -13.942 5.625 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.735 -15.226 5.607 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.171 -13.799 5.504 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.081 -16.333 5.473 1.00 0.00 C ATOM 1118 CE2 TYR A 75 1.994 -14.900 5.367 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.444 -16.164 5.353 1.00 0.00 C ATOM 1120 OH TYR A 75 2.261 -17.264 5.218 1.00 0.00 O ATOM 0 H TYR A 75 -2.764 -10.843 5.610 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.213 -12.343 3.662 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.495 -11.872 6.048 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.799 -12.907 6.594 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.802 -15.362 5.699 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.605 -12.810 5.517 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -0.346 -17.325 5.462 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.062 -14.771 5.271 1.00 0.00 H new ATOM 0 HH TYR A 75 3.193 -16.972 5.144 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.129 -13.793 2.952 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.078 -14.825 2.551 1.00 0.00 C ATOM 1132 C CYS A 76 -3.364 -16.146 2.281 1.00 0.00 C ATOM 1133 O CYS A 76 -2.266 -16.166 1.726 1.00 0.00 O ATOM 1134 CB CYS A 76 -4.846 -14.383 1.304 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.085 -15.573 0.740 1.00 0.00 S ATOM 0 H CYS A 76 -2.657 -13.329 2.176 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.782 -14.974 3.370 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.338 -13.433 1.511 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.135 -14.204 0.497 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.682 -15.109 -0.317 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.995 -17.245 2.680 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.419 -18.570 2.484 1.00 0.00 C ATOM 1143 C GLN A 77 -4.247 -19.383 1.494 1.00 0.00 C ATOM 1144 O GLN A 77 -5.394 -19.734 1.770 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.325 -19.311 3.819 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.379 -18.657 4.813 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.375 -19.353 6.159 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -1.400 -20.008 6.530 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.468 -19.215 6.901 1.00 0.00 N ATOM 0 H GLN A 77 -4.905 -17.244 3.141 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.417 -18.446 2.074 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.319 -19.372 4.262 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.995 -20.333 3.635 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.369 -18.660 4.404 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.665 -17.614 4.948 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -4.253 -18.663 6.555 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.522 -19.661 7.817 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.657 -19.680 0.340 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.340 -20.452 -0.691 1.00 0.00 C ATOM 1160 C VAL A 78 -4.848 -21.779 -0.137 1.00 0.00 C ATOM 1161 O VAL A 78 -6.011 -22.136 -0.322 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.414 -20.730 -1.890 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.938 -19.425 -2.510 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -2.233 -21.589 -1.463 1.00 0.00 C ATOM 0 H VAL A 78 -2.708 -19.398 0.096 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.187 -19.853 -1.027 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.979 -21.278 -2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.285 -19.641 -3.356 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.798 -18.850 -2.853 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.389 -18.848 -1.766 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.589 -21.776 -2.323 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.666 -21.070 -0.691 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.597 -22.538 -1.069 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.967 -22.506 0.544 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.345 -23.785 1.115 1.00 0.00 C ATOM 1176 C GLY A 79 -3.152 -24.691 1.349 1.00 0.00 C ATOM 1177 O GLY A 79 -2.096 -24.236 1.787 1.00 0.00 O ATOM 0 H GLY A 79 -2.999 -22.232 0.710 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.862 -23.619 2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.050 -24.283 0.449 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.321 -25.976 1.057 1.00 0.00 N ATOM 1182 CA ASP A 80 -2.250 -26.949 1.239 1.00 0.00 C ATOM 1183 C ASP A 80 -1.394 -27.055 -0.020 1.00 0.00 C ATOM 1184 O ASP A 80 -1.706 -26.456 -1.049 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.830 -28.318 1.594 1.00 0.00 C ATOM 1186 CG ASP A 80 -3.986 -28.222 2.571 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -4.137 -27.158 3.206 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -4.738 -29.211 2.700 1.00 0.00 O ATOM 0 H ASP A 80 -4.190 -26.368 0.693 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.618 -26.608 2.059 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.168 -28.813 0.684 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.046 -28.941 2.024 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.313 -27.823 0.069 1.00 0.00 N ATOM 1194 CA LYS A 81 0.589 -28.010 -1.061 1.00 0.00 C ATOM 1195 C LYS A 81 -0.170 -28.513 -2.285 1.00 0.00 C ATOM 1196 O LYS A 81 -0.164 -27.891 -3.348 1.00 0.00 O ATOM 1197 CB LYS A 81 1.700 -28.996 -0.696 1.00 0.00 C ATOM 1198 CG LYS A 81 2.197 -29.816 -1.874 1.00 0.00 C ATOM 1199 CD LYS A 81 3.639 -30.254 -1.679 1.00 0.00 C ATOM 1200 CE LYS A 81 3.723 -31.575 -0.930 1.00 0.00 C ATOM 1201 NZ LYS A 81 5.101 -32.141 -0.956 1.00 0.00 N ATOM 0 H LYS A 81 -0.040 -28.326 0.913 1.00 0.00 H new ATOM 0 HA LYS A 81 1.034 -27.045 -1.302 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.538 -28.445 -0.269 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.335 -29.671 0.078 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.563 -30.694 -2.001 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.115 -29.228 -2.788 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.125 -30.353 -2.650 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.182 -29.487 -1.128 1.00 0.00 H new ATOM 0 HE2 LYS A 81 3.411 -31.427 0.104 1.00 0.00 H new ATOM 0 HE3 LYS A 81 3.029 -32.289 -1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 5.117 -33.041 -0.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.390 -32.306 -1.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.760 -31.471 -0.510 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.841 -29.665 -2.134 1.00 0.00 N ATOM 1216 CA PRO A 82 -1.618 -30.276 -3.216 1.00 0.00 C ATOM 1217 C PRO A 82 -2.873 -29.476 -3.552 1.00 0.00 C ATOM 1218 O PRO A 82 -3.591 -29.797 -4.498 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.994 -31.648 -2.652 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.970 -31.469 -1.173 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.891 -30.459 -0.895 1.00 0.00 C ATOM 0 HA PRO A 82 -1.053 -30.323 -4.147 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.979 -31.961 -2.997 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.287 -32.414 -2.970 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.935 -31.120 -0.807 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.760 -32.413 -0.669 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -1.132 -29.840 -0.031 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.065 -30.939 -0.686 1.00 0.00 H new ATOM 1229 N TYR A 83 -3.130 -28.433 -2.770 1.00 0.00 N ATOM 1230 CA TYR A 83 -4.299 -27.588 -2.983 1.00 0.00 C ATOM 1231 C TYR A 83 -3.975 -26.439 -3.933 1.00 0.00 C ATOM 1232 O TYR A 83 -4.761 -26.115 -4.824 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.805 -27.035 -1.650 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.974 -26.087 -1.792 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.781 -24.771 -2.194 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -7.271 -26.507 -1.524 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -6.846 -23.901 -2.324 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -8.342 -25.644 -1.653 1.00 0.00 C ATOM 1239 CZ TYR A 83 -8.125 -24.342 -2.053 1.00 0.00 C ATOM 1240 OH TYR A 83 -9.188 -23.479 -2.183 1.00 0.00 O ATOM 0 H TYR A 83 -2.545 -28.153 -1.983 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.080 -28.200 -3.435 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.098 -27.867 -1.009 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.988 -26.518 -1.147 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.782 -24.422 -2.408 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.445 -27.525 -1.209 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.678 -22.881 -2.636 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -9.344 -25.987 -1.442 1.00 0.00 H new ATOM 0 HH TYR A 83 -10.019 -23.947 -1.956 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.813 -25.828 -3.736 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.383 -24.715 -4.575 1.00 0.00 C ATOM 1252 C TRP A 84 -2.212 -25.160 -6.024 1.00 0.00 C ATOM 1253 O TRP A 84 -2.646 -24.474 -6.950 1.00 0.00 O ATOM 1254 CB TRP A 84 -1.071 -24.130 -4.050 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.342 -23.302 -5.064 1.00 0.00 C ATOM 1256 CD1 TRP A 84 0.948 -23.467 -5.482 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.859 -22.179 -5.785 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.263 -22.513 -6.420 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.172 -21.712 -6.624 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -2.093 -21.523 -5.806 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.004 -20.620 -7.472 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.258 -20.440 -6.648 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.215 -19.997 -7.472 1.00 0.00 C ATOM 0 H TRP A 84 -2.151 -26.084 -3.003 1.00 0.00 H new ATOM 0 HA TRP A 84 -3.155 -23.946 -4.539 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -1.280 -23.517 -3.173 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.424 -24.944 -3.723 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.621 -24.234 -5.128 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.164 -22.417 -6.888 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.903 -21.857 -5.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.807 -20.277 -8.107 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.208 -19.926 -6.671 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.376 -19.148 -8.120 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.576 -26.311 -6.213 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.348 -26.849 -7.549 1.00 0.00 C ATOM 1276 C LYS A 85 -2.640 -26.857 -8.360 1.00 0.00 C ATOM 1277 O LYS A 85 -2.625 -26.644 -9.573 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.781 -28.267 -7.461 1.00 0.00 C ATOM 1279 CG LYS A 85 0.027 -28.521 -6.200 1.00 0.00 C ATOM 1280 CD LYS A 85 0.854 -29.791 -6.314 1.00 0.00 C ATOM 1281 CE LYS A 85 2.247 -29.503 -6.850 1.00 0.00 C ATOM 1282 NZ LYS A 85 2.297 -29.581 -8.336 1.00 0.00 N ATOM 0 H LYS A 85 -1.209 -26.890 -5.457 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.626 -26.206 -8.053 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.603 -28.982 -7.506 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.150 -28.452 -8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.685 -27.673 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -0.645 -28.599 -5.346 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.930 -30.266 -5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 85 0.349 -30.498 -6.972 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.562 -28.511 -6.528 1.00 0.00 H new ATOM 0 HE3 LYS A 85 2.954 -30.215 -6.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 3.276 -29.752 -8.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 1.691 -30.360 -8.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.959 -28.685 -8.742 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.757 -27.102 -7.683 1.00 0.00 N ATOM 1297 CA ASP A 86 -5.058 -27.134 -8.341 1.00 0.00 C ATOM 1298 C ASP A 86 -5.171 -26.021 -9.378 1.00 0.00 C ATOM 1299 O ASP A 86 -5.404 -24.857 -9.051 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.178 -27.002 -7.308 1.00 0.00 C ATOM 1301 CG ASP A 86 -6.013 -27.964 -6.148 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.981 -28.666 -6.102 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.915 -28.016 -5.286 1.00 0.00 O ATOM 0 H ASP A 86 -3.787 -27.281 -6.679 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.156 -28.092 -8.852 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.200 -25.980 -6.929 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.138 -27.183 -7.792 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.001 -26.384 -10.658 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.080 -25.431 -11.768 1.00 0.00 C ATOM 1310 C PRO A 87 -6.499 -24.924 -11.998 1.00 0.00 C ATOM 1311 O PRO A 87 -6.724 -24.029 -12.811 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.602 -26.248 -12.971 1.00 0.00 C ATOM 1313 CG PRO A 87 -4.897 -27.663 -12.610 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.721 -27.754 -11.119 1.00 0.00 C ATOM 0 HA PRO A 87 -4.487 -24.536 -11.580 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.125 -25.955 -13.881 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.538 -26.100 -13.153 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.911 -27.937 -12.901 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.222 -28.346 -13.125 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.408 -28.475 -10.677 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.712 -28.070 -10.852 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.453 -25.502 -11.276 1.00 0.00 N ATOM 1323 CA ASN A 88 -8.852 -25.108 -11.402 1.00 0.00 C ATOM 1324 C ASN A 88 -9.355 -24.468 -10.112 1.00 0.00 C ATOM 1325 O ASN A 88 -10.521 -24.616 -9.747 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.716 -26.321 -11.753 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.401 -27.525 -10.886 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -9.762 -27.568 -9.710 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -8.725 -28.511 -11.466 1.00 0.00 N ATOM 0 H ASN A 88 -7.283 -26.245 -10.598 1.00 0.00 H new ATOM 0 HA ASN A 88 -8.926 -24.374 -12.204 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.768 -26.060 -11.639 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -9.564 -26.581 -12.801 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.485 -29.347 -10.933 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.446 -28.432 -12.444 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.467 -23.756 -9.425 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.821 -23.093 -8.175 1.00 0.00 C ATOM 1338 C ASN A 89 -9.286 -21.662 -8.431 1.00 0.00 C ATOM 1339 O ASN A 89 -8.857 -21.022 -9.391 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.626 -23.090 -7.220 1.00 0.00 C ATOM 1341 CG ASN A 89 -6.332 -22.712 -7.914 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -6.343 -22.126 -8.997 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -5.208 -23.047 -7.291 1.00 0.00 N ATOM 0 H ASN A 89 -7.497 -23.624 -9.713 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.642 -23.646 -7.718 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -7.816 -22.390 -6.406 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.520 -24.078 -6.772 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -4.306 -22.819 -7.709 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.247 -23.532 -6.395 1.00 0.00 H new ATOM 1350 N ASP A 90 -10.164 -21.168 -7.566 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.687 -19.813 -7.696 1.00 0.00 C ATOM 1352 C ASP A 90 -9.550 -18.798 -7.776 1.00 0.00 C ATOM 1353 O ASP A 90 -9.744 -17.668 -8.225 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.602 -19.480 -6.516 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.906 -20.252 -6.560 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -13.362 -20.583 -7.674 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -13.471 -20.525 -5.480 1.00 0.00 O ATOM 0 H ASP A 90 -10.529 -21.686 -6.767 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.264 -19.760 -8.619 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.083 -19.702 -5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.816 -18.411 -6.516 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.365 -19.209 -7.337 1.00 0.00 N ATOM 1363 CA PHE A 91 -7.198 -18.335 -7.357 1.00 0.00 C ATOM 1364 C PHE A 91 -6.684 -18.146 -8.782 1.00 0.00 C ATOM 1365 O PHE A 91 -6.261 -17.054 -9.161 1.00 0.00 O ATOM 1366 CB PHE A 91 -6.088 -18.910 -6.475 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.393 -18.840 -5.006 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.129 -17.687 -4.284 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.945 -19.927 -4.347 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.408 -17.620 -2.932 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -7.226 -19.866 -2.995 1.00 0.00 C ATOM 1372 CZ PHE A 91 -6.959 -18.710 -2.287 1.00 0.00 C ATOM 0 H PHE A 91 -8.188 -20.141 -6.963 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.497 -17.363 -6.965 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.916 -19.950 -6.753 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.162 -18.370 -6.672 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.700 -16.831 -4.784 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.158 -20.832 -4.896 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.195 -16.716 -2.380 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.654 -20.721 -2.493 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.181 -18.659 -1.231 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.724 -19.219 -9.565 1.00 0.00 N ATOM 1383 CA ARG A 92 -6.261 -19.173 -10.947 1.00 0.00 C ATOM 1384 C ARG A 92 -7.427 -18.938 -11.903 1.00 0.00 C ATOM 1385 O ARG A 92 -7.225 -18.632 -13.078 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.544 -20.474 -11.311 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.272 -20.712 -10.513 1.00 0.00 C ATOM 1388 CD ARG A 92 -3.711 -22.104 -10.760 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.683 -22.460 -9.787 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.813 -23.448 -9.965 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.848 -24.174 -11.074 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.906 -23.712 -9.033 1.00 0.00 N ATOM 0 H ARG A 92 -7.072 -20.130 -9.266 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.562 -18.342 -11.042 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.224 -21.311 -11.152 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -5.299 -20.459 -12.373 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.526 -19.965 -10.784 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.479 -20.585 -9.450 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.520 -22.834 -10.716 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.291 -22.153 -11.765 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.630 -21.921 -8.923 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.544 -23.974 -11.793 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -1.179 -24.932 -11.209 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.876 -23.156 -8.178 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -0.239 -24.471 -9.171 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.644 -19.083 -11.391 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.841 -18.888 -12.200 1.00 0.00 C ATOM 1408 C GLN A 93 -10.394 -17.477 -12.023 1.00 0.00 C ATOM 1409 O GLN A 93 -10.780 -16.823 -12.992 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.909 -19.917 -11.826 1.00 0.00 C ATOM 1411 CG GLN A 93 -10.432 -21.356 -11.937 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.550 -21.903 -13.346 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.627 -21.883 -13.944 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.441 -22.396 -13.886 1.00 0.00 N ATOM 0 H GLN A 93 -8.828 -19.335 -10.420 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.567 -19.023 -13.246 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.240 -19.730 -10.804 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.776 -19.780 -12.472 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.393 -21.416 -11.614 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -11.013 -21.981 -11.259 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.570 -22.393 -13.355 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.460 -22.778 -14.832 1.00 0.00 H new ATOM 1423 N LYS A 94 -10.430 -17.014 -10.778 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.935 -15.680 -10.472 1.00 0.00 C ATOM 1425 C LYS A 94 -9.789 -14.681 -10.345 1.00 0.00 C ATOM 1426 O LYS A 94 -9.777 -13.647 -11.014 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.750 -15.706 -9.177 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.852 -16.750 -9.172 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.939 -16.410 -8.166 1.00 0.00 C ATOM 1430 CE LYS A 94 -14.750 -17.639 -7.784 1.00 0.00 C ATOM 1431 NZ LYS A 94 -16.105 -17.276 -7.286 1.00 0.00 N ATOM 0 H LYS A 94 -10.116 -17.543 -9.964 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.579 -15.365 -11.293 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.079 -15.895 -8.339 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.192 -14.723 -9.016 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.288 -16.825 -10.168 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.428 -17.726 -8.935 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.487 -15.979 -7.273 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.601 -15.652 -8.586 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.845 -18.295 -8.649 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.219 -18.200 -7.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.626 -18.141 -7.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.015 -16.671 -6.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -16.622 -16.763 -8.028 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.828 -14.996 -9.484 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.677 -14.126 -9.271 1.00 0.00 C ATOM 1447 C LEU A 95 -6.636 -14.321 -10.369 1.00 0.00 C ATOM 1448 O LEU A 95 -5.791 -13.456 -10.598 1.00 0.00 O ATOM 1449 CB LEU A 95 -7.050 -14.404 -7.903 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.824 -13.884 -6.692 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -7.144 -14.311 -5.400 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.953 -12.369 -6.752 1.00 0.00 C ATOM 0 H LEU A 95 -8.823 -15.847 -8.922 1.00 0.00 H new ATOM 0 HA LEU A 95 -8.022 -13.093 -9.303 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.926 -15.482 -7.795 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.052 -13.965 -7.887 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.825 -14.316 -6.712 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.709 -13.932 -4.549 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.103 -15.399 -5.353 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -6.131 -13.909 -5.372 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.507 -12.016 -5.882 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.960 -11.919 -6.757 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.485 -12.085 -7.660 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.705 -15.462 -11.047 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.772 -15.770 -12.124 1.00 0.00 C ATOM 1466 C LYS A 96 -4.330 -15.588 -11.663 1.00 0.00 C ATOM 1467 O LYS A 96 -3.542 -14.900 -12.313 1.00 0.00 O ATOM 1468 CB LYS A 96 -6.048 -14.876 -13.336 1.00 0.00 C ATOM 1469 CG LYS A 96 -7.070 -15.455 -14.298 1.00 0.00 C ATOM 1470 CD LYS A 96 -8.491 -15.200 -13.823 1.00 0.00 C ATOM 1471 CE LYS A 96 -9.020 -13.869 -14.337 1.00 0.00 C ATOM 1472 NZ LYS A 96 -9.358 -13.930 -15.786 1.00 0.00 N ATOM 0 H LYS A 96 -7.398 -16.189 -10.869 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.915 -16.812 -12.408 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -6.399 -13.904 -12.988 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.114 -14.705 -13.871 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -6.931 -15.015 -15.286 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -6.907 -16.528 -14.401 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -9.140 -16.007 -14.164 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.518 -15.207 -12.733 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -9.906 -13.586 -13.769 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.273 -13.092 -14.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -9.942 -13.108 -16.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -8.483 -13.921 -16.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.886 -14.804 -15.983 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.990 -16.211 -10.539 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.641 -16.119 -9.994 1.00 0.00 C ATOM 1488 C ILE A 97 -1.631 -16.803 -10.909 1.00 0.00 C ATOM 1489 O ILE A 97 -1.983 -17.683 -11.695 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.557 -16.751 -8.592 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.499 -16.029 -7.626 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -1.126 -16.707 -8.076 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -3.331 -14.526 -7.628 1.00 0.00 C ATOM 0 H ILE A 97 -4.630 -16.784 -9.989 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.401 -15.058 -9.921 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.866 -17.794 -8.661 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.529 -16.272 -7.887 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.329 -16.404 -6.617 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.083 -17.157 -7.084 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.477 -17.261 -8.755 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.791 -15.671 -8.019 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -4.030 -14.081 -6.920 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.311 -14.274 -7.338 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.530 -14.139 -8.627 1.00 0.00 H new ATOM 1505 N THR A 98 -0.370 -16.395 -10.799 1.00 0.00 N ATOM 1506 CA THR A 98 0.693 -16.968 -11.616 1.00 0.00 C ATOM 1507 C THR A 98 1.514 -17.976 -10.820 1.00 0.00 C ATOM 1508 O THR A 98 1.499 -19.172 -11.112 1.00 0.00 O ATOM 1509 CB THR A 98 1.631 -15.876 -12.163 1.00 0.00 C ATOM 1510 OG1 THR A 98 0.867 -14.851 -12.807 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.630 -16.465 -13.148 1.00 0.00 C ATOM 0 H THR A 98 -0.060 -15.670 -10.152 1.00 0.00 H new ATOM 0 HA THR A 98 0.212 -17.475 -12.452 1.00 0.00 H new ATOM 0 HB THR A 98 2.180 -15.447 -11.325 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.473 -14.184 -13.192 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.282 -15.675 -13.521 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.230 -17.225 -12.647 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.094 -16.918 -13.982 1.00 0.00 H new ATOM 1519 N ALA A 99 2.229 -17.487 -9.813 1.00 0.00 N ATOM 1520 CA ALA A 99 3.055 -18.346 -8.974 1.00 0.00 C ATOM 1521 C ALA A 99 3.151 -17.798 -7.554 1.00 0.00 C ATOM 1522 O ALA A 99 3.519 -16.641 -7.348 1.00 0.00 O ATOM 1523 CB ALA A 99 4.443 -18.499 -9.578 1.00 0.00 C ATOM 0 H ALA A 99 2.253 -16.500 -9.558 1.00 0.00 H new ATOM 0 HA ALA A 99 2.582 -19.327 -8.926 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.048 -19.143 -8.940 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.361 -18.944 -10.570 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.915 -17.520 -9.657 1.00 0.00 H new ATOM 1529 N VAL A 100 2.818 -18.635 -6.577 1.00 0.00 N ATOM 1530 CA VAL A 100 2.868 -18.234 -5.176 1.00 0.00 C ATOM 1531 C VAL A 100 4.277 -18.376 -4.613 1.00 0.00 C ATOM 1532 O VAL A 100 5.045 -19.254 -5.009 1.00 0.00 O ATOM 1533 CB VAL A 100 1.898 -19.069 -4.319 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.516 -19.102 -4.954 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.438 -20.477 -4.122 1.00 0.00 C ATOM 0 H VAL A 100 2.511 -19.595 -6.730 1.00 0.00 H new ATOM 0 HA VAL A 100 2.568 -17.187 -5.136 1.00 0.00 H new ATOM 0 HB VAL A 100 1.809 -18.599 -3.340 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.155 -19.697 -4.334 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.129 -18.086 -5.037 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.582 -19.547 -5.947 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.740 -21.053 -3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.558 -20.960 -5.092 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.403 -20.429 -3.618 1.00 0.00 H new ATOM 1545 N PRO A 101 4.628 -17.494 -3.666 1.00 0.00 N ATOM 1546 CA PRO A 101 3.723 -16.445 -3.187 1.00 0.00 C ATOM 1547 C PRO A 101 3.477 -15.368 -4.238 1.00 0.00 C ATOM 1548 O PRO A 101 4.359 -15.051 -5.037 1.00 0.00 O ATOM 1549 CB PRO A 101 4.465 -15.858 -1.984 1.00 0.00 C ATOM 1550 CG PRO A 101 5.903 -16.143 -2.250 1.00 0.00 C ATOM 1551 CD PRO A 101 5.936 -17.452 -2.990 1.00 0.00 C ATOM 0 HA PRO A 101 2.735 -16.838 -2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.284 -14.787 -1.891 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.136 -16.319 -1.053 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.355 -15.348 -2.843 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.467 -16.207 -1.319 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.759 -17.490 -3.704 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.065 -18.295 -2.311 1.00 0.00 H new ATOM 1559 N THR A 102 2.272 -14.806 -4.231 1.00 0.00 N ATOM 1560 CA THR A 102 1.909 -13.764 -5.184 1.00 0.00 C ATOM 1561 C THR A 102 1.415 -12.512 -4.469 1.00 0.00 C ATOM 1562 O THR A 102 0.387 -12.538 -3.790 1.00 0.00 O ATOM 1563 CB THR A 102 0.819 -14.249 -6.159 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.241 -15.455 -6.805 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.517 -13.186 -7.204 1.00 0.00 C ATOM 0 H THR A 102 1.531 -15.055 -3.576 1.00 0.00 H new ATOM 0 HA THR A 102 2.810 -13.524 -5.748 1.00 0.00 H new ATOM 0 HB THR A 102 -0.089 -14.443 -5.588 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.219 -15.510 -6.788 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.255 -13.551 -7.881 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.168 -12.279 -6.710 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.422 -12.965 -7.771 1.00 0.00 H new ATOM 1573 N LEU A 103 2.151 -11.418 -4.624 1.00 0.00 N ATOM 1574 CA LEU A 103 1.787 -10.154 -3.993 1.00 0.00 C ATOM 1575 C LEU A 103 1.099 -9.226 -4.989 1.00 0.00 C ATOM 1576 O LEU A 103 1.757 -8.542 -5.773 1.00 0.00 O ATOM 1577 CB LEU A 103 3.029 -9.472 -3.417 1.00 0.00 C ATOM 1578 CG LEU A 103 2.782 -8.195 -2.613 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.141 -8.525 -1.273 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.083 -7.432 -2.411 1.00 0.00 C ATOM 0 H LEU A 103 3.004 -11.380 -5.182 1.00 0.00 H new ATOM 0 HA LEU A 103 1.090 -10.369 -3.183 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.547 -10.186 -2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.703 -9.235 -4.240 1.00 0.00 H new ATOM 0 HG LEU A 103 2.096 -7.561 -3.175 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.972 -7.605 -0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.189 -9.028 -1.439 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.802 -9.179 -0.704 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.888 -6.526 -1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.792 -8.059 -1.870 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.502 -7.164 -3.381 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.229 -9.207 -4.951 1.00 0.00 N ATOM 1593 CA LEU A 104 -1.007 -8.361 -5.849 1.00 0.00 C ATOM 1594 C LEU A 104 -1.420 -7.066 -5.157 1.00 0.00 C ATOM 1595 O LEU A 104 -1.962 -7.085 -4.052 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.249 -9.109 -6.338 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.435 -8.239 -6.758 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -3.144 -7.542 -8.078 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.700 -9.077 -6.863 1.00 0.00 C ATOM 0 H LEU A 104 -0.789 -9.767 -4.308 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.380 -8.110 -6.705 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.963 -9.732 -7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.579 -9.781 -5.546 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.591 -7.477 -5.995 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.999 -6.928 -8.361 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.263 -6.910 -7.969 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.962 -8.288 -8.851 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.533 -8.442 -7.163 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.556 -9.861 -7.606 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.918 -9.529 -5.896 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.160 -5.941 -5.814 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.507 -4.635 -5.264 1.00 0.00 C ATOM 1613 C LYS A 105 -2.908 -4.217 -5.698 1.00 0.00 C ATOM 1614 O LYS A 105 -3.088 -3.624 -6.762 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.488 -3.584 -5.711 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.819 -2.178 -5.240 1.00 0.00 C ATOM 1617 CD LYS A 105 0.355 -1.234 -5.435 1.00 0.00 C ATOM 1618 CE LYS A 105 0.111 0.106 -4.760 1.00 0.00 C ATOM 1619 NZ LYS A 105 1.335 0.954 -4.750 1.00 0.00 N ATOM 0 H LYS A 105 -0.710 -5.907 -6.729 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.490 -4.710 -4.177 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.497 -3.862 -5.335 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.427 -3.589 -6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.683 -1.804 -5.789 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.096 -2.202 -4.186 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.259 -1.688 -5.029 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.526 -1.080 -6.500 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.691 0.632 -5.277 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -0.225 -0.059 -3.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 1.315 1.582 -3.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 2.178 0.346 -4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 1.368 1.526 -5.618 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.897 -4.528 -4.868 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.283 -4.185 -5.167 1.00 0.00 C ATOM 1635 C TYR A 106 -5.393 -2.748 -5.665 1.00 0.00 C ATOM 1636 O TYR A 106 -5.279 -1.799 -4.890 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.156 -4.375 -3.925 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.599 -4.693 -4.243 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.930 -5.744 -5.089 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.633 -3.943 -3.696 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.247 -6.037 -5.383 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -9.954 -4.230 -3.983 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.256 -5.278 -4.827 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.569 -5.568 -5.116 1.00 0.00 O ATOM 0 H TYR A 106 -3.765 -5.017 -3.983 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.634 -4.851 -5.955 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.740 -5.180 -3.319 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.117 -3.468 -3.321 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.143 -6.342 -5.524 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.400 -3.121 -3.035 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.486 -6.856 -6.045 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.745 -3.637 -3.549 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.154 -4.940 -4.643 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.615 -2.595 -6.967 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.738 -1.271 -7.549 1.00 0.00 C ATOM 1656 C GLY A 107 -4.860 -1.092 -8.772 1.00 0.00 C ATOM 1657 O GLY A 107 -5.220 -0.372 -9.704 1.00 0.00 O ATOM 0 H GLY A 107 -5.712 -3.365 -7.629 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.778 -1.093 -7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.472 -0.523 -6.802 1.00 0.00 H new ATOM 1661 N THR A 108 -3.703 -1.746 -8.769 1.00 0.00 N ATOM 1662 CA THR A 108 -2.770 -1.653 -9.884 1.00 0.00 C ATOM 1663 C THR A 108 -2.311 -3.035 -10.335 1.00 0.00 C ATOM 1664 O THR A 108 -2.273 -3.987 -9.555 1.00 0.00 O ATOM 1665 CB THR A 108 -1.534 -0.810 -9.515 1.00 0.00 C ATOM 1666 OG1 THR A 108 -0.860 -1.395 -8.395 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.934 0.620 -9.183 1.00 0.00 C ATOM 0 H THR A 108 -3.390 -2.346 -8.006 1.00 0.00 H new ATOM 0 HA THR A 108 -3.303 -1.166 -10.700 1.00 0.00 H new ATOM 0 HB THR A 108 -0.863 -0.792 -10.374 1.00 0.00 H new ATOM 0 HG1 THR A 108 -1.388 -2.146 -8.051 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.045 1.196 -8.926 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.421 1.071 -10.047 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.623 0.618 -8.338 1.00 0.00 H new ATOM 1675 N PRO A 109 -1.955 -3.151 -11.622 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.491 -4.414 -12.205 1.00 0.00 C ATOM 1677 C PRO A 109 -0.117 -4.822 -11.686 1.00 0.00 C ATOM 1678 O PRO A 109 0.406 -5.875 -12.049 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.428 -4.111 -13.704 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.238 -2.636 -13.785 1.00 0.00 C ATOM 1681 CD PRO A 109 -1.976 -2.058 -12.609 1.00 0.00 C ATOM 0 HA PRO A 109 -2.149 -5.245 -11.952 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.605 -4.643 -14.181 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.343 -4.421 -14.209 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.180 -2.376 -13.748 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.630 -2.243 -14.723 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.485 -1.163 -12.227 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -2.995 -1.775 -12.874 1.00 0.00 H new ATOM 1689 N GLN A 110 0.463 -3.982 -10.834 1.00 0.00 N ATOM 1690 CA GLN A 110 1.777 -4.256 -10.266 1.00 0.00 C ATOM 1691 C GLN A 110 1.696 -5.360 -9.217 1.00 0.00 C ATOM 1692 O GLN A 110 0.958 -5.248 -8.238 1.00 0.00 O ATOM 1693 CB GLN A 110 2.362 -2.987 -9.644 1.00 0.00 C ATOM 1694 CG GLN A 110 3.073 -2.091 -10.646 1.00 0.00 C ATOM 1695 CD GLN A 110 4.194 -1.287 -10.017 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.349 -1.378 -10.434 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.859 -0.493 -9.007 1.00 0.00 N ATOM 0 H GLN A 110 0.043 -3.106 -10.522 1.00 0.00 H new ATOM 0 HA GLN A 110 2.431 -4.592 -11.071 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.560 -2.422 -9.169 1.00 0.00 H new ATOM 0 HB3 GLN A 110 3.063 -3.267 -8.858 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.478 -2.703 -11.452 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.350 -1.410 -11.095 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.889 -0.448 -8.693 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.571 0.072 -8.545 1.00 0.00 H new ATOM 1706 N LYS A 111 2.461 -6.426 -9.427 1.00 0.00 N ATOM 1707 CA LYS A 111 2.477 -7.551 -8.500 1.00 0.00 C ATOM 1708 C LYS A 111 3.882 -8.131 -8.373 1.00 0.00 C ATOM 1709 O LYS A 111 4.670 -8.090 -9.319 1.00 0.00 O ATOM 1710 CB LYS A 111 1.506 -8.638 -8.966 1.00 0.00 C ATOM 1711 CG LYS A 111 1.739 -9.088 -10.398 1.00 0.00 C ATOM 1712 CD LYS A 111 2.735 -10.233 -10.468 1.00 0.00 C ATOM 1713 CE LYS A 111 2.040 -11.583 -10.375 1.00 0.00 C ATOM 1714 NZ LYS A 111 2.871 -12.675 -10.954 1.00 0.00 N ATOM 0 H LYS A 111 3.078 -6.534 -10.232 1.00 0.00 H new ATOM 0 HA LYS A 111 2.162 -7.187 -7.522 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.594 -9.500 -8.304 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.486 -8.267 -8.872 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.793 -9.400 -10.841 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.106 -8.249 -10.989 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.294 -10.174 -11.402 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.458 -10.138 -9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 111 1.821 -11.808 -9.331 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.085 -11.537 -10.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 2.285 -13.261 -11.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.656 -12.263 -11.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 3.253 -13.264 -10.187 1.00 0.00 H new ATOM 1728 N LEU A 112 4.191 -8.671 -7.199 1.00 0.00 N ATOM 1729 CA LEU A 112 5.501 -9.261 -6.949 1.00 0.00 C ATOM 1730 C LEU A 112 5.397 -10.776 -6.798 1.00 0.00 C ATOM 1731 O LEU A 112 4.736 -11.275 -5.887 1.00 0.00 O ATOM 1732 CB LEU A 112 6.124 -8.653 -5.691 1.00 0.00 C ATOM 1733 CG LEU A 112 6.127 -7.126 -5.614 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.910 -6.654 -4.399 1.00 0.00 C ATOM 1735 CD2 LEU A 112 6.706 -6.529 -6.889 1.00 0.00 C ATOM 0 H LEU A 112 3.552 -8.712 -6.405 1.00 0.00 H new ATOM 0 HA LEU A 112 6.139 -9.043 -7.805 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.591 -9.039 -4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.154 -9.003 -5.614 1.00 0.00 H new ATOM 0 HG LEU A 112 5.097 -6.785 -5.512 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.901 -5.565 -4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.452 -7.052 -3.494 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.939 -7.006 -4.470 1.00 0.00 H new ATOM 0 HD21 LEU A 112 6.700 -5.441 -6.817 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.730 -6.879 -7.022 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.103 -6.839 -7.742 1.00 0.00 H new ATOM 1747 N VAL A 113 6.056 -11.502 -7.695 1.00 0.00 N ATOM 1748 CA VAL A 113 6.041 -12.959 -7.660 1.00 0.00 C ATOM 1749 C VAL A 113 7.037 -13.495 -6.638 1.00 0.00 C ATOM 1750 O VAL A 113 7.786 -12.732 -6.028 1.00 0.00 O ATOM 1751 CB VAL A 113 6.367 -13.558 -9.041 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.657 -14.890 -9.227 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.988 -12.584 -10.146 1.00 0.00 C ATOM 0 H VAL A 113 6.607 -11.104 -8.455 1.00 0.00 H new ATOM 0 HA VAL A 113 5.033 -13.257 -7.372 1.00 0.00 H new ATOM 0 HB VAL A 113 7.441 -13.736 -9.096 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.899 -15.298 -10.208 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.982 -15.587 -8.454 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.580 -14.742 -9.152 1.00 0.00 H new ATOM 0 HG21 VAL A 113 6.225 -13.023 -11.115 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.920 -12.373 -10.095 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.547 -11.657 -10.021 1.00 0.00 H new ATOM 1763 N GLU A 114 7.040 -14.812 -6.456 1.00 0.00 N ATOM 1764 CA GLU A 114 7.945 -15.449 -5.507 1.00 0.00 C ATOM 1765 C GLU A 114 9.265 -14.688 -5.419 1.00 0.00 C ATOM 1766 O GLU A 114 9.611 -14.143 -4.370 1.00 0.00 O ATOM 1767 CB GLU A 114 8.207 -16.901 -5.914 1.00 0.00 C ATOM 1768 CG GLU A 114 6.955 -17.647 -6.344 1.00 0.00 C ATOM 1769 CD GLU A 114 7.168 -19.146 -6.423 1.00 0.00 C ATOM 1770 OE1 GLU A 114 7.840 -19.699 -5.527 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.662 -19.767 -7.382 1.00 0.00 O ATOM 0 H GLU A 114 6.426 -15.458 -6.953 1.00 0.00 H new ATOM 0 HA GLU A 114 7.471 -15.434 -4.526 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.928 -16.916 -6.732 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.664 -17.428 -5.076 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.150 -17.435 -5.640 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.633 -17.278 -7.318 1.00 0.00 H new ATOM 1778 N SER A 115 9.998 -14.657 -6.527 1.00 0.00 N ATOM 1779 CA SER A 115 11.282 -13.967 -6.574 1.00 0.00 C ATOM 1780 C SER A 115 11.132 -12.510 -6.149 1.00 0.00 C ATOM 1781 O SER A 115 11.944 -11.989 -5.384 1.00 0.00 O ATOM 1782 CB SER A 115 11.872 -14.041 -7.984 1.00 0.00 C ATOM 1783 OG SER A 115 13.004 -13.196 -8.108 1.00 0.00 O ATOM 0 H SER A 115 9.725 -15.101 -7.404 1.00 0.00 H new ATOM 0 HA SER A 115 11.959 -14.462 -5.877 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.155 -15.069 -8.210 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.116 -13.751 -8.714 1.00 0.00 H new ATOM 0 HG SER A 115 13.364 -13.262 -9.017 1.00 0.00 H new ATOM 1789 N GLU A 116 10.088 -11.858 -6.650 1.00 0.00 N ATOM 1790 CA GLU A 116 9.832 -10.460 -6.323 1.00 0.00 C ATOM 1791 C GLU A 116 9.329 -10.321 -4.889 1.00 0.00 C ATOM 1792 O GLU A 116 9.282 -9.218 -4.341 1.00 0.00 O ATOM 1793 CB GLU A 116 8.809 -9.865 -7.293 1.00 0.00 C ATOM 1794 CG GLU A 116 9.119 -10.149 -8.753 1.00 0.00 C ATOM 1795 CD GLU A 116 8.300 -9.294 -9.701 1.00 0.00 C ATOM 1796 OE1 GLU A 116 7.123 -9.634 -9.942 1.00 0.00 O ATOM 1797 OE2 GLU A 116 8.837 -8.283 -10.200 1.00 0.00 O ATOM 0 H GLU A 116 9.406 -12.275 -7.284 1.00 0.00 H new ATOM 0 HA GLU A 116 10.771 -9.914 -6.416 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.822 -10.262 -7.056 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.763 -8.786 -7.143 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.179 -9.974 -8.936 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.929 -11.202 -8.963 1.00 0.00 H new ATOM 1804 N CYS A 117 8.955 -11.444 -4.288 1.00 0.00 N ATOM 1805 CA CYS A 117 8.454 -11.448 -2.918 1.00 0.00 C ATOM 1806 C CYS A 117 9.602 -11.565 -1.920 1.00 0.00 C ATOM 1807 O CYS A 117 9.428 -11.316 -0.726 1.00 0.00 O ATOM 1808 CB CYS A 117 7.468 -12.600 -2.716 1.00 0.00 C ATOM 1809 SG CYS A 117 5.873 -12.357 -3.531 1.00 0.00 S ATOM 0 H CYS A 117 8.989 -12.364 -4.727 1.00 0.00 H new ATOM 0 HA CYS A 117 7.939 -10.504 -2.743 1.00 0.00 H new ATOM 0 HB2 CYS A 117 7.919 -13.520 -3.090 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.301 -12.738 -1.648 1.00 0.00 H new ATOM 0 HG CYS A 117 6.032 -11.607 -4.581 1.00 0.00 H new ATOM 1815 N CYS A 118 10.774 -11.946 -2.416 1.00 0.00 N ATOM 1816 CA CYS A 118 11.950 -12.098 -1.567 1.00 0.00 C ATOM 1817 C CYS A 118 12.942 -10.964 -1.805 1.00 0.00 C ATOM 1818 O CYS A 118 13.910 -10.808 -1.061 1.00 0.00 O ATOM 1819 CB CYS A 118 12.624 -13.445 -1.831 1.00 0.00 C ATOM 1820 SG CYS A 118 14.299 -13.577 -1.162 1.00 0.00 S ATOM 0 H CYS A 118 10.935 -12.155 -3.401 1.00 0.00 H new ATOM 0 HA CYS A 118 11.625 -12.060 -0.527 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.010 -14.237 -1.402 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.660 -13.617 -2.907 1.00 0.00 H new ATOM 0 HG CYS A 118 14.737 -12.393 -0.851 1.00 0.00 H new ATOM 1826 N GLN A 119 12.695 -10.177 -2.847 1.00 0.00 N ATOM 1827 CA GLN A 119 13.569 -9.059 -3.184 1.00 0.00 C ATOM 1828 C GLN A 119 13.048 -7.760 -2.578 1.00 0.00 C ATOM 1829 O GLN A 119 12.076 -7.183 -3.064 1.00 0.00 O ATOM 1830 CB GLN A 119 13.687 -8.916 -4.702 1.00 0.00 C ATOM 1831 CG GLN A 119 14.772 -9.788 -5.313 1.00 0.00 C ATOM 1832 CD GLN A 119 14.983 -11.079 -4.547 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.641 -11.097 -3.506 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.426 -12.170 -5.059 1.00 0.00 N ATOM 0 H GLN A 119 11.897 -10.293 -3.472 1.00 0.00 H new ATOM 0 HA GLN A 119 14.556 -9.263 -2.768 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.730 -9.169 -5.158 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.891 -7.873 -4.946 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.508 -10.021 -6.344 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.708 -9.230 -5.342 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.889 -12.110 -5.924 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.535 -13.068 -4.587 1.00 0.00 H new ATOM 1843 N SER A 120 13.701 -7.306 -1.513 1.00 0.00 N ATOM 1844 CA SER A 120 13.302 -6.077 -0.838 1.00 0.00 C ATOM 1845 C SER A 120 13.321 -4.896 -1.803 1.00 0.00 C ATOM 1846 O SER A 120 12.416 -4.062 -1.799 1.00 0.00 O ATOM 1847 CB SER A 120 14.228 -5.797 0.348 1.00 0.00 C ATOM 1848 OG SER A 120 15.515 -6.349 0.131 1.00 0.00 O ATOM 0 H SER A 120 14.509 -7.771 -1.099 1.00 0.00 H new ATOM 0 HA SER A 120 12.284 -6.207 -0.471 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.311 -4.721 0.502 1.00 0.00 H new ATOM 0 HB3 SER A 120 13.797 -6.217 1.257 1.00 0.00 H new ATOM 0 HG SER A 120 16.088 -6.155 0.902 1.00 0.00 H new ATOM 1854 N SER A 121 14.361 -4.832 -2.629 1.00 0.00 N ATOM 1855 CA SER A 121 14.502 -3.752 -3.598 1.00 0.00 C ATOM 1856 C SER A 121 13.201 -3.538 -4.366 1.00 0.00 C ATOM 1857 O SER A 121 12.841 -2.407 -4.699 1.00 0.00 O ATOM 1858 CB SER A 121 15.639 -4.059 -4.574 1.00 0.00 C ATOM 1859 OG SER A 121 16.869 -3.533 -4.106 1.00 0.00 O ATOM 0 H SER A 121 15.118 -5.515 -2.646 1.00 0.00 H new ATOM 0 HA SER A 121 14.737 -2.837 -3.054 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.728 -5.137 -4.706 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.407 -3.636 -5.552 1.00 0.00 H new ATOM 0 HG SER A 121 17.580 -3.744 -4.747 1.00 0.00 H new ATOM 1865 N LEU A 122 12.500 -4.631 -4.646 1.00 0.00 N ATOM 1866 CA LEU A 122 11.238 -4.565 -5.375 1.00 0.00 C ATOM 1867 C LEU A 122 10.077 -4.278 -4.429 1.00 0.00 C ATOM 1868 O LEU A 122 9.150 -3.543 -4.772 1.00 0.00 O ATOM 1869 CB LEU A 122 10.990 -5.876 -6.123 1.00 0.00 C ATOM 1870 CG LEU A 122 11.954 -6.188 -7.268 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.998 -7.685 -7.535 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.552 -5.432 -8.526 1.00 0.00 C ATOM 0 H LEU A 122 12.784 -5.574 -4.379 1.00 0.00 H new ATOM 0 HA LEU A 122 11.305 -3.750 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 122 11.034 -6.695 -5.405 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.976 -5.857 -6.523 1.00 0.00 H new ATOM 0 HG LEU A 122 12.952 -5.862 -6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.689 -7.889 -8.353 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.334 -8.205 -6.638 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.002 -8.036 -7.806 1.00 0.00 H new ATOM 0 HD21 LEU A 122 12.250 -5.667 -9.330 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.545 -5.727 -8.822 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.573 -4.360 -8.329 1.00 0.00 H new ATOM 1884 N VAL A 123 10.134 -4.860 -3.236 1.00 0.00 N ATOM 1885 CA VAL A 123 9.089 -4.665 -2.238 1.00 0.00 C ATOM 1886 C VAL A 123 8.927 -3.188 -1.894 1.00 0.00 C ATOM 1887 O VAL A 123 7.816 -2.659 -1.897 1.00 0.00 O ATOM 1888 CB VAL A 123 9.390 -5.451 -0.948 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.363 -5.128 0.126 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.426 -6.945 -1.232 1.00 0.00 C ATOM 0 H VAL A 123 10.894 -5.471 -2.936 1.00 0.00 H new ATOM 0 HA VAL A 123 8.162 -5.038 -2.673 1.00 0.00 H new ATOM 0 HB VAL A 123 10.371 -5.151 -0.580 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.592 -5.693 1.030 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.391 -4.061 0.348 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.368 -5.398 -0.229 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.640 -7.486 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.460 -7.264 -1.624 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.204 -7.157 -1.966 1.00 0.00 H new ATOM 1900 N GLU A 124 10.043 -2.529 -1.599 1.00 0.00 N ATOM 1901 CA GLU A 124 10.023 -1.113 -1.253 1.00 0.00 C ATOM 1902 C GLU A 124 9.717 -0.257 -2.478 1.00 0.00 C ATOM 1903 O GLU A 124 9.433 0.935 -2.361 1.00 0.00 O ATOM 1904 CB GLU A 124 11.365 -0.695 -0.648 1.00 0.00 C ATOM 1905 CG GLU A 124 12.534 -0.823 -1.611 1.00 0.00 C ATOM 1906 CD GLU A 124 13.778 -0.110 -1.117 1.00 0.00 C ATOM 1907 OE1 GLU A 124 14.552 -0.729 -0.356 1.00 0.00 O ATOM 1908 OE2 GLU A 124 13.977 1.064 -1.490 1.00 0.00 O ATOM 0 H GLU A 124 10.971 -2.952 -1.593 1.00 0.00 H new ATOM 0 HA GLU A 124 9.235 -0.957 -0.516 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.295 0.339 -0.310 1.00 0.00 H new ATOM 0 HB3 GLU A 124 11.563 -1.306 0.233 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.761 -1.878 -1.763 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.247 -0.416 -2.581 1.00 0.00 H new ATOM 1915 N MET A 125 9.778 -0.874 -3.654 1.00 0.00 N ATOM 1916 CA MET A 125 9.507 -0.169 -4.901 1.00 0.00 C ATOM 1917 C MET A 125 8.007 -0.104 -5.173 1.00 0.00 C ATOM 1918 O MET A 125 7.459 0.970 -5.426 1.00 0.00 O ATOM 1919 CB MET A 125 10.218 -0.859 -6.067 1.00 0.00 C ATOM 1920 CG MET A 125 10.305 -0.002 -7.319 1.00 0.00 C ATOM 1921 SD MET A 125 10.451 -0.983 -8.824 1.00 0.00 S ATOM 1922 CE MET A 125 8.917 -1.906 -8.776 1.00 0.00 C ATOM 0 H MET A 125 10.013 -1.860 -3.769 1.00 0.00 H new ATOM 0 HA MET A 125 9.886 0.848 -4.804 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.225 -1.135 -5.755 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.693 -1.784 -6.306 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.418 0.628 -7.385 1.00 0.00 H new ATOM 0 HG3 MET A 125 11.164 0.664 -7.240 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.574 -2.095 -9.793 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.079 -2.855 -8.266 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.163 -1.330 -8.240 1.00 0.00 H new ATOM 1932 N ILE A 126 7.350 -1.257 -5.121 1.00 0.00 N ATOM 1933 CA ILE A 126 5.914 -1.329 -5.361 1.00 0.00 C ATOM 1934 C ILE A 126 5.146 -0.471 -4.361 1.00 0.00 C ATOM 1935 O ILE A 126 4.049 0.008 -4.651 1.00 0.00 O ATOM 1936 CB ILE A 126 5.401 -2.779 -5.277 1.00 0.00 C ATOM 1937 CG1 ILE A 126 3.981 -2.874 -5.840 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.440 -3.272 -3.839 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.554 -4.288 -6.167 1.00 0.00 C ATOM 0 H ILE A 126 7.789 -2.154 -4.915 1.00 0.00 H new ATOM 0 HA ILE A 126 5.743 -0.950 -6.368 1.00 0.00 H new ATOM 0 HB ILE A 126 6.053 -3.415 -5.876 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.283 -2.450 -5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.915 -2.265 -6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.074 -4.298 -3.796 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.465 -3.236 -3.470 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.809 -2.636 -3.219 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.538 -4.279 -6.561 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.229 -4.709 -6.913 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.587 -4.896 -5.263 1.00 0.00 H new ATOM 1951 N PHE A 127 5.729 -0.280 -3.183 1.00 0.00 N ATOM 1952 CA PHE A 127 5.100 0.521 -2.139 1.00 0.00 C ATOM 1953 C PHE A 127 5.398 2.004 -2.339 1.00 0.00 C ATOM 1954 O PHE A 127 4.516 2.851 -2.192 1.00 0.00 O ATOM 1955 CB PHE A 127 5.587 0.073 -0.760 1.00 0.00 C ATOM 1956 CG PHE A 127 5.142 -1.313 -0.388 1.00 0.00 C ATOM 1957 CD1 PHE A 127 3.835 -1.718 -0.608 1.00 0.00 C ATOM 1958 CD2 PHE A 127 6.031 -2.211 0.180 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.424 -2.992 -0.266 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.625 -3.487 0.524 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.320 -3.878 0.299 1.00 0.00 C ATOM 0 H PHE A 127 6.636 -0.669 -2.927 1.00 0.00 H new ATOM 0 HA PHE A 127 4.022 0.373 -2.201 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.676 0.115 -0.737 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.225 0.776 -0.010 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.130 -1.030 -1.052 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.053 -1.911 0.356 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.402 -3.295 -0.441 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.327 -4.177 0.968 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.001 -4.875 0.564 1.00 0.00 H new ATOM 1971 N SER A 128 6.647 2.311 -2.673 1.00 0.00 N ATOM 1972 CA SER A 128 7.063 3.692 -2.889 1.00 0.00 C ATOM 1973 C SER A 128 6.373 4.283 -4.115 1.00 0.00 C ATOM 1974 O SER A 128 5.803 5.371 -4.054 1.00 0.00 O ATOM 1975 CB SER A 128 8.582 3.769 -3.058 1.00 0.00 C ATOM 1976 OG SER A 128 9.052 5.090 -2.853 1.00 0.00 O ATOM 0 H SER A 128 7.389 1.622 -2.800 1.00 0.00 H new ATOM 0 HA SER A 128 6.772 4.274 -2.014 1.00 0.00 H new ATOM 0 HB2 SER A 128 9.064 3.094 -2.351 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.857 3.433 -4.058 1.00 0.00 H new ATOM 0 HG SER A 128 10.025 5.112 -2.965 1.00 0.00 H new ATOM 1982 N GLU A 129 6.430 3.555 -5.226 1.00 0.00 N ATOM 1983 CA GLU A 129 5.811 4.007 -6.467 1.00 0.00 C ATOM 1984 C GLU A 129 4.381 3.489 -6.581 1.00 0.00 C ATOM 1985 O GLU A 129 4.125 2.297 -6.406 1.00 0.00 O ATOM 1986 CB GLU A 129 6.632 3.542 -7.671 1.00 0.00 C ATOM 1987 CG GLU A 129 6.176 4.146 -8.989 1.00 0.00 C ATOM 1988 CD GLU A 129 7.299 4.247 -10.003 1.00 0.00 C ATOM 1989 OE1 GLU A 129 8.466 4.391 -9.584 1.00 0.00 O ATOM 1990 OE2 GLU A 129 7.010 4.181 -11.216 1.00 0.00 O ATOM 0 H GLU A 129 6.898 2.651 -5.292 1.00 0.00 H new ATOM 0 HA GLU A 129 5.784 5.097 -6.454 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.679 3.798 -7.507 1.00 0.00 H new ATOM 0 HB3 GLU A 129 6.576 2.456 -7.740 1.00 0.00 H new ATOM 0 HG2 GLU A 129 5.371 3.539 -9.403 1.00 0.00 H new ATOM 0 HG3 GLU A 129 5.765 5.139 -8.807 1.00 0.00 H new ATOM 1997 N ASP A 130 3.452 4.392 -6.876 1.00 0.00 N ATOM 1998 CA ASP A 130 2.047 4.028 -7.015 1.00 0.00 C ATOM 1999 C ASP A 130 1.608 4.103 -8.474 1.00 0.00 C ATOM 2000 O ASP A 130 1.795 5.125 -9.136 1.00 0.00 O ATOM 2001 CB ASP A 130 1.173 4.944 -6.158 1.00 0.00 C ATOM 2002 CG ASP A 130 1.416 6.412 -6.447 1.00 0.00 C ATOM 2003 OD1 ASP A 130 2.554 6.879 -6.233 1.00 0.00 O ATOM 2004 OD2 ASP A 130 0.467 7.095 -6.888 1.00 0.00 O ATOM 0 H ASP A 130 3.647 5.382 -7.024 1.00 0.00 H new ATOM 0 HA ASP A 130 1.928 3.001 -6.671 1.00 0.00 H new ATOM 0 HB2 ASP A 130 0.123 4.711 -6.336 1.00 0.00 H new ATOM 0 HB3 ASP A 130 1.369 4.747 -5.104 1.00 0.00 H new TER 2009 ASP A 130