USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=35 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 -23:sc= 0.809 USER MOD Set 1.3: A 119 GLN : amide:sc= -2.84! C(o=-2!,f=-2.9!) USER MOD Set 2.1: A 42 LYS NZ :NH3+ -178:sc= -0.111 (180deg=-0.0418) USER MOD Set 2.2: A 77 GLN : amide:sc= -2.19 K(o=-2.3,f=-5.9!) USER MOD Set 3.1: A 39 SER OG : rot -137:sc= 0.0938 USER MOD Set 3.2: A 48 SER OG : rot -145:sc= -1.02! USER MOD Set 3.3: A 53 CYS SG : rot 180:sc= 1.36 USER MOD Set 3.4: A 75 TYR OH : rot 93:sc= 0.335 USER MOD Single : A 1 GLY N :NH3+ 146:sc= 0.00463 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 24:sc= 0.299 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 41:sc= 0.108 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 HD1:sc= -4.69! K(o=-4.7!,f=-2.9) USER MOD Single : A 31 SER OG : rot 13:sc= 0.92 USER MOD Single : A 32 LYS NZ :NH3+ 167:sc=-0.00652 (180deg=-0.129) USER MOD Single : A 33 THR OG1 : rot -163:sc= 0.703 USER MOD Single : A 37 TYR OH : rot 165:sc= -0.177 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -22:sc= 0.308 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 CYS SG : rot 180:sc= -1.39 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 68 THR OG1 : rot -107:sc= 0.0799 USER MOD Single : A 71 CYS SG : rot 162:sc= 0.793 USER MOD Single : A 76 CYS SG : rot 179:sc= -0.472 USER MOD Single : A 81 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.231) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -1.19 K(o=-1.2,f=-0.13) USER MOD Single : A 89 ASN : amide:sc= -0.48 K(o=-0.48,f=-3.1!) USER MOD Single : A 93 GLN : amide:sc= -0.0189 X(o=-0.019,f=-0.34) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 156:sc= -0.0534 (180deg=-0.399) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 1:sc= -1.54! USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot -1:sc= -0.811 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0.0054) USER MOD Single : A 111 LYS NZ :NH3+ 155:sc= -0.106 (180deg=-0.5) USER MOD Single : A 117 CYS SG : rot 148:sc= -1.7 USER MOD Single : A 120 SER OG : rot 180:sc= 0.0189 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -156:sc= -0.098 (180deg=-0.51) USER MOD Single : A 128 SER OG : rot 83:sc= 0.671 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.031 26.380 23.519 1.00 0.00 N ATOM 2 CA GLY A 1 5.290 25.750 23.168 1.00 0.00 C ATOM 3 C GLY A 1 5.112 24.597 22.200 1.00 0.00 C ATOM 4 O GLY A 1 4.169 23.815 22.323 1.00 0.00 O ATOM 0 H1 GLY A 1 4.070 26.708 24.505 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.862 27.191 22.891 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.258 25.693 23.413 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.953 26.493 22.725 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.776 25.388 24.074 1.00 0.00 H new ATOM 8 N SER A 2 6.018 24.493 21.233 1.00 0.00 N ATOM 9 CA SER A 2 5.953 23.431 20.236 1.00 0.00 C ATOM 10 C SER A 2 5.612 22.094 20.888 1.00 0.00 C ATOM 11 O SER A 2 6.172 21.737 21.924 1.00 0.00 O ATOM 12 CB SER A 2 7.283 23.323 19.488 1.00 0.00 C ATOM 13 OG SER A 2 7.114 22.677 18.238 1.00 0.00 O ATOM 0 H SER A 2 6.806 25.131 21.119 1.00 0.00 H new ATOM 0 HA SER A 2 5.165 23.680 19.526 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.699 24.319 19.333 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.000 22.769 20.093 1.00 0.00 H new ATOM 0 HG SER A 2 7.978 22.622 17.779 1.00 0.00 H new ATOM 19 N GLU A 3 4.691 21.360 20.272 1.00 0.00 N ATOM 20 CA GLU A 3 4.275 20.063 20.793 1.00 0.00 C ATOM 21 C GLU A 3 4.906 18.928 19.992 1.00 0.00 C ATOM 22 O GLU A 3 5.439 17.975 20.559 1.00 0.00 O ATOM 23 CB GLU A 3 2.750 19.940 20.759 1.00 0.00 C ATOM 24 CG GLU A 3 2.173 19.905 19.353 1.00 0.00 C ATOM 25 CD GLU A 3 0.701 20.266 19.317 1.00 0.00 C ATOM 26 OE1 GLU A 3 -0.132 19.398 19.651 1.00 0.00 O ATOM 27 OE2 GLU A 3 0.382 21.418 18.956 1.00 0.00 O ATOM 0 H GLU A 3 4.219 21.641 19.412 1.00 0.00 H new ATOM 0 HA GLU A 3 4.615 19.989 21.826 1.00 0.00 H new ATOM 0 HB2 GLU A 3 2.455 19.033 21.286 1.00 0.00 H new ATOM 0 HB3 GLU A 3 2.314 20.779 21.301 1.00 0.00 H new ATOM 0 HG2 GLU A 3 2.728 20.596 18.719 1.00 0.00 H new ATOM 0 HG3 GLU A 3 2.309 18.908 18.933 1.00 0.00 H new ATOM 34 N GLY A 4 4.839 19.037 18.668 1.00 0.00 N ATOM 35 CA GLY A 4 5.407 18.013 17.810 1.00 0.00 C ATOM 36 C GLY A 4 4.524 17.701 16.619 1.00 0.00 C ATOM 37 O GLY A 4 3.342 18.045 16.606 1.00 0.00 O ATOM 0 H GLY A 4 4.402 19.816 18.175 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.385 18.340 17.458 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.565 17.104 18.390 1.00 0.00 H new ATOM 41 N ALA A 5 5.098 17.047 15.614 1.00 0.00 N ATOM 42 CA ALA A 5 4.355 16.688 14.413 1.00 0.00 C ATOM 43 C ALA A 5 5.110 15.650 13.589 1.00 0.00 C ATOM 44 O ALA A 5 6.305 15.797 13.334 1.00 0.00 O ATOM 45 CB ALA A 5 4.075 17.927 13.575 1.00 0.00 C ATOM 0 H ALA A 5 6.075 16.755 15.608 1.00 0.00 H new ATOM 0 HA ALA A 5 3.406 16.249 14.721 1.00 0.00 H new ATOM 0 HB1 ALA A 5 3.519 17.644 12.681 1.00 0.00 H new ATOM 0 HB2 ALA A 5 3.487 18.636 14.158 1.00 0.00 H new ATOM 0 HB3 ALA A 5 5.018 18.390 13.285 1.00 0.00 H new ATOM 51 N ALA A 6 4.405 14.601 13.178 1.00 0.00 N ATOM 52 CA ALA A 6 5.010 13.540 12.382 1.00 0.00 C ATOM 53 C ALA A 6 3.959 12.810 11.552 1.00 0.00 C ATOM 54 O ALA A 6 3.056 12.173 12.096 1.00 0.00 O ATOM 55 CB ALA A 6 5.748 12.561 13.283 1.00 0.00 C ATOM 0 H ALA A 6 3.415 14.463 13.383 1.00 0.00 H new ATOM 0 HA ALA A 6 5.725 13.995 11.696 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.195 11.774 12.676 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.531 13.088 13.828 1.00 0.00 H new ATOM 0 HB3 ALA A 6 5.047 12.119 13.991 1.00 0.00 H new ATOM 61 N THR A 7 4.083 12.905 10.232 1.00 0.00 N ATOM 62 CA THR A 7 3.143 12.256 9.327 1.00 0.00 C ATOM 63 C THR A 7 3.810 11.112 8.571 1.00 0.00 C ATOM 64 O THR A 7 4.825 11.306 7.903 1.00 0.00 O ATOM 65 CB THR A 7 2.558 13.256 8.312 1.00 0.00 C ATOM 66 OG1 THR A 7 3.611 13.842 7.540 1.00 0.00 O ATOM 67 CG2 THR A 7 1.772 14.349 9.021 1.00 0.00 C ATOM 0 H THR A 7 4.826 13.426 9.766 1.00 0.00 H new ATOM 0 HA THR A 7 2.334 11.860 9.941 1.00 0.00 H new ATOM 0 HB THR A 7 1.881 12.715 7.650 1.00 0.00 H new ATOM 0 HG1 THR A 7 4.390 13.247 7.544 1.00 0.00 H new ATOM 0 HG21 THR A 7 1.368 15.043 8.284 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.953 13.901 9.584 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.431 14.886 9.703 1.00 0.00 H new ATOM 75 N MET A 8 3.231 9.921 8.678 1.00 0.00 N ATOM 76 CA MET A 8 3.769 8.747 8.001 1.00 0.00 C ATOM 77 C MET A 8 2.646 7.822 7.543 1.00 0.00 C ATOM 78 O MET A 8 1.533 7.874 8.066 1.00 0.00 O ATOM 79 CB MET A 8 4.722 7.990 8.928 1.00 0.00 C ATOM 80 CG MET A 8 4.033 7.363 10.129 1.00 0.00 C ATOM 81 SD MET A 8 3.738 8.548 11.456 1.00 0.00 S ATOM 82 CE MET A 8 4.895 7.966 12.693 1.00 0.00 C ATOM 0 H MET A 8 2.390 9.743 9.227 1.00 0.00 H new ATOM 0 HA MET A 8 4.319 9.085 7.123 1.00 0.00 H new ATOM 0 HB2 MET A 8 5.224 7.208 8.359 1.00 0.00 H new ATOM 0 HB3 MET A 8 5.494 8.675 9.279 1.00 0.00 H new ATOM 0 HG2 MET A 8 3.083 6.932 9.814 1.00 0.00 H new ATOM 0 HG3 MET A 8 4.645 6.544 10.508 1.00 0.00 H new ATOM 0 HE1 MET A 8 4.831 8.600 13.578 1.00 0.00 H new ATOM 0 HE2 MET A 8 4.652 6.939 12.964 1.00 0.00 H new ATOM 0 HE3 MET A 8 5.907 8.005 12.291 1.00 0.00 H new ATOM 92 N ALA A 9 2.945 6.976 6.562 1.00 0.00 N ATOM 93 CA ALA A 9 1.961 6.039 6.034 1.00 0.00 C ATOM 94 C ALA A 9 1.503 5.061 7.110 1.00 0.00 C ATOM 95 O ALA A 9 2.235 4.776 8.059 1.00 0.00 O ATOM 96 CB ALA A 9 2.536 5.285 4.844 1.00 0.00 C ATOM 0 H ALA A 9 3.861 6.921 6.117 1.00 0.00 H new ATOM 0 HA ALA A 9 1.093 6.609 5.704 1.00 0.00 H new ATOM 0 HB1 ALA A 9 1.791 4.589 4.460 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.808 5.993 4.062 1.00 0.00 H new ATOM 0 HB3 ALA A 9 3.422 4.732 5.157 1.00 0.00 H new ATOM 102 N THR A 10 0.286 4.548 6.958 1.00 0.00 N ATOM 103 CA THR A 10 -0.272 3.604 7.918 1.00 0.00 C ATOM 104 C THR A 10 -0.489 2.236 7.280 1.00 0.00 C ATOM 105 O THR A 10 -1.199 2.111 6.283 1.00 0.00 O ATOM 106 CB THR A 10 -1.609 4.108 8.491 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.467 4.537 7.428 1.00 0.00 O ATOM 108 CG2 THR A 10 -1.383 5.258 9.462 1.00 0.00 C ATOM 0 H THR A 10 -0.333 4.771 6.178 1.00 0.00 H new ATOM 0 HA THR A 10 0.451 3.514 8.729 1.00 0.00 H new ATOM 0 HB THR A 10 -2.081 3.286 9.029 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.403 3.906 6.681 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.342 5.597 9.854 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.754 4.921 10.285 1.00 0.00 H new ATOM 0 HG23 THR A 10 -0.891 6.081 8.943 1.00 0.00 H new ATOM 116 N PHE A 11 0.127 1.212 7.863 1.00 0.00 N ATOM 117 CA PHE A 11 0.001 -0.147 7.351 1.00 0.00 C ATOM 118 C PHE A 11 -0.614 -1.069 8.400 1.00 0.00 C ATOM 119 O PHE A 11 -0.236 -1.032 9.571 1.00 0.00 O ATOM 120 CB PHE A 11 1.369 -0.683 6.924 1.00 0.00 C ATOM 121 CG PHE A 11 2.159 -1.278 8.054 1.00 0.00 C ATOM 122 CD1 PHE A 11 1.882 -2.556 8.513 1.00 0.00 C ATOM 123 CD2 PHE A 11 3.178 -0.560 8.659 1.00 0.00 C ATOM 124 CE1 PHE A 11 2.607 -3.107 9.553 1.00 0.00 C ATOM 125 CE2 PHE A 11 3.907 -1.106 9.698 1.00 0.00 C ATOM 126 CZ PHE A 11 3.620 -2.380 10.147 1.00 0.00 C ATOM 0 H PHE A 11 0.718 1.298 8.690 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.659 -0.122 6.484 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.229 -1.439 6.151 1.00 0.00 H new ATOM 0 HB3 PHE A 11 1.944 0.127 6.476 1.00 0.00 H new ATOM 0 HD1 PHE A 11 1.090 -3.128 8.053 1.00 0.00 H new ATOM 0 HD2 PHE A 11 3.405 0.438 8.314 1.00 0.00 H new ATOM 0 HE1 PHE A 11 2.382 -4.104 9.901 1.00 0.00 H new ATOM 0 HE2 PHE A 11 4.701 -0.537 10.159 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.187 -2.807 10.961 1.00 0.00 H new ATOM 136 N GLU A 12 -1.565 -1.893 7.971 1.00 0.00 N ATOM 137 CA GLU A 12 -2.233 -2.823 8.874 1.00 0.00 C ATOM 138 C GLU A 12 -2.188 -4.245 8.322 1.00 0.00 C ATOM 139 O GLU A 12 -2.525 -4.482 7.163 1.00 0.00 O ATOM 140 CB GLU A 12 -3.685 -2.397 9.097 1.00 0.00 C ATOM 141 CG GLU A 12 -4.472 -3.354 9.977 1.00 0.00 C ATOM 142 CD GLU A 12 -4.011 -3.333 11.421 1.00 0.00 C ATOM 143 OE1 GLU A 12 -3.888 -2.226 11.988 1.00 0.00 O ATOM 144 OE2 GLU A 12 -3.773 -4.421 11.984 1.00 0.00 O ATOM 0 H GLU A 12 -1.890 -1.935 7.005 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.706 -2.805 9.828 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.698 -1.406 9.550 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.183 -2.313 8.131 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.530 -3.095 9.934 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.375 -4.366 9.584 1.00 0.00 H new ATOM 151 N GLU A 13 -1.768 -5.186 9.161 1.00 0.00 N ATOM 152 CA GLU A 13 -1.678 -6.584 8.757 1.00 0.00 C ATOM 153 C GLU A 13 -2.970 -7.329 9.078 1.00 0.00 C ATOM 154 O GLU A 13 -3.457 -7.292 10.208 1.00 0.00 O ATOM 155 CB GLU A 13 -0.498 -7.265 9.454 1.00 0.00 C ATOM 156 CG GLU A 13 0.114 -8.398 8.648 1.00 0.00 C ATOM 157 CD GLU A 13 -0.794 -9.610 8.564 1.00 0.00 C ATOM 158 OE1 GLU A 13 -0.794 -10.420 9.514 1.00 0.00 O ATOM 159 OE2 GLU A 13 -1.505 -9.748 7.546 1.00 0.00 O ATOM 0 H GLU A 13 -1.485 -5.006 10.124 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.521 -6.613 7.679 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.271 -6.520 9.659 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.831 -7.654 10.417 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.336 -8.044 7.641 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.062 -8.689 9.100 1.00 0.00 H new ATOM 166 N VAL A 14 -3.523 -8.003 8.075 1.00 0.00 N ATOM 167 CA VAL A 14 -4.759 -8.757 8.249 1.00 0.00 C ATOM 168 C VAL A 14 -4.599 -10.194 7.767 1.00 0.00 C ATOM 169 O VAL A 14 -4.408 -10.443 6.577 1.00 0.00 O ATOM 170 CB VAL A 14 -5.928 -8.100 7.491 1.00 0.00 C ATOM 171 CG1 VAL A 14 -7.196 -8.926 7.647 1.00 0.00 C ATOM 172 CG2 VAL A 14 -6.146 -6.676 7.979 1.00 0.00 C ATOM 0 H VAL A 14 -3.134 -8.042 7.133 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.982 -8.758 9.316 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.676 -8.062 6.431 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -8.011 -8.447 7.105 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -7.031 -9.926 7.245 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.456 -8.998 8.703 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.976 -6.227 7.433 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.377 -6.688 9.044 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.242 -6.091 7.810 1.00 0.00 H new ATOM 182 N SER A 15 -4.678 -11.138 8.700 1.00 0.00 N ATOM 183 CA SER A 15 -4.539 -12.551 8.372 1.00 0.00 C ATOM 184 C SER A 15 -5.881 -13.149 7.962 1.00 0.00 C ATOM 185 O SER A 15 -6.912 -12.868 8.573 1.00 0.00 O ATOM 186 CB SER A 15 -3.969 -13.320 9.565 1.00 0.00 C ATOM 187 OG SER A 15 -4.135 -14.718 9.398 1.00 0.00 O ATOM 0 H SER A 15 -4.838 -10.949 9.689 1.00 0.00 H new ATOM 0 HA SER A 15 -3.851 -12.636 7.531 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.910 -13.088 9.679 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.466 -12.998 10.480 1.00 0.00 H new ATOM 0 HG SER A 15 -3.761 -15.187 10.173 1.00 0.00 H new ATOM 193 N VAL A 16 -5.861 -13.976 6.921 1.00 0.00 N ATOM 194 CA VAL A 16 -7.075 -14.615 6.428 1.00 0.00 C ATOM 195 C VAL A 16 -6.753 -15.897 5.669 1.00 0.00 C ATOM 196 O VAL A 16 -5.623 -16.098 5.221 1.00 0.00 O ATOM 197 CB VAL A 16 -7.871 -13.672 5.506 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.551 -12.579 6.317 1.00 0.00 C ATOM 199 CG2 VAL A 16 -6.961 -13.071 4.445 1.00 0.00 C ATOM 0 H VAL A 16 -5.017 -14.219 6.403 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.682 -14.856 7.301 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.644 -14.252 5.003 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.108 -11.923 5.648 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.235 -13.031 7.035 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.797 -11.999 6.850 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.540 -12.408 3.803 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.164 -12.505 4.927 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.526 -13.870 3.844 1.00 0.00 H new ATOM 209 N LEU A 17 -7.751 -16.762 5.529 1.00 0.00 N ATOM 210 CA LEU A 17 -7.575 -18.026 4.823 1.00 0.00 C ATOM 211 C LEU A 17 -8.725 -18.273 3.852 1.00 0.00 C ATOM 212 O LEU A 17 -9.892 -18.273 4.244 1.00 0.00 O ATOM 213 CB LEU A 17 -7.477 -19.181 5.821 1.00 0.00 C ATOM 214 CG LEU A 17 -6.627 -20.375 5.385 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.335 -21.283 6.570 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.324 -21.149 4.276 1.00 0.00 C ATOM 0 H LEU A 17 -8.691 -16.611 5.895 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.649 -17.968 4.252 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -7.071 -18.794 6.756 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.485 -19.537 6.034 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.679 -20.000 4.998 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.729 -22.127 6.241 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.794 -20.723 7.333 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.273 -21.650 6.987 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.705 -21.995 3.978 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.287 -21.513 4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.481 -20.495 3.419 1.00 0.00 H new ATOM 228 N GLY A 18 -8.388 -18.487 2.584 1.00 0.00 N ATOM 229 CA GLY A 18 -9.404 -18.735 1.578 1.00 0.00 C ATOM 230 C GLY A 18 -9.786 -17.480 0.818 1.00 0.00 C ATOM 231 O GLY A 18 -9.263 -16.398 1.088 1.00 0.00 O ATOM 0 H GLY A 18 -7.429 -18.493 2.235 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.040 -19.485 0.876 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.291 -19.150 2.056 1.00 0.00 H new ATOM 235 N PHE A 19 -10.699 -17.623 -0.137 1.00 0.00 N ATOM 236 CA PHE A 19 -11.148 -16.493 -0.941 1.00 0.00 C ATOM 237 C PHE A 19 -12.258 -15.725 -0.227 1.00 0.00 C ATOM 238 O PHE A 19 -12.348 -14.503 -0.334 1.00 0.00 O ATOM 239 CB PHE A 19 -11.643 -16.975 -2.306 1.00 0.00 C ATOM 240 CG PHE A 19 -11.810 -15.868 -3.308 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.923 -15.043 -3.269 1.00 0.00 C ATOM 242 CD2 PHE A 19 -10.855 -15.653 -4.288 1.00 0.00 C ATOM 243 CE1 PHE A 19 -13.080 -14.025 -4.190 1.00 0.00 C ATOM 244 CE2 PHE A 19 -11.006 -14.636 -5.212 1.00 0.00 C ATOM 245 CZ PHE A 19 -12.120 -13.820 -5.162 1.00 0.00 C ATOM 0 H PHE A 19 -11.142 -18.511 -0.373 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.301 -15.823 -1.086 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.940 -17.708 -2.700 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.597 -17.486 -2.178 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.676 -15.198 -2.510 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -9.982 -16.287 -4.331 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -13.953 -13.390 -4.150 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.255 -14.479 -5.972 1.00 0.00 H new ATOM 0 HZ PHE A 19 -12.240 -13.023 -5.881 1.00 0.00 H new ATOM 255 N GLU A 20 -13.100 -16.453 0.499 1.00 0.00 N ATOM 256 CA GLU A 20 -14.204 -15.841 1.229 1.00 0.00 C ATOM 257 C GLU A 20 -13.697 -14.752 2.169 1.00 0.00 C ATOM 258 O GLU A 20 -14.009 -13.574 1.996 1.00 0.00 O ATOM 259 CB GLU A 20 -14.969 -16.901 2.024 1.00 0.00 C ATOM 260 CG GLU A 20 -15.791 -17.839 1.155 1.00 0.00 C ATOM 261 CD GLU A 20 -14.986 -19.019 0.647 1.00 0.00 C ATOM 262 OE1 GLU A 20 -14.346 -19.701 1.474 1.00 0.00 O ATOM 263 OE2 GLU A 20 -14.997 -19.261 -0.578 1.00 0.00 O ATOM 0 H GLU A 20 -13.039 -17.466 0.597 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.878 -15.386 0.503 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.259 -17.488 2.607 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.630 -16.404 2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -16.643 -18.205 1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.191 -17.285 0.306 1.00 0.00 H new ATOM 270 N GLU A 21 -12.915 -15.155 3.166 1.00 0.00 N ATOM 271 CA GLU A 21 -12.367 -14.214 4.135 1.00 0.00 C ATOM 272 C GLU A 21 -11.631 -13.076 3.432 1.00 0.00 C ATOM 273 O GLU A 21 -11.883 -11.901 3.698 1.00 0.00 O ATOM 274 CB GLU A 21 -11.417 -14.932 5.096 1.00 0.00 C ATOM 275 CG GLU A 21 -12.129 -15.811 6.110 1.00 0.00 C ATOM 276 CD GLU A 21 -13.005 -15.016 7.059 1.00 0.00 C ATOM 277 OE1 GLU A 21 -14.078 -14.549 6.625 1.00 0.00 O ATOM 278 OE2 GLU A 21 -12.617 -14.863 8.236 1.00 0.00 O ATOM 0 H GLU A 21 -12.647 -16.127 3.323 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.197 -13.792 4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.724 -15.545 4.519 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.820 -14.190 5.626 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.741 -16.543 5.584 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.389 -16.368 6.685 1.00 0.00 H new ATOM 285 N PHE A 22 -10.721 -13.434 2.533 1.00 0.00 N ATOM 286 CA PHE A 22 -9.947 -12.445 1.792 1.00 0.00 C ATOM 287 C PHE A 22 -10.856 -11.360 1.221 1.00 0.00 C ATOM 288 O PHE A 22 -10.584 -10.168 1.366 1.00 0.00 O ATOM 289 CB PHE A 22 -9.166 -13.119 0.662 1.00 0.00 C ATOM 290 CG PHE A 22 -8.651 -12.155 -0.368 1.00 0.00 C ATOM 291 CD1 PHE A 22 -7.971 -11.010 0.014 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.846 -12.394 -1.719 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.497 -10.121 -0.932 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.374 -11.509 -2.670 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.697 -10.372 -2.276 1.00 0.00 C ATOM 0 H PHE A 22 -10.501 -14.402 2.300 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.244 -11.979 2.482 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.325 -13.666 1.088 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.809 -13.851 0.173 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.809 -10.810 1.063 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.373 -13.283 -2.033 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -6.971 -9.231 -0.621 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.534 -11.707 -3.720 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.324 -9.680 -3.017 1.00 0.00 H new ATOM 305 N ASP A 23 -11.935 -11.783 0.571 1.00 0.00 N ATOM 306 CA ASP A 23 -12.885 -10.849 -0.022 1.00 0.00 C ATOM 307 C ASP A 23 -13.415 -9.875 1.026 1.00 0.00 C ATOM 308 O ASP A 23 -13.377 -8.659 0.835 1.00 0.00 O ATOM 309 CB ASP A 23 -14.046 -11.608 -0.664 1.00 0.00 C ATOM 310 CG ASP A 23 -14.792 -10.771 -1.685 1.00 0.00 C ATOM 311 OD1 ASP A 23 -15.537 -9.859 -1.273 1.00 0.00 O ATOM 312 OD2 ASP A 23 -14.630 -11.030 -2.896 1.00 0.00 O ATOM 0 H ASP A 23 -12.173 -12.766 0.442 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.364 -10.279 -0.792 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.665 -12.509 -1.146 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.739 -11.931 0.113 1.00 0.00 H new ATOM 317 N LYS A 24 -13.910 -10.416 2.133 1.00 0.00 N ATOM 318 CA LYS A 24 -14.449 -9.597 3.212 1.00 0.00 C ATOM 319 C LYS A 24 -13.449 -8.523 3.630 1.00 0.00 C ATOM 320 O LYS A 24 -13.758 -7.332 3.606 1.00 0.00 O ATOM 321 CB LYS A 24 -14.806 -10.472 4.416 1.00 0.00 C ATOM 322 CG LYS A 24 -15.941 -9.915 5.257 1.00 0.00 C ATOM 323 CD LYS A 24 -17.291 -10.156 4.602 1.00 0.00 C ATOM 324 CE LYS A 24 -18.396 -10.297 5.637 1.00 0.00 C ATOM 325 NZ LYS A 24 -18.476 -11.682 6.177 1.00 0.00 N ATOM 0 H LYS A 24 -13.949 -11.420 2.307 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.352 -9.107 2.847 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.080 -11.466 4.063 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.923 -10.589 5.044 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.926 -10.379 6.243 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.794 -8.845 5.406 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.523 -9.329 3.931 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.245 -11.058 3.992 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.219 -9.598 6.455 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -19.351 -10.027 5.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.241 -11.737 6.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -18.670 -12.347 5.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.573 -11.931 6.629 1.00 0.00 H new ATOM 339 N ALA A 25 -12.251 -8.952 4.011 1.00 0.00 N ATOM 340 CA ALA A 25 -11.205 -8.027 4.430 1.00 0.00 C ATOM 341 C ALA A 25 -10.910 -7.002 3.341 1.00 0.00 C ATOM 342 O ALA A 25 -10.609 -5.844 3.629 1.00 0.00 O ATOM 343 CB ALA A 25 -9.941 -8.790 4.797 1.00 0.00 C ATOM 0 H ALA A 25 -11.980 -9.935 4.038 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.560 -7.491 5.310 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.169 -8.086 5.108 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.156 -9.478 5.615 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.592 -9.353 3.932 1.00 0.00 H new ATOM 349 N VAL A 26 -10.997 -7.436 2.087 1.00 0.00 N ATOM 350 CA VAL A 26 -10.739 -6.556 0.954 1.00 0.00 C ATOM 351 C VAL A 26 -11.793 -5.458 0.860 1.00 0.00 C ATOM 352 O VAL A 26 -11.510 -4.286 1.109 1.00 0.00 O ATOM 353 CB VAL A 26 -10.712 -7.340 -0.371 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.803 -6.391 -1.556 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.456 -8.194 -0.458 1.00 0.00 C ATOM 0 H VAL A 26 -11.244 -8.392 1.831 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.761 -6.104 1.121 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.578 -8.002 -0.399 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.782 -6.964 -2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.733 -5.826 -1.499 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.958 -5.702 -1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.453 -8.741 -1.401 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.576 -7.553 -0.408 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.438 -8.900 0.372 1.00 0.00 H new ATOM 365 N LYS A 27 -13.012 -5.845 0.499 1.00 0.00 N ATOM 366 CA LYS A 27 -14.111 -4.895 0.373 1.00 0.00 C ATOM 367 C LYS A 27 -14.152 -3.948 1.568 1.00 0.00 C ATOM 368 O LYS A 27 -14.588 -2.804 1.449 1.00 0.00 O ATOM 369 CB LYS A 27 -15.443 -5.638 0.252 1.00 0.00 C ATOM 370 CG LYS A 27 -15.697 -6.211 -1.132 1.00 0.00 C ATOM 371 CD LYS A 27 -17.044 -6.911 -1.207 1.00 0.00 C ATOM 372 CE LYS A 27 -17.363 -7.354 -2.627 1.00 0.00 C ATOM 373 NZ LYS A 27 -18.546 -8.258 -2.673 1.00 0.00 N ATOM 0 H LYS A 27 -13.264 -6.811 0.288 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.947 -4.306 -0.529 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.465 -6.448 0.981 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.254 -4.956 0.508 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.660 -5.410 -1.871 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -14.905 -6.916 -1.386 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -17.042 -7.778 -0.546 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -17.825 -6.239 -0.850 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -17.551 -6.478 -3.247 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -16.499 -7.865 -3.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -18.731 -8.538 -3.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -18.357 -9.106 -2.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -19.377 -7.762 -2.292 1.00 0.00 H new ATOM 387 N GLU A 28 -13.692 -4.433 2.717 1.00 0.00 N ATOM 388 CA GLU A 28 -13.676 -3.629 3.933 1.00 0.00 C ATOM 389 C GLU A 28 -12.720 -2.448 3.791 1.00 0.00 C ATOM 390 O GLU A 28 -13.091 -1.301 4.044 1.00 0.00 O ATOM 391 CB GLU A 28 -13.270 -4.486 5.134 1.00 0.00 C ATOM 392 CG GLU A 28 -14.442 -5.172 5.816 1.00 0.00 C ATOM 393 CD GLU A 28 -15.583 -4.219 6.114 1.00 0.00 C ATOM 394 OE1 GLU A 28 -15.469 -3.445 7.088 1.00 0.00 O ATOM 395 OE2 GLU A 28 -16.589 -4.247 5.376 1.00 0.00 O ATOM 0 H GLU A 28 -13.326 -5.378 2.831 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.682 -3.243 4.096 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.558 -5.243 4.805 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.755 -3.858 5.860 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -14.805 -5.980 5.181 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.101 -5.627 6.746 1.00 0.00 H new ATOM 402 N HIS A 29 -11.488 -2.737 3.386 1.00 0.00 N ATOM 403 CA HIS A 29 -10.478 -1.699 3.210 1.00 0.00 C ATOM 404 C HIS A 29 -10.353 -1.306 1.741 1.00 0.00 C ATOM 405 O HIS A 29 -9.297 -0.857 1.297 1.00 0.00 O ATOM 406 CB HIS A 29 -9.126 -2.180 3.738 1.00 0.00 C ATOM 407 CG HIS A 29 -9.236 -3.121 4.898 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.667 -2.728 6.148 1.00 0.00 N ATOM 409 CD2 HIS A 29 -8.970 -4.444 4.993 1.00 0.00 C ATOM 410 CE1 HIS A 29 -9.659 -3.769 6.961 1.00 0.00 C ATOM 411 NE2 HIS A 29 -9.241 -4.823 6.284 1.00 0.00 N ATOM 0 H HIS A 29 -11.165 -3.681 3.173 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.790 -0.822 3.777 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.585 -2.673 2.931 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.534 -1.315 4.037 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -8.611 -5.083 4.200 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.946 -3.760 8.002 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -9.137 -5.766 6.660 1.00 0.00 H new ATOM 420 N GLU A 30 -11.438 -1.479 0.993 1.00 0.00 N ATOM 421 CA GLU A 30 -11.448 -1.143 -0.426 1.00 0.00 C ATOM 422 C GLU A 30 -11.130 0.334 -0.638 1.00 0.00 C ATOM 423 O GLU A 30 -10.377 0.695 -1.543 1.00 0.00 O ATOM 424 CB GLU A 30 -12.808 -1.476 -1.042 1.00 0.00 C ATOM 425 CG GLU A 30 -13.966 -0.727 -0.405 1.00 0.00 C ATOM 426 CD GLU A 30 -14.219 0.619 -1.057 1.00 0.00 C ATOM 427 OE1 GLU A 30 -13.793 0.805 -2.216 1.00 0.00 O ATOM 428 OE2 GLU A 30 -14.843 1.485 -0.409 1.00 0.00 O ATOM 0 H GLU A 30 -12.321 -1.849 1.345 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.678 -1.737 -0.919 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -12.781 -1.247 -2.107 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -12.986 -2.548 -0.951 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.868 -1.335 -0.473 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.760 -0.580 0.655 1.00 0.00 H new ATOM 435 N SER A 31 -11.709 1.185 0.203 1.00 0.00 N ATOM 436 CA SER A 31 -11.491 2.623 0.106 1.00 0.00 C ATOM 437 C SER A 31 -10.003 2.941 -0.011 1.00 0.00 C ATOM 438 O SER A 31 -9.594 3.759 -0.834 1.00 0.00 O ATOM 439 CB SER A 31 -12.082 3.333 1.326 1.00 0.00 C ATOM 440 OG SER A 31 -13.496 3.248 1.331 1.00 0.00 O ATOM 0 H SER A 31 -12.333 0.903 0.959 1.00 0.00 H new ATOM 0 HA SER A 31 -11.993 2.982 -0.793 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.685 2.887 2.238 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.778 4.380 1.324 1.00 0.00 H new ATOM 0 HG SER A 31 -13.786 2.579 0.677 1.00 0.00 H new ATOM 446 N LYS A 32 -9.199 2.288 0.820 1.00 0.00 N ATOM 447 CA LYS A 32 -7.756 2.498 0.812 1.00 0.00 C ATOM 448 C LYS A 32 -7.046 1.366 0.075 1.00 0.00 C ATOM 449 O LYS A 32 -7.631 0.312 -0.178 1.00 0.00 O ATOM 450 CB LYS A 32 -7.226 2.599 2.244 1.00 0.00 C ATOM 451 CG LYS A 32 -7.796 3.772 3.022 1.00 0.00 C ATOM 452 CD LYS A 32 -9.100 3.404 3.709 1.00 0.00 C ATOM 453 CE LYS A 32 -9.548 4.491 4.674 1.00 0.00 C ATOM 454 NZ LYS A 32 -9.609 5.826 4.017 1.00 0.00 N ATOM 0 H LYS A 32 -9.522 1.608 1.508 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.553 3.433 0.289 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.458 1.675 2.774 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.140 2.686 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.072 4.102 3.767 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.964 4.611 2.347 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.874 3.240 2.959 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.976 2.465 4.249 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.530 4.238 5.075 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.860 4.533 5.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.121 6.492 4.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.644 6.177 3.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.105 5.743 3.107 1.00 0.00 H new ATOM 468 N THR A 33 -5.781 1.591 -0.267 1.00 0.00 N ATOM 469 CA THR A 33 -4.991 0.591 -0.974 1.00 0.00 C ATOM 470 C THR A 33 -4.879 -0.696 -0.163 1.00 0.00 C ATOM 471 O THR A 33 -4.663 -0.660 1.048 1.00 0.00 O ATOM 472 CB THR A 33 -3.576 1.111 -1.288 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.652 2.415 -1.874 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.849 0.167 -2.233 1.00 0.00 C ATOM 0 H THR A 33 -5.282 2.457 -0.066 1.00 0.00 H new ATOM 0 HA THR A 33 -5.509 0.384 -1.910 1.00 0.00 H new ATOM 0 HB THR A 33 -3.018 1.165 -0.353 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.803 2.624 -2.317 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.852 0.556 -2.440 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.766 -0.817 -1.772 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.407 0.085 -3.166 1.00 0.00 H new ATOM 482 N ILE A 34 -5.026 -1.830 -0.839 1.00 0.00 N ATOM 483 CA ILE A 34 -4.939 -3.128 -0.181 1.00 0.00 C ATOM 484 C ILE A 34 -3.825 -3.977 -0.784 1.00 0.00 C ATOM 485 O ILE A 34 -3.490 -3.836 -1.960 1.00 0.00 O ATOM 486 CB ILE A 34 -6.269 -3.899 -0.280 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.355 -3.193 0.533 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.087 -5.331 0.200 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.760 -3.541 0.094 1.00 0.00 C ATOM 0 H ILE A 34 -5.206 -1.877 -1.842 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.717 -2.936 0.869 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.582 -3.923 -1.324 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.237 -3.453 1.585 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.214 -2.115 0.453 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.035 -5.863 0.124 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.340 -5.830 -0.418 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.755 -5.327 1.238 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.478 -3.005 0.714 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.896 -3.256 -0.949 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.919 -4.614 0.200 1.00 0.00 H new ATOM 501 N PHE A 35 -3.255 -4.859 0.030 1.00 0.00 N ATOM 502 CA PHE A 35 -2.179 -5.733 -0.423 1.00 0.00 C ATOM 503 C PHE A 35 -2.418 -7.170 0.029 1.00 0.00 C ATOM 504 O PHE A 35 -2.325 -7.483 1.216 1.00 0.00 O ATOM 505 CB PHE A 35 -0.833 -5.236 0.109 1.00 0.00 C ATOM 506 CG PHE A 35 -0.330 -4.005 -0.589 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.349 -4.103 -1.793 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.537 -2.749 -0.041 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.813 -2.971 -2.436 1.00 0.00 C ATOM 510 CE2 PHE A 35 -0.075 -1.614 -0.680 1.00 0.00 C ATOM 511 CZ PHE A 35 0.600 -1.725 -1.880 1.00 0.00 C ATOM 0 H PHE A 35 -3.520 -4.988 1.007 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.162 -5.712 -1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.927 -5.027 1.175 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.094 -6.031 0.004 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.517 -5.075 -2.234 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.065 -2.656 0.896 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.342 -3.061 -3.373 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -0.242 -0.641 -0.242 1.00 0.00 H new ATOM 0 HZ PHE A 35 0.960 -0.839 -2.382 1.00 0.00 H new ATOM 521 N ALA A 36 -2.728 -8.041 -0.926 1.00 0.00 N ATOM 522 CA ALA A 36 -2.980 -9.445 -0.627 1.00 0.00 C ATOM 523 C ALA A 36 -1.735 -10.290 -0.874 1.00 0.00 C ATOM 524 O ALA A 36 -1.185 -10.296 -1.975 1.00 0.00 O ATOM 525 CB ALA A 36 -4.144 -9.962 -1.460 1.00 0.00 C ATOM 0 H ALA A 36 -2.811 -7.799 -1.913 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.239 -9.525 0.429 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.321 -11.012 -1.226 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.039 -9.384 -1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.907 -9.861 -2.519 1.00 0.00 H new ATOM 531 N TYR A 37 -1.295 -11.002 0.158 1.00 0.00 N ATOM 532 CA TYR A 37 -0.112 -11.848 0.054 1.00 0.00 C ATOM 533 C TYR A 37 -0.497 -13.325 0.058 1.00 0.00 C ATOM 534 O TYR A 37 -0.471 -13.983 1.098 1.00 0.00 O ATOM 535 CB TYR A 37 0.851 -11.558 1.206 1.00 0.00 C ATOM 536 CG TYR A 37 2.160 -12.309 1.105 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.969 -12.186 -0.018 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.587 -13.142 2.132 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.165 -12.870 -0.115 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.782 -13.829 2.044 1.00 0.00 C ATOM 541 CZ TYR A 37 4.567 -13.690 0.918 1.00 0.00 C ATOM 542 OH TYR A 37 5.758 -14.374 0.826 1.00 0.00 O ATOM 0 H TYR A 37 -1.740 -11.010 1.076 1.00 0.00 H new ATOM 0 HA TYR A 37 0.383 -11.622 -0.890 1.00 0.00 H new ATOM 0 HB2 TYR A 37 1.057 -10.488 1.236 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.366 -11.815 2.148 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.657 -11.545 -0.829 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.974 -13.254 3.014 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.782 -12.763 -0.995 1.00 0.00 H new ATOM 0 HE2 TYR A 37 4.100 -14.471 2.852 1.00 0.00 H new ATOM 0 HH TYR A 37 6.012 -14.709 1.711 1.00 0.00 H new ATOM 552 N PHE A 38 -0.854 -13.839 -1.114 1.00 0.00 N ATOM 553 CA PHE A 38 -1.245 -15.238 -1.248 1.00 0.00 C ATOM 554 C PHE A 38 -0.032 -16.156 -1.121 1.00 0.00 C ATOM 555 O PHE A 38 0.902 -16.081 -1.919 1.00 0.00 O ATOM 556 CB PHE A 38 -1.936 -15.470 -2.593 1.00 0.00 C ATOM 557 CG PHE A 38 -2.825 -14.334 -3.014 1.00 0.00 C ATOM 558 CD1 PHE A 38 -3.972 -14.033 -2.298 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.514 -13.569 -4.126 1.00 0.00 C ATOM 560 CE1 PHE A 38 -4.792 -12.989 -2.682 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.330 -12.523 -4.515 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.471 -12.234 -3.793 1.00 0.00 C ATOM 0 H PHE A 38 -0.881 -13.308 -1.985 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.943 -15.473 -0.444 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.178 -15.631 -3.359 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.529 -16.383 -2.535 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.228 -14.621 -1.429 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.624 -13.792 -4.696 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.683 -12.764 -2.114 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.075 -11.933 -5.383 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.111 -11.419 -4.097 1.00 0.00 H new ATOM 572 N SER A 39 -0.056 -17.021 -0.113 1.00 0.00 N ATOM 573 CA SER A 39 1.043 -17.951 0.122 1.00 0.00 C ATOM 574 C SER A 39 0.554 -19.195 0.858 1.00 0.00 C ATOM 575 O SER A 39 -0.335 -19.119 1.706 1.00 0.00 O ATOM 576 CB SER A 39 2.151 -17.271 0.928 1.00 0.00 C ATOM 577 OG SER A 39 1.629 -16.647 2.088 1.00 0.00 O ATOM 0 H SER A 39 -0.824 -17.098 0.554 1.00 0.00 H new ATOM 0 HA SER A 39 1.442 -18.255 -0.846 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.901 -18.008 1.214 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.654 -16.529 0.307 1.00 0.00 H new ATOM 0 HG SER A 39 2.047 -15.768 2.203 1.00 0.00 H new ATOM 583 N GLY A 40 1.141 -20.340 0.526 1.00 0.00 N ATOM 584 CA GLY A 40 0.753 -21.585 1.163 1.00 0.00 C ATOM 585 C GLY A 40 0.413 -21.404 2.630 1.00 0.00 C ATOM 586 O GLY A 40 0.998 -20.561 3.310 1.00 0.00 O ATOM 0 H GLY A 40 1.879 -20.428 -0.173 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.109 -22.003 0.642 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.564 -22.307 1.067 1.00 0.00 H new ATOM 590 N SER A 41 -0.536 -22.197 3.117 1.00 0.00 N ATOM 591 CA SER A 41 -0.957 -22.116 4.511 1.00 0.00 C ATOM 592 C SER A 41 0.205 -22.431 5.449 1.00 0.00 C ATOM 593 O SER A 41 1.291 -22.806 5.007 1.00 0.00 O ATOM 594 CB SER A 41 -2.114 -23.082 4.773 1.00 0.00 C ATOM 595 OG SER A 41 -1.679 -24.429 4.708 1.00 0.00 O ATOM 0 H SER A 41 -1.027 -22.902 2.568 1.00 0.00 H new ATOM 0 HA SER A 41 -1.292 -21.097 4.705 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.543 -22.882 5.755 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.904 -22.916 4.040 1.00 0.00 H new ATOM 0 HG SER A 41 -2.437 -25.026 4.881 1.00 0.00 H new ATOM 601 N LYS A 42 -0.031 -22.274 6.747 1.00 0.00 N ATOM 602 CA LYS A 42 0.993 -22.541 7.749 1.00 0.00 C ATOM 603 C LYS A 42 0.975 -24.008 8.168 1.00 0.00 C ATOM 604 O LYS A 42 0.151 -24.789 7.692 1.00 0.00 O ATOM 605 CB LYS A 42 0.783 -21.648 8.974 1.00 0.00 C ATOM 606 CG LYS A 42 0.913 -20.164 8.674 1.00 0.00 C ATOM 607 CD LYS A 42 0.589 -19.318 9.894 1.00 0.00 C ATOM 608 CE LYS A 42 -0.892 -18.979 9.959 1.00 0.00 C ATOM 609 NZ LYS A 42 -1.263 -17.922 8.978 1.00 0.00 N ATOM 0 H LYS A 42 -0.924 -21.963 7.130 1.00 0.00 H new ATOM 0 HA LYS A 42 1.964 -22.319 7.307 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.206 -21.841 9.389 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.509 -21.920 9.740 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.927 -19.947 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.243 -19.897 7.857 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.881 -19.853 10.797 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.173 -18.398 9.866 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.479 -19.877 9.765 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.144 -18.645 10.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.273 -17.695 9.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.697 -17.068 9.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.078 -18.263 8.013 1.00 0.00 H new ATOM 623 N ASP A 43 1.887 -24.375 9.062 1.00 0.00 N ATOM 624 CA ASP A 43 1.974 -25.747 9.546 1.00 0.00 C ATOM 625 C ASP A 43 1.786 -25.802 11.059 1.00 0.00 C ATOM 626 O ASP A 43 1.566 -24.778 11.707 1.00 0.00 O ATOM 627 CB ASP A 43 3.321 -26.361 9.165 1.00 0.00 C ATOM 628 CG ASP A 43 3.413 -26.683 7.686 1.00 0.00 C ATOM 629 OD1 ASP A 43 3.040 -25.818 6.867 1.00 0.00 O ATOM 630 OD2 ASP A 43 3.856 -27.801 7.348 1.00 0.00 O ATOM 0 H ASP A 43 2.576 -23.741 9.466 1.00 0.00 H new ATOM 0 HA ASP A 43 1.176 -26.323 9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 43 4.121 -25.671 9.434 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.478 -27.272 9.743 1.00 0.00 H new ATOM 635 N THR A 44 1.872 -27.005 11.618 1.00 0.00 N ATOM 636 CA THR A 44 1.709 -27.195 13.054 1.00 0.00 C ATOM 637 C THR A 44 2.746 -26.395 13.835 1.00 0.00 C ATOM 638 O THR A 44 2.606 -26.191 15.040 1.00 0.00 O ATOM 639 CB THR A 44 1.825 -28.681 13.441 1.00 0.00 C ATOM 640 OG1 THR A 44 1.606 -28.839 14.847 1.00 0.00 O ATOM 641 CG2 THR A 44 3.194 -29.231 13.071 1.00 0.00 C ATOM 0 H THR A 44 2.054 -27.863 11.097 1.00 0.00 H new ATOM 0 HA THR A 44 0.711 -26.838 13.309 1.00 0.00 H new ATOM 0 HB THR A 44 1.067 -29.238 12.891 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.780 -27.989 15.303 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.252 -30.282 13.354 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.346 -29.136 11.996 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.966 -28.670 13.598 1.00 0.00 H new ATOM 649 N GLU A 45 3.786 -25.945 13.140 1.00 0.00 N ATOM 650 CA GLU A 45 4.847 -25.168 13.770 1.00 0.00 C ATOM 651 C GLU A 45 4.643 -23.675 13.530 1.00 0.00 C ATOM 652 O GLU A 45 5.130 -22.840 14.292 1.00 0.00 O ATOM 653 CB GLU A 45 6.213 -25.600 13.234 1.00 0.00 C ATOM 654 CG GLU A 45 7.341 -25.434 14.239 1.00 0.00 C ATOM 655 CD GLU A 45 8.498 -26.378 13.979 1.00 0.00 C ATOM 656 OE1 GLU A 45 8.246 -27.583 13.768 1.00 0.00 O ATOM 657 OE2 GLU A 45 9.657 -25.912 13.985 1.00 0.00 O ATOM 0 H GLU A 45 3.916 -26.105 12.141 1.00 0.00 H new ATOM 0 HA GLU A 45 4.811 -25.354 14.843 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.160 -26.645 12.929 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.444 -25.019 12.341 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.702 -24.406 14.208 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.955 -25.606 15.244 1.00 0.00 H new ATOM 664 N GLY A 46 3.920 -23.346 12.464 1.00 0.00 N ATOM 665 CA GLY A 46 3.665 -21.954 12.141 1.00 0.00 C ATOM 666 C GLY A 46 4.538 -21.452 11.008 1.00 0.00 C ATOM 667 O GLY A 46 4.951 -20.292 11.000 1.00 0.00 O ATOM 0 H GLY A 46 3.506 -24.018 11.818 1.00 0.00 H new ATOM 0 HA2 GLY A 46 2.617 -21.834 11.868 1.00 0.00 H new ATOM 0 HA3 GLY A 46 3.836 -21.342 13.026 1.00 0.00 H new ATOM 671 N LYS A 47 4.823 -22.327 10.050 1.00 0.00 N ATOM 672 CA LYS A 47 5.654 -21.968 8.907 1.00 0.00 C ATOM 673 C LYS A 47 5.080 -22.541 7.615 1.00 0.00 C ATOM 674 O LYS A 47 4.584 -23.667 7.592 1.00 0.00 O ATOM 675 CB LYS A 47 7.084 -22.473 9.111 1.00 0.00 C ATOM 676 CG LYS A 47 7.198 -23.988 9.117 1.00 0.00 C ATOM 677 CD LYS A 47 8.638 -24.439 8.941 1.00 0.00 C ATOM 678 CE LYS A 47 9.353 -24.557 10.278 1.00 0.00 C ATOM 679 NZ LYS A 47 10.738 -25.082 10.122 1.00 0.00 N ATOM 0 H LYS A 47 4.490 -23.291 10.042 1.00 0.00 H new ATOM 0 HA LYS A 47 5.667 -20.881 8.827 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.718 -22.072 8.320 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.467 -22.084 10.055 1.00 0.00 H new ATOM 0 HG2 LYS A 47 6.805 -24.380 10.055 1.00 0.00 H new ATOM 0 HG3 LYS A 47 6.585 -24.403 8.317 1.00 0.00 H new ATOM 0 HD2 LYS A 47 8.659 -25.402 8.430 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.168 -23.729 8.306 1.00 0.00 H new ATOM 0 HE2 LYS A 47 9.387 -23.579 10.759 1.00 0.00 H new ATOM 0 HE3 LYS A 47 8.787 -25.216 10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.192 -25.148 11.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 10.705 -26.026 9.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 11.286 -24.440 9.515 1.00 0.00 H new ATOM 693 N SER A 48 5.152 -21.759 6.543 1.00 0.00 N ATOM 694 CA SER A 48 4.637 -22.189 5.248 1.00 0.00 C ATOM 695 C SER A 48 5.488 -23.316 4.672 1.00 0.00 C ATOM 696 O SER A 48 6.717 -23.258 4.701 1.00 0.00 O ATOM 697 CB SER A 48 4.603 -21.010 4.272 1.00 0.00 C ATOM 698 OG SER A 48 5.913 -20.571 3.958 1.00 0.00 O ATOM 0 H SER A 48 5.562 -20.825 6.545 1.00 0.00 H new ATOM 0 HA SER A 48 3.623 -22.561 5.393 1.00 0.00 H new ATOM 0 HB2 SER A 48 4.086 -21.304 3.359 1.00 0.00 H new ATOM 0 HB3 SER A 48 4.035 -20.188 4.709 1.00 0.00 H new ATOM 0 HG SER A 48 5.914 -19.597 3.847 1.00 0.00 H new ATOM 704 N TRP A 49 4.825 -24.341 4.149 1.00 0.00 N ATOM 705 CA TRP A 49 5.520 -25.483 3.566 1.00 0.00 C ATOM 706 C TRP A 49 6.605 -25.024 2.598 1.00 0.00 C ATOM 707 O TRP A 49 7.674 -25.631 2.517 1.00 0.00 O ATOM 708 CB TRP A 49 4.527 -26.395 2.842 1.00 0.00 C ATOM 709 CG TRP A 49 3.556 -25.649 1.978 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.319 -25.196 2.338 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.741 -25.271 0.610 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.724 -24.559 1.276 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.576 -24.591 0.204 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.779 -25.439 -0.312 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.422 -24.082 -1.083 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.624 -24.933 -1.588 1.00 0.00 C ATOM 717 CH2 TRP A 49 3.453 -24.261 -1.964 1.00 0.00 C ATOM 0 H TRP A 49 3.808 -24.405 4.117 1.00 0.00 H new ATOM 0 HA TRP A 49 5.993 -26.040 4.375 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.079 -27.105 2.226 1.00 0.00 H new ATOM 0 HB3 TRP A 49 3.974 -26.976 3.580 1.00 0.00 H new ATOM 0 HD1 TRP A 49 1.874 -25.320 3.314 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.798 -24.132 1.284 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.685 -25.955 -0.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.520 -23.564 -1.375 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 5.419 -25.057 -2.308 1.00 0.00 H new ATOM 0 HH2 TRP A 49 3.363 -23.877 -2.969 1.00 0.00 H new ATOM 728 N CYS A 50 6.325 -23.950 1.868 1.00 0.00 N ATOM 729 CA CYS A 50 7.279 -23.410 0.906 1.00 0.00 C ATOM 730 C CYS A 50 8.279 -22.485 1.591 1.00 0.00 C ATOM 731 O CYS A 50 7.918 -21.632 2.402 1.00 0.00 O ATOM 732 CB CYS A 50 6.544 -22.655 -0.203 1.00 0.00 C ATOM 733 SG CYS A 50 7.417 -22.636 -1.787 1.00 0.00 S ATOM 0 H CYS A 50 5.446 -23.436 1.924 1.00 0.00 H new ATOM 0 HA CYS A 50 7.826 -24.244 0.467 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.563 -23.107 -0.347 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.378 -21.627 0.120 1.00 0.00 H new ATOM 0 HG CYS A 50 6.716 -21.977 -2.661 1.00 0.00 H new ATOM 739 N PRO A 51 9.567 -22.657 1.261 1.00 0.00 N ATOM 740 CA PRO A 51 10.646 -21.847 1.835 1.00 0.00 C ATOM 741 C PRO A 51 10.612 -20.404 1.344 1.00 0.00 C ATOM 742 O PRO A 51 10.939 -19.478 2.087 1.00 0.00 O ATOM 743 CB PRO A 51 11.916 -22.548 1.344 1.00 0.00 C ATOM 744 CG PRO A 51 11.503 -23.247 0.094 1.00 0.00 C ATOM 745 CD PRO A 51 10.070 -23.654 0.302 1.00 0.00 C ATOM 0 HA PRO A 51 10.571 -21.780 2.920 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.715 -21.832 1.152 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.292 -23.252 2.086 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.601 -22.591 -0.771 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.133 -24.117 -0.093 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.507 -23.633 -0.631 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.993 -24.667 0.698 1.00 0.00 H new ATOM 753 N ASP A 52 10.213 -20.219 0.090 1.00 0.00 N ATOM 754 CA ASP A 52 10.134 -18.888 -0.499 1.00 0.00 C ATOM 755 C ASP A 52 9.330 -17.946 0.392 1.00 0.00 C ATOM 756 O ASP A 52 9.844 -16.931 0.864 1.00 0.00 O ATOM 757 CB ASP A 52 9.501 -18.959 -1.889 1.00 0.00 C ATOM 758 CG ASP A 52 10.010 -17.870 -2.814 1.00 0.00 C ATOM 759 OD1 ASP A 52 9.829 -16.679 -2.484 1.00 0.00 O ATOM 760 OD2 ASP A 52 10.591 -18.209 -3.866 1.00 0.00 O ATOM 0 H ASP A 52 9.939 -20.975 -0.538 1.00 0.00 H new ATOM 0 HA ASP A 52 11.147 -18.497 -0.589 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.710 -19.933 -2.331 1.00 0.00 H new ATOM 0 HB3 ASP A 52 8.418 -18.876 -1.796 1.00 0.00 H new ATOM 765 N CYS A 53 8.066 -18.288 0.617 1.00 0.00 N ATOM 766 CA CYS A 53 7.189 -17.472 1.450 1.00 0.00 C ATOM 767 C CYS A 53 7.886 -17.077 2.748 1.00 0.00 C ATOM 768 O CYS A 53 7.910 -15.903 3.119 1.00 0.00 O ATOM 769 CB CYS A 53 5.897 -18.229 1.761 1.00 0.00 C ATOM 770 SG CYS A 53 5.050 -17.661 3.254 1.00 0.00 S ATOM 0 H CYS A 53 7.625 -19.125 0.234 1.00 0.00 H new ATOM 0 HA CYS A 53 6.946 -16.564 0.898 1.00 0.00 H new ATOM 0 HB2 CYS A 53 5.219 -18.133 0.913 1.00 0.00 H new ATOM 0 HB3 CYS A 53 6.126 -19.289 1.867 1.00 0.00 H new ATOM 0 HG CYS A 53 3.968 -18.360 3.432 1.00 0.00 H new ATOM 776 N VAL A 54 8.451 -18.065 3.435 1.00 0.00 N ATOM 777 CA VAL A 54 9.148 -17.820 4.692 1.00 0.00 C ATOM 778 C VAL A 54 10.390 -16.964 4.474 1.00 0.00 C ATOM 779 O VAL A 54 10.886 -16.325 5.402 1.00 0.00 O ATOM 780 CB VAL A 54 9.560 -19.140 5.371 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.304 -18.863 6.669 1.00 0.00 C ATOM 782 CG2 VAL A 54 8.340 -20.013 5.622 1.00 0.00 C ATOM 0 H VAL A 54 8.440 -19.042 3.142 1.00 0.00 H new ATOM 0 HA VAL A 54 8.453 -17.287 5.341 1.00 0.00 H new ATOM 0 HB VAL A 54 10.232 -19.678 4.703 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.587 -19.807 7.135 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.200 -18.280 6.457 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.658 -18.304 7.346 1.00 0.00 H new ATOM 0 HG21 VAL A 54 8.649 -20.941 6.102 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.642 -19.484 6.271 1.00 0.00 H new ATOM 0 HG23 VAL A 54 7.854 -20.240 4.673 1.00 0.00 H new ATOM 792 N GLU A 55 10.888 -16.955 3.241 1.00 0.00 N ATOM 793 CA GLU A 55 12.073 -16.176 2.902 1.00 0.00 C ATOM 794 C GLU A 55 11.685 -14.805 2.356 1.00 0.00 C ATOM 795 O GLU A 55 12.516 -13.901 2.272 1.00 0.00 O ATOM 796 CB GLU A 55 12.925 -16.924 1.875 1.00 0.00 C ATOM 797 CG GLU A 55 14.027 -16.075 1.264 1.00 0.00 C ATOM 798 CD GLU A 55 14.971 -16.882 0.394 1.00 0.00 C ATOM 799 OE1 GLU A 55 14.547 -17.318 -0.697 1.00 0.00 O ATOM 800 OE2 GLU A 55 16.134 -17.077 0.804 1.00 0.00 O ATOM 0 H GLU A 55 10.489 -17.478 2.461 1.00 0.00 H new ATOM 0 HA GLU A 55 12.656 -16.034 3.812 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.372 -17.796 2.352 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.278 -17.293 1.079 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.579 -15.280 0.668 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.595 -15.595 2.061 1.00 0.00 H new ATOM 807 N ALA A 56 10.417 -14.659 1.986 1.00 0.00 N ATOM 808 CA ALA A 56 9.919 -13.399 1.449 1.00 0.00 C ATOM 809 C ALA A 56 9.143 -12.621 2.506 1.00 0.00 C ATOM 810 O ALA A 56 9.052 -11.395 2.445 1.00 0.00 O ATOM 811 CB ALA A 56 9.044 -13.654 0.231 1.00 0.00 C ATOM 0 H ALA A 56 9.716 -15.398 2.048 1.00 0.00 H new ATOM 0 HA ALA A 56 10.776 -12.797 1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.679 -12.704 -0.160 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.628 -14.162 -0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.197 -14.279 0.516 1.00 0.00 H new ATOM 817 N GLU A 57 8.586 -13.341 3.475 1.00 0.00 N ATOM 818 CA GLU A 57 7.816 -12.717 4.544 1.00 0.00 C ATOM 819 C GLU A 57 8.552 -11.504 5.108 1.00 0.00 C ATOM 820 O GLU A 57 8.049 -10.381 5.098 1.00 0.00 O ATOM 821 CB GLU A 57 7.543 -13.725 5.662 1.00 0.00 C ATOM 822 CG GLU A 57 7.454 -13.096 7.042 1.00 0.00 C ATOM 823 CD GLU A 57 6.649 -11.811 7.047 1.00 0.00 C ATOM 824 OE1 GLU A 57 5.648 -11.736 6.304 1.00 0.00 O ATOM 825 OE2 GLU A 57 7.021 -10.880 7.792 1.00 0.00 O ATOM 0 H GLU A 57 8.654 -14.357 3.541 1.00 0.00 H new ATOM 0 HA GLU A 57 6.867 -12.383 4.125 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.610 -14.247 5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 57 8.334 -14.475 5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.001 -13.807 7.733 1.00 0.00 H new ATOM 0 HG3 GLU A 57 8.460 -12.892 7.410 1.00 0.00 H new ATOM 832 N PRO A 58 9.774 -11.736 5.611 1.00 0.00 N ATOM 833 CA PRO A 58 10.606 -10.676 6.188 1.00 0.00 C ATOM 834 C PRO A 58 11.118 -9.702 5.133 1.00 0.00 C ATOM 835 O PRO A 58 11.650 -8.640 5.459 1.00 0.00 O ATOM 836 CB PRO A 58 11.771 -11.443 6.818 1.00 0.00 C ATOM 837 CG PRO A 58 11.850 -12.714 6.044 1.00 0.00 C ATOM 838 CD PRO A 58 10.437 -13.050 5.655 1.00 0.00 C ATOM 0 HA PRO A 58 10.050 -10.061 6.896 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.701 -10.878 6.748 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.593 -11.634 7.876 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.480 -12.596 5.162 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.289 -13.510 6.645 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.395 -13.554 4.689 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.967 -13.713 6.381 1.00 0.00 H new ATOM 846 N VAL A 59 10.954 -10.069 3.865 1.00 0.00 N ATOM 847 CA VAL A 59 11.399 -9.226 2.762 1.00 0.00 C ATOM 848 C VAL A 59 10.267 -8.337 2.259 1.00 0.00 C ATOM 849 O VAL A 59 10.507 -7.301 1.638 1.00 0.00 O ATOM 850 CB VAL A 59 11.933 -10.071 1.590 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.719 -9.203 0.620 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.788 -11.218 2.107 1.00 0.00 C ATOM 0 H VAL A 59 10.516 -10.944 3.577 1.00 0.00 H new ATOM 0 HA VAL A 59 12.205 -8.601 3.146 1.00 0.00 H new ATOM 0 HB VAL A 59 11.084 -10.495 1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 59 13.088 -9.818 -0.201 1.00 0.00 H new ATOM 0 HG12 VAL A 59 12.071 -8.421 0.225 1.00 0.00 H new ATOM 0 HG13 VAL A 59 13.562 -8.748 1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.157 -11.805 1.266 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.632 -10.818 2.669 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.188 -11.854 2.758 1.00 0.00 H new ATOM 862 N ILE A 60 9.033 -8.749 2.531 1.00 0.00 N ATOM 863 CA ILE A 60 7.864 -7.989 2.107 1.00 0.00 C ATOM 864 C ILE A 60 7.395 -7.043 3.207 1.00 0.00 C ATOM 865 O ILE A 60 7.093 -5.877 2.951 1.00 0.00 O ATOM 866 CB ILE A 60 6.700 -8.918 1.714 1.00 0.00 C ATOM 867 CG1 ILE A 60 7.096 -9.791 0.522 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.457 -8.103 1.391 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.949 -10.598 -0.044 1.00 0.00 C ATOM 0 H ILE A 60 8.817 -9.605 3.043 1.00 0.00 H new ATOM 0 HA ILE A 60 8.165 -7.408 1.235 1.00 0.00 H new ATOM 0 HB ILE A 60 6.474 -9.569 2.558 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.505 -9.155 -0.264 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.891 -10.471 0.828 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.644 -8.774 1.115 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.166 -7.521 2.265 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.669 -7.429 0.561 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.303 -11.193 -0.886 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.554 -11.260 0.727 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.162 -9.924 -0.382 1.00 0.00 H new ATOM 881 N ARG A 61 7.338 -7.552 4.434 1.00 0.00 N ATOM 882 CA ARG A 61 6.907 -6.752 5.574 1.00 0.00 C ATOM 883 C ARG A 61 7.933 -5.671 5.899 1.00 0.00 C ATOM 884 O ARG A 61 7.588 -4.612 6.422 1.00 0.00 O ATOM 885 CB ARG A 61 6.686 -7.646 6.796 1.00 0.00 C ATOM 886 CG ARG A 61 5.267 -8.177 6.913 1.00 0.00 C ATOM 887 CD ARG A 61 4.997 -8.746 8.298 1.00 0.00 C ATOM 888 NE ARG A 61 4.564 -7.715 9.237 1.00 0.00 N ATOM 889 CZ ARG A 61 5.398 -7.033 10.015 1.00 0.00 C ATOM 890 NH1 ARG A 61 6.701 -7.271 9.965 1.00 0.00 N ATOM 891 NH2 ARG A 61 4.928 -6.110 10.845 1.00 0.00 N ATOM 0 H ARG A 61 7.585 -8.515 4.664 1.00 0.00 H new ATOM 0 HA ARG A 61 5.966 -6.268 5.312 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.377 -8.488 6.750 1.00 0.00 H new ATOM 0 HB3 ARG A 61 6.930 -7.083 7.697 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.559 -7.375 6.704 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.104 -8.950 6.163 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.232 -9.519 8.230 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.900 -9.225 8.676 1.00 0.00 H new ATOM 0 HE ARG A 61 3.567 -7.507 9.299 1.00 0.00 H new ATOM 0 HH11 ARG A 61 7.066 -7.979 9.328 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.339 -6.746 10.563 1.00 0.00 H new ATOM 0 HH21 ARG A 61 3.926 -5.924 10.886 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.569 -5.587 11.442 1.00 0.00 H new ATOM 905 N GLU A 62 9.196 -5.948 5.587 1.00 0.00 N ATOM 906 CA GLU A 62 10.272 -4.999 5.848 1.00 0.00 C ATOM 907 C GLU A 62 10.154 -3.779 4.938 1.00 0.00 C ATOM 908 O GLU A 62 10.611 -2.690 5.281 1.00 0.00 O ATOM 909 CB GLU A 62 11.632 -5.670 5.647 1.00 0.00 C ATOM 910 CG GLU A 62 12.134 -6.408 6.877 1.00 0.00 C ATOM 911 CD GLU A 62 12.779 -5.483 7.891 1.00 0.00 C ATOM 912 OE1 GLU A 62 12.154 -4.461 8.243 1.00 0.00 O ATOM 913 OE2 GLU A 62 13.908 -5.782 8.332 1.00 0.00 O ATOM 0 H GLU A 62 9.498 -6.821 5.154 1.00 0.00 H new ATOM 0 HA GLU A 62 10.188 -4.668 6.883 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.562 -6.372 4.816 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.363 -4.913 5.364 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.301 -6.932 7.347 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.856 -7.166 6.572 1.00 0.00 H new ATOM 920 N GLY A 63 9.539 -3.973 3.776 1.00 0.00 N ATOM 921 CA GLY A 63 9.373 -2.881 2.834 1.00 0.00 C ATOM 922 C GLY A 63 8.057 -2.150 3.019 1.00 0.00 C ATOM 923 O GLY A 63 7.963 -0.951 2.757 1.00 0.00 O ATOM 0 H GLY A 63 9.153 -4.866 3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.196 -2.176 2.951 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.429 -3.270 1.818 1.00 0.00 H new ATOM 927 N LEU A 64 7.039 -2.874 3.471 1.00 0.00 N ATOM 928 CA LEU A 64 5.721 -2.288 3.690 1.00 0.00 C ATOM 929 C LEU A 64 5.824 -1.010 4.516 1.00 0.00 C ATOM 930 O LEU A 64 4.960 -0.136 4.439 1.00 0.00 O ATOM 931 CB LEU A 64 4.806 -3.291 4.393 1.00 0.00 C ATOM 932 CG LEU A 64 4.031 -4.245 3.483 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.430 -5.384 4.292 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.945 -3.496 2.726 1.00 0.00 C ATOM 0 H LEU A 64 7.101 -3.868 3.693 1.00 0.00 H new ATOM 0 HA LEU A 64 5.296 -2.037 2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.410 -3.885 5.078 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.089 -2.736 4.999 1.00 0.00 H new ATOM 0 HG LEU A 64 4.726 -4.668 2.757 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.882 -6.053 3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.227 -5.938 4.788 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.749 -4.979 5.041 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.404 -4.191 2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.252 -3.044 3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.399 -2.716 2.115 1.00 0.00 H new ATOM 946 N LYS A 65 6.888 -0.906 5.305 1.00 0.00 N ATOM 947 CA LYS A 65 7.108 0.267 6.144 1.00 0.00 C ATOM 948 C LYS A 65 7.476 1.481 5.297 1.00 0.00 C ATOM 949 O LYS A 65 7.046 2.600 5.578 1.00 0.00 O ATOM 950 CB LYS A 65 8.214 -0.011 7.164 1.00 0.00 C ATOM 951 CG LYS A 65 7.710 -0.634 8.454 1.00 0.00 C ATOM 952 CD LYS A 65 7.358 0.425 9.485 1.00 0.00 C ATOM 953 CE LYS A 65 8.605 0.998 10.143 1.00 0.00 C ATOM 954 NZ LYS A 65 8.275 2.095 11.095 1.00 0.00 N ATOM 0 H LYS A 65 7.612 -1.620 5.381 1.00 0.00 H new ATOM 0 HA LYS A 65 6.180 0.484 6.673 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.953 -0.675 6.714 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.725 0.923 7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.832 -1.245 8.245 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.472 -1.299 8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.796 1.227 9.007 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.710 -0.008 10.247 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.134 0.205 10.672 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.281 1.374 9.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.151 2.459 11.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.793 2.863 10.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.651 1.730 11.842 1.00 0.00 H new ATOM 968 N HIS A 66 8.272 1.252 4.257 1.00 0.00 N ATOM 969 CA HIS A 66 8.696 2.327 3.368 1.00 0.00 C ATOM 970 C HIS A 66 7.505 2.906 2.610 1.00 0.00 C ATOM 971 O HIS A 66 7.543 4.048 2.151 1.00 0.00 O ATOM 972 CB HIS A 66 9.745 1.816 2.379 1.00 0.00 C ATOM 973 CG HIS A 66 11.022 1.385 3.031 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.229 2.016 2.813 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.276 0.380 3.901 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.170 1.416 3.520 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.618 0.420 4.189 1.00 0.00 N ATOM 0 H HIS A 66 8.636 0.332 4.010 1.00 0.00 H new ATOM 0 HA HIS A 66 9.136 3.117 3.977 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.329 0.976 1.823 1.00 0.00 H new ATOM 0 HB3 HIS A 66 9.963 2.601 1.655 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.557 -0.323 4.295 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.214 1.693 3.546 1.00 0.00 H new ATOM 0 HE2 HIS A 66 13.109 -0.216 4.817 1.00 0.00 H new ATOM 986 N VAL A 67 6.448 2.111 2.481 1.00 0.00 N ATOM 987 CA VAL A 67 5.245 2.544 1.780 1.00 0.00 C ATOM 988 C VAL A 67 4.891 3.984 2.135 1.00 0.00 C ATOM 989 O VAL A 67 5.042 4.408 3.281 1.00 0.00 O ATOM 990 CB VAL A 67 4.046 1.636 2.108 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.427 2.029 3.440 1.00 0.00 C ATOM 992 CG2 VAL A 67 3.012 1.695 0.993 1.00 0.00 C ATOM 0 H VAL A 67 6.400 1.163 2.853 1.00 0.00 H new ATOM 0 HA VAL A 67 5.459 2.478 0.713 1.00 0.00 H new ATOM 0 HB VAL A 67 4.402 0.609 2.189 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.581 1.376 3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.171 1.931 4.230 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.084 3.063 3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.171 1.047 1.242 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.659 2.720 0.878 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.464 1.360 0.059 1.00 0.00 H new ATOM 1002 N THR A 68 4.418 4.733 1.143 1.00 0.00 N ATOM 1003 CA THR A 68 4.042 6.126 1.350 1.00 0.00 C ATOM 1004 C THR A 68 2.546 6.329 1.138 1.00 0.00 C ATOM 1005 O THR A 68 2.104 7.418 0.776 1.00 0.00 O ATOM 1006 CB THR A 68 4.815 7.063 0.402 1.00 0.00 C ATOM 1007 OG1 THR A 68 4.296 6.951 -0.928 1.00 0.00 O ATOM 1008 CG2 THR A 68 6.299 6.729 0.403 1.00 0.00 C ATOM 0 H THR A 68 4.286 4.398 0.189 1.00 0.00 H new ATOM 0 HA THR A 68 4.297 6.373 2.381 1.00 0.00 H new ATOM 0 HB THR A 68 4.689 8.086 0.755 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.931 6.456 -1.486 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.824 7.403 -0.273 1.00 0.00 H new ATOM 0 HG22 THR A 68 6.697 6.844 1.411 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.441 5.700 0.072 1.00 0.00 H new ATOM 1016 N GLU A 69 1.772 5.273 1.368 1.00 0.00 N ATOM 1017 CA GLU A 69 0.324 5.337 1.201 1.00 0.00 C ATOM 1018 C GLU A 69 -0.383 4.505 2.268 1.00 0.00 C ATOM 1019 O GLU A 69 0.059 3.408 2.609 1.00 0.00 O ATOM 1020 CB GLU A 69 -0.073 4.845 -0.192 1.00 0.00 C ATOM 1021 CG GLU A 69 -0.027 3.333 -0.340 1.00 0.00 C ATOM 1022 CD GLU A 69 -0.528 2.864 -1.692 1.00 0.00 C ATOM 1023 OE1 GLU A 69 -1.299 3.611 -2.331 1.00 0.00 O ATOM 1024 OE2 GLU A 69 -0.150 1.750 -2.111 1.00 0.00 O ATOM 0 H GLU A 69 2.122 4.364 1.670 1.00 0.00 H new ATOM 0 HA GLU A 69 0.016 6.377 1.312 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -1.081 5.193 -0.417 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.592 5.294 -0.930 1.00 0.00 H new ATOM 0 HG2 GLU A 69 0.997 2.989 -0.197 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.630 2.876 0.445 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.483 5.036 2.790 1.00 0.00 N ATOM 1032 CA ASP A 70 -2.253 4.344 3.817 1.00 0.00 C ATOM 1033 C ASP A 70 -2.958 3.122 3.236 1.00 0.00 C ATOM 1034 O ASP A 70 -4.057 3.227 2.691 1.00 0.00 O ATOM 1035 CB ASP A 70 -3.279 5.291 4.440 1.00 0.00 C ATOM 1036 CG ASP A 70 -3.937 6.190 3.412 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -3.333 7.222 3.053 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -5.057 5.862 2.967 1.00 0.00 O ATOM 0 H ASP A 70 -1.862 5.944 2.519 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.562 4.009 4.591 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -4.045 4.707 4.951 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.790 5.906 5.196 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.318 1.964 3.357 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.882 0.721 2.842 1.00 0.00 C ATOM 1045 C CYS A 71 -3.135 -0.270 3.973 1.00 0.00 C ATOM 1046 O CYS A 71 -2.753 -0.032 5.119 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.945 0.102 1.805 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.444 -0.624 2.506 1.00 0.00 S ATOM 0 H CYS A 71 -1.409 1.860 3.807 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.835 0.953 2.366 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.486 -0.669 1.256 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.662 0.868 1.083 1.00 0.00 H new ATOM 0 HG CYS A 71 0.087 -1.440 1.644 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.784 -1.383 3.644 1.00 0.00 N ATOM 1055 CA VAL A 72 -4.089 -2.411 4.632 1.00 0.00 C ATOM 1056 C VAL A 72 -3.652 -3.788 4.145 1.00 0.00 C ATOM 1057 O VAL A 72 -4.373 -4.453 3.401 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.594 -2.447 4.958 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.892 -3.533 5.981 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -6.063 -1.089 5.456 1.00 0.00 C ATOM 0 H VAL A 72 -4.109 -1.595 2.701 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.535 -2.156 5.536 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.141 -2.682 4.045 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.960 -3.544 6.199 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.594 -4.502 5.581 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.336 -3.332 6.897 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.129 -1.132 5.682 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.512 -0.822 6.358 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.885 -0.338 4.686 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.466 -4.211 4.570 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.931 -5.510 4.177 1.00 0.00 C ATOM 1072 C PHE A 73 -2.898 -6.630 4.549 1.00 0.00 C ATOM 1073 O PHE A 73 -3.663 -6.512 5.506 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.575 -5.749 4.843 1.00 0.00 C ATOM 1075 CG PHE A 73 0.142 -6.963 4.325 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.964 -6.877 3.213 1.00 0.00 C ATOM 1077 CD2 PHE A 73 -0.007 -8.191 4.949 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.623 -7.993 2.733 1.00 0.00 C ATOM 1079 CE2 PHE A 73 0.650 -9.310 4.474 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.467 -9.211 3.365 1.00 0.00 C ATOM 0 H PHE A 73 -1.857 -3.673 5.187 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.801 -5.510 3.095 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.055 -4.873 4.691 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.721 -5.854 5.918 1.00 0.00 H new ATOM 0 HD1 PHE A 73 1.091 -5.927 2.716 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -0.644 -8.275 5.817 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.260 -7.913 1.864 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.525 -10.261 4.970 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.983 -10.084 2.993 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.856 -7.717 3.785 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.727 -8.859 4.034 1.00 0.00 C ATOM 1092 C ILE A 74 -3.003 -10.172 3.759 1.00 0.00 C ATOM 1093 O ILE A 74 -2.792 -10.547 2.606 1.00 0.00 O ATOM 1094 CB ILE A 74 -4.999 -8.796 3.168 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.728 -7.468 3.388 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.915 -9.968 3.486 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.855 -7.228 2.409 1.00 0.00 C ATOM 0 H ILE A 74 -2.228 -7.831 2.989 1.00 0.00 H new ATOM 0 HA ILE A 74 -4.011 -8.816 5.086 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.710 -8.860 2.119 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -6.127 -7.446 4.402 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -5.010 -6.652 3.310 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.810 -9.909 2.866 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.393 -10.903 3.283 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.200 -9.932 4.538 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.326 -6.269 2.625 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.459 -7.218 1.394 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.594 -8.024 2.502 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.627 -10.868 4.826 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.926 -12.141 4.701 1.00 0.00 C ATOM 1111 C TYR A 75 -2.907 -13.279 4.437 1.00 0.00 C ATOM 1112 O TYR A 75 -3.419 -13.901 5.369 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.120 -12.430 5.968 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.050 -13.481 5.779 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.378 -14.767 5.366 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.288 -13.189 6.014 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.597 -15.731 5.192 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.268 -14.146 5.841 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.918 -15.416 5.430 1.00 0.00 C ATOM 1120 OH TYR A 75 2.892 -16.373 5.258 1.00 0.00 O ATOM 0 H TYR A 75 -2.796 -10.572 5.787 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.244 -12.070 3.854 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.653 -11.506 6.310 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.801 -12.754 6.755 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.412 -15.017 5.178 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.566 -12.197 6.337 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.326 -16.726 4.871 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.304 -13.902 6.026 1.00 0.00 H new ATOM 0 HH TYR A 75 3.249 -16.316 4.347 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.163 -13.547 3.162 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.082 -14.611 2.774 1.00 0.00 C ATOM 1132 C CYS A 76 -3.319 -15.862 2.351 1.00 0.00 C ATOM 1133 O CYS A 76 -2.271 -15.774 1.712 1.00 0.00 O ATOM 1134 CB CYS A 76 -4.987 -14.141 1.633 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.168 -15.387 1.066 1.00 0.00 S ATOM 0 H CYS A 76 -2.747 -13.042 2.379 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.698 -14.858 3.639 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.536 -13.258 1.959 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.364 -13.837 0.792 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.903 -14.888 0.117 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.851 -17.024 2.713 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.218 -18.293 2.373 1.00 0.00 C ATOM 1143 C GLN A 77 -4.069 -19.078 1.380 1.00 0.00 C ATOM 1144 O GLN A 77 -5.256 -19.310 1.612 1.00 0.00 O ATOM 1145 CB GLN A 77 -2.986 -19.126 3.635 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.107 -18.437 4.666 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.905 -17.602 5.648 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -3.173 -16.425 5.405 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.289 -18.208 6.765 1.00 0.00 N ATOM 0 H GLN A 77 -4.719 -17.114 3.242 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.257 -18.077 1.907 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -3.949 -19.359 4.089 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.528 -20.075 3.355 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.537 -19.188 5.213 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -1.385 -17.799 4.155 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.045 -19.185 6.925 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.829 -17.696 7.463 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.456 -19.482 0.272 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.158 -20.242 -0.756 1.00 0.00 C ATOM 1160 C VAL A 78 -4.630 -21.588 -0.219 1.00 0.00 C ATOM 1161 O VAL A 78 -5.805 -21.936 -0.332 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.264 -20.478 -1.987 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.951 -19.160 -2.680 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.984 -21.196 -1.587 1.00 0.00 C ATOM 0 H VAL A 78 -2.475 -19.296 0.063 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.023 -19.649 -1.052 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.804 -21.112 -2.690 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.318 -19.346 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.880 -18.689 -3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.431 -18.499 -1.987 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.365 -21.354 -2.470 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.438 -20.590 -0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.231 -22.159 -1.140 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.705 -22.343 0.368 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.047 -23.643 0.914 1.00 0.00 C ATOM 1176 C GLY A 79 -2.830 -24.526 1.112 1.00 0.00 C ATOM 1177 O GLY A 79 -1.721 -24.030 1.312 1.00 0.00 O ATOM 0 H GLY A 79 -2.726 -22.077 0.475 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.555 -23.510 1.869 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.749 -24.141 0.246 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.038 -25.837 1.058 1.00 0.00 N ATOM 1182 CA ASP A 80 -1.949 -26.791 1.234 1.00 0.00 C ATOM 1183 C ASP A 80 -1.129 -26.921 -0.046 1.00 0.00 C ATOM 1184 O ASP A 80 -1.497 -26.381 -1.090 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.502 -28.158 1.641 1.00 0.00 C ATOM 1186 CG ASP A 80 -3.544 -28.058 2.737 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -4.652 -27.553 2.459 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -3.252 -28.486 3.873 1.00 0.00 O ATOM 0 H ASP A 80 -3.950 -26.263 0.894 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.298 -26.420 2.026 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.941 -28.643 0.769 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.683 -28.792 1.980 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.014 -27.639 0.043 1.00 0.00 N ATOM 1194 CA LYS A 81 0.860 -27.840 -1.107 1.00 0.00 C ATOM 1195 C LYS A 81 0.115 -28.538 -2.241 1.00 0.00 C ATOM 1196 O LYS A 81 0.100 -28.077 -3.382 1.00 0.00 O ATOM 1197 CB LYS A 81 2.085 -28.664 -0.704 1.00 0.00 C ATOM 1198 CG LYS A 81 3.371 -28.208 -1.372 1.00 0.00 C ATOM 1199 CD LYS A 81 4.580 -28.476 -0.492 1.00 0.00 C ATOM 1200 CE LYS A 81 4.991 -29.939 -0.539 1.00 0.00 C ATOM 1201 NZ LYS A 81 4.276 -30.749 0.486 1.00 0.00 N ATOM 0 H LYS A 81 0.306 -28.091 0.900 1.00 0.00 H new ATOM 0 HA LYS A 81 1.187 -26.862 -1.459 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.209 -28.611 0.378 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.907 -29.710 -0.953 1.00 0.00 H new ATOM 0 HG2 LYS A 81 3.491 -28.725 -2.324 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.310 -27.142 -1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.413 -27.853 -0.817 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.353 -28.194 0.536 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.784 -30.343 -1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.066 -30.019 -0.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 4.962 -31.328 1.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 3.780 -30.116 1.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 3.586 -31.370 0.018 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.519 -29.676 -1.921 1.00 0.00 N ATOM 1216 CA PRO A 82 -1.280 -30.460 -2.899 1.00 0.00 C ATOM 1217 C PRO A 82 -2.558 -29.756 -3.339 1.00 0.00 C ATOM 1218 O PRO A 82 -3.187 -30.147 -4.323 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.612 -31.747 -2.140 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.592 -31.356 -0.703 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.544 -30.285 -0.580 1.00 0.00 C ATOM 0 HA PRO A 82 -0.716 -30.624 -3.817 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -2.587 -32.137 -2.430 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.881 -32.529 -2.348 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.567 -30.986 -0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.353 -32.210 -0.069 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.803 -29.556 0.188 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.426 -30.701 -0.310 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.938 -28.716 -2.605 1.00 0.00 N ATOM 1230 CA TYR A 83 -4.143 -27.958 -2.919 1.00 0.00 C ATOM 1231 C TYR A 83 -3.829 -26.802 -3.864 1.00 0.00 C ATOM 1232 O TYR A 83 -4.506 -26.612 -4.875 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.782 -27.423 -1.636 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.757 -26.291 -1.872 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.309 -24.990 -2.061 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -7.127 -26.524 -1.907 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -6.197 -23.953 -2.276 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -8.021 -25.494 -2.123 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.551 -24.210 -2.307 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.438 -23.180 -2.522 1.00 0.00 O ATOM 0 H TYR A 83 -2.429 -28.379 -1.788 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.845 -28.628 -3.415 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.300 -28.238 -1.131 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.995 -27.080 -0.964 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.249 -24.785 -2.040 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.499 -27.528 -1.763 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.832 -22.947 -2.419 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -9.082 -25.692 -2.148 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.353 -23.530 -2.515 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.799 -26.035 -3.528 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.394 -24.898 -4.347 1.00 0.00 C ATOM 1252 C TRP A 84 -2.209 -25.314 -5.802 1.00 0.00 C ATOM 1253 O TRP A 84 -2.747 -24.683 -6.712 1.00 0.00 O ATOM 1254 CB TRP A 84 -1.098 -24.291 -3.808 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.321 -23.533 -4.843 1.00 0.00 C ATOM 1256 CD1 TRP A 84 0.954 -23.788 -5.260 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.770 -22.397 -5.588 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.325 -22.878 -6.220 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.285 -22.014 -6.440 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -1.961 -21.666 -5.621 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.183 -20.934 -7.312 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.060 -20.593 -6.487 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -0.994 -20.236 -7.323 1.00 0.00 C ATOM 0 H TRP A 84 -2.229 -26.179 -2.695 1.00 0.00 H new ATOM 0 HA TRP A 84 -3.184 -24.149 -4.301 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -1.335 -23.623 -2.980 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.472 -25.087 -3.405 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.579 -24.587 -4.890 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.229 -22.850 -6.692 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.789 -21.935 -4.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 1.004 -20.657 -7.957 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -2.975 -20.020 -6.520 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.103 -19.393 -7.989 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.444 -26.379 -6.016 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.188 -26.880 -7.361 1.00 0.00 C ATOM 1276 C LYS A 85 -2.473 -26.911 -8.183 1.00 0.00 C ATOM 1277 O LYS A 85 -2.460 -26.631 -9.382 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.577 -28.282 -7.297 1.00 0.00 C ATOM 1279 CG LYS A 85 0.722 -28.344 -6.513 1.00 0.00 C ATOM 1280 CD LYS A 85 1.926 -28.108 -7.408 1.00 0.00 C ATOM 1281 CE LYS A 85 3.217 -28.541 -6.732 1.00 0.00 C ATOM 1282 NZ LYS A 85 4.414 -27.942 -7.385 1.00 0.00 N ATOM 0 H LYS A 85 -0.990 -26.912 -5.274 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.483 -26.205 -7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.298 -28.963 -6.844 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.397 -28.637 -8.312 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.705 -27.596 -5.720 1.00 0.00 H new ATOM 0 HG3 LYS A 85 0.811 -29.318 -6.031 1.00 0.00 H new ATOM 0 HD2 LYS A 85 1.800 -28.658 -8.341 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.987 -27.051 -7.667 1.00 0.00 H new ATOM 0 HE2 LYS A 85 3.192 -28.250 -5.682 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.294 -29.628 -6.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 5.274 -28.262 -6.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.452 -28.240 -8.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.353 -26.905 -7.336 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.579 -27.252 -7.532 1.00 0.00 N ATOM 1297 CA ASP A 86 -4.872 -27.317 -8.203 1.00 0.00 C ATOM 1298 C ASP A 86 -5.071 -26.111 -9.116 1.00 0.00 C ATOM 1299 O ASP A 86 -5.230 -24.977 -8.663 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.002 -27.384 -7.173 1.00 0.00 C ATOM 1301 CG ASP A 86 -5.762 -28.449 -6.121 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.821 -29.251 -6.292 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.517 -28.480 -5.126 1.00 0.00 O ATOM 0 H ASP A 86 -3.606 -27.488 -6.540 1.00 0.00 H new ATOM 0 HA ASP A 86 -4.892 -28.220 -8.813 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.105 -26.414 -6.687 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.944 -27.587 -7.683 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.062 -26.359 -10.434 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.240 -25.307 -11.439 1.00 0.00 C ATOM 1310 C PRO A 87 -6.661 -24.753 -11.454 1.00 0.00 C ATOM 1311 O PRO A 87 -6.900 -23.644 -11.929 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.930 -26.020 -12.758 1.00 0.00 C ATOM 1313 CG PRO A 87 -5.223 -27.456 -12.490 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.878 -27.686 -11.045 1.00 0.00 C ATOM 0 HA PRO A 87 -4.602 -24.445 -11.244 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.546 -25.635 -13.570 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.890 -25.876 -13.051 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.272 -27.683 -12.682 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.633 -28.103 -13.140 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.530 -28.432 -10.590 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.855 -28.044 -10.928 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.600 -25.534 -10.930 1.00 0.00 N ATOM 1323 CA ASN A 88 -8.998 -25.121 -10.884 1.00 0.00 C ATOM 1324 C ASN A 88 -9.305 -24.386 -9.583 1.00 0.00 C ATOM 1325 O ASN A 88 -10.429 -24.429 -9.083 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.916 -26.337 -11.024 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.816 -26.982 -12.393 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -10.710 -26.834 -13.227 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -8.726 -27.702 -12.630 1.00 0.00 N ATOM 0 H ASN A 88 -7.419 -26.455 -10.532 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.177 -24.441 -11.717 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.661 -27.071 -10.260 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.947 -26.033 -10.843 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.604 -28.160 -13.533 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.011 -27.797 -11.909 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.298 -23.710 -9.039 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.460 -22.964 -7.796 1.00 0.00 C ATOM 1338 C ASN A 89 -9.026 -21.574 -8.066 1.00 0.00 C ATOM 1339 O ASN A 89 -8.801 -20.996 -9.130 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.119 -22.849 -7.068 1.00 0.00 C ATOM 1341 CG ASN A 89 -6.880 -24.000 -6.111 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -7.816 -24.688 -5.704 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -5.621 -24.214 -5.746 1.00 0.00 N ATOM 0 H ASN A 89 -7.361 -23.663 -9.439 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.163 -23.506 -7.164 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.313 -22.816 -7.801 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.087 -21.909 -6.517 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.399 -24.974 -5.103 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -4.877 -23.618 -6.109 1.00 0.00 H new ATOM 1350 N ASP A 90 -9.761 -21.042 -7.095 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.359 -19.719 -7.226 1.00 0.00 C ATOM 1352 C ASP A 90 -9.282 -18.640 -7.294 1.00 0.00 C ATOM 1353 O ASP A 90 -9.553 -17.501 -7.674 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.302 -19.443 -6.054 1.00 0.00 C ATOM 1355 CG ASP A 90 -10.816 -20.067 -4.761 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -11.126 -21.253 -4.522 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -10.125 -19.370 -3.988 1.00 0.00 O ATOM 0 H ASP A 90 -9.957 -21.507 -6.209 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.930 -19.696 -8.154 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -11.403 -18.366 -5.919 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -12.293 -19.829 -6.290 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.060 -19.007 -6.921 1.00 0.00 N ATOM 1363 CA PHE A 91 -6.943 -18.071 -6.937 1.00 0.00 C ATOM 1364 C PHE A 91 -6.400 -17.896 -8.352 1.00 0.00 C ATOM 1365 O PHE A 91 -6.207 -16.774 -8.820 1.00 0.00 O ATOM 1366 CB PHE A 91 -5.829 -18.558 -6.008 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.213 -18.551 -4.556 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.025 -17.418 -3.781 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.764 -19.677 -3.967 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.377 -17.410 -2.445 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -7.119 -19.675 -2.631 1.00 0.00 C ATOM 1372 CZ PHE A 91 -6.926 -18.539 -1.869 1.00 0.00 C ATOM 0 H PHE A 91 -7.819 -19.946 -6.604 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.305 -17.106 -6.584 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.544 -19.570 -6.295 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.950 -17.928 -6.146 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.599 -16.531 -4.226 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.918 -20.567 -4.559 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.223 -16.521 -1.851 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.547 -20.560 -2.184 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.204 -18.534 -0.825 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.155 -19.014 -9.028 1.00 0.00 N ATOM 1383 CA ARG A 92 -5.632 -18.985 -10.389 1.00 0.00 C ATOM 1384 C ARG A 92 -6.751 -18.734 -11.395 1.00 0.00 C ATOM 1385 O ARG A 92 -6.495 -18.508 -12.578 1.00 0.00 O ATOM 1386 CB ARG A 92 -4.926 -20.303 -10.714 1.00 0.00 C ATOM 1387 CG ARG A 92 -3.900 -20.717 -9.672 1.00 0.00 C ATOM 1388 CD ARG A 92 -3.615 -22.210 -9.735 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.249 -22.523 -9.324 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.177 -22.228 -10.052 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.312 -21.616 -11.220 1.00 0.00 N ATOM 1392 NH2 ARG A 92 0.034 -22.546 -9.611 1.00 0.00 N ATOM 0 H ARG A 92 -6.310 -19.951 -8.656 1.00 0.00 H new ATOM 0 HA ARG A 92 -4.913 -18.168 -10.459 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -5.673 -21.091 -10.810 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.432 -20.212 -11.682 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.975 -20.162 -9.829 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.263 -20.456 -8.678 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.318 -22.741 -9.093 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.779 -22.568 -10.751 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.110 -22.994 -8.430 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.241 -21.370 -11.563 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.487 -21.391 -11.776 1.00 0.00 H new ATOM 0 HH21 ARG A 92 0.142 -23.017 -8.713 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.856 -22.319 -10.170 1.00 0.00 H new ATOM 1406 N GLN A 93 -7.991 -18.775 -10.917 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.148 -18.552 -11.776 1.00 0.00 C ATOM 1408 C GLN A 93 -9.664 -17.124 -11.635 1.00 0.00 C ATOM 1409 O GLN A 93 -10.092 -16.508 -12.611 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.261 -19.545 -11.436 1.00 0.00 C ATOM 1411 CG GLN A 93 -9.869 -20.997 -11.658 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.162 -21.471 -13.068 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.267 -21.287 -13.580 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.171 -22.084 -13.704 1.00 0.00 N ATOM 0 H GLN A 93 -8.220 -18.960 -9.940 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.837 -18.706 -12.809 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -10.551 -19.411 -10.394 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.138 -19.317 -12.042 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -8.806 -21.118 -11.452 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.405 -21.627 -10.948 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.272 -22.215 -13.241 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.309 -22.424 -14.656 1.00 0.00 H new ATOM 1423 N LYS A 94 -9.620 -16.602 -10.414 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.082 -15.246 -10.144 1.00 0.00 C ATOM 1425 C LYS A 94 -8.905 -14.282 -10.033 1.00 0.00 C ATOM 1426 O LYS A 94 -8.852 -13.268 -10.729 1.00 0.00 O ATOM 1427 CB LYS A 94 -10.906 -15.213 -8.854 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.012 -16.253 -8.812 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.075 -15.895 -7.787 1.00 0.00 C ATOM 1430 CE LYS A 94 -13.962 -17.088 -7.465 1.00 0.00 C ATOM 1431 NZ LYS A 94 -15.020 -16.741 -6.475 1.00 0.00 N ATOM 0 H LYS A 94 -9.269 -17.098 -9.595 1.00 0.00 H new ATOM 0 HA LYS A 94 -10.710 -14.930 -10.977 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.241 -15.367 -8.004 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.346 -14.222 -8.739 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.470 -16.339 -9.798 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.587 -17.228 -8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.597 -15.539 -6.875 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -13.687 -15.077 -8.166 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.427 -17.453 -8.381 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.350 -17.900 -7.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -15.603 -17.580 -6.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -14.576 -16.417 -5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.620 -15.983 -6.859 1.00 0.00 H new ATOM 1445 N LEU A 95 -7.963 -14.606 -9.155 1.00 0.00 N ATOM 1446 CA LEU A 95 -6.784 -13.769 -8.953 1.00 0.00 C ATOM 1447 C LEU A 95 -5.724 -14.060 -10.010 1.00 0.00 C ATOM 1448 O LEU A 95 -4.787 -13.283 -10.196 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.205 -13.998 -7.556 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.091 -13.573 -6.385 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -6.549 -14.128 -5.077 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.197 -12.056 -6.319 1.00 0.00 C ATOM 0 H LEU A 95 -7.992 -15.442 -8.571 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.088 -12.726 -9.046 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -5.978 -15.059 -7.448 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.259 -13.461 -7.484 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.089 -13.981 -6.543 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.192 -13.815 -4.255 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.526 -15.217 -5.126 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.540 -13.750 -4.912 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -7.831 -11.772 -5.479 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.204 -11.627 -6.185 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -7.632 -11.681 -7.246 1.00 0.00 H new ATOM 1464 N LYS A 96 -5.878 -15.183 -10.703 1.00 0.00 N ATOM 1465 CA LYS A 96 -4.936 -15.576 -11.744 1.00 0.00 C ATOM 1466 C LYS A 96 -3.513 -15.633 -11.197 1.00 0.00 C ATOM 1467 O LYS A 96 -2.576 -15.141 -11.827 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.004 -14.597 -12.918 1.00 0.00 C ATOM 1469 CG LYS A 96 -6.412 -14.372 -13.442 1.00 0.00 C ATOM 1470 CD LYS A 96 -6.939 -15.599 -14.166 1.00 0.00 C ATOM 1471 CE LYS A 96 -8.027 -15.233 -15.164 1.00 0.00 C ATOM 1472 NZ LYS A 96 -7.489 -14.441 -16.305 1.00 0.00 N ATOM 0 H LYS A 96 -6.647 -15.838 -10.562 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.212 -16.571 -12.092 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -4.584 -13.640 -12.607 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -4.379 -14.971 -13.729 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.075 -14.125 -12.613 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -6.417 -13.518 -14.120 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.120 -16.096 -14.685 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.334 -16.310 -13.440 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -8.494 -16.142 -15.542 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -8.805 -14.660 -14.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -8.113 -14.552 -17.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -7.443 -13.437 -16.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -6.535 -14.780 -16.544 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.358 -16.237 -10.024 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.049 -16.360 -9.395 1.00 0.00 C ATOM 1488 C ILE A 97 -1.128 -17.257 -10.215 1.00 0.00 C ATOM 1489 O ILE A 97 -1.429 -18.429 -10.448 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.161 -16.926 -7.968 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.155 -16.103 -7.145 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -0.796 -16.944 -7.296 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -3.119 -14.624 -7.460 1.00 0.00 C ATOM 0 H ILE A 97 -4.123 -16.649 -9.490 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.627 -15.356 -9.346 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.528 -17.950 -8.028 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.162 -16.480 -7.323 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.944 -16.246 -6.085 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -0.892 -17.347 -6.288 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.115 -17.569 -7.873 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.402 -15.929 -7.245 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.848 -14.102 -6.841 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.123 -14.232 -7.255 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.360 -14.470 -8.512 1.00 0.00 H new ATOM 1505 N THR A 98 -0.002 -16.700 -10.649 1.00 0.00 N ATOM 1506 CA THR A 98 0.965 -17.449 -11.443 1.00 0.00 C ATOM 1507 C THR A 98 1.786 -18.388 -10.566 1.00 0.00 C ATOM 1508 O THR A 98 1.910 -19.577 -10.860 1.00 0.00 O ATOM 1509 CB THR A 98 1.920 -16.508 -12.201 1.00 0.00 C ATOM 1510 OG1 THR A 98 2.839 -17.272 -12.989 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.689 -15.622 -11.232 1.00 0.00 C ATOM 0 H THR A 98 0.263 -15.733 -10.464 1.00 0.00 H new ATOM 0 HA THR A 98 0.395 -18.034 -12.165 1.00 0.00 H new ATOM 0 HB THR A 98 1.324 -15.872 -12.855 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.441 -16.666 -13.469 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.357 -14.966 -11.790 1.00 0.00 H new ATOM 0 HG22 THR A 98 1.988 -15.019 -10.655 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.274 -16.245 -10.555 1.00 0.00 H new ATOM 1519 N ALA A 99 2.343 -17.847 -9.488 1.00 0.00 N ATOM 1520 CA ALA A 99 3.150 -18.638 -8.566 1.00 0.00 C ATOM 1521 C ALA A 99 3.246 -17.963 -7.203 1.00 0.00 C ATOM 1522 O ALA A 99 3.540 -16.771 -7.108 1.00 0.00 O ATOM 1523 CB ALA A 99 4.539 -18.867 -9.144 1.00 0.00 C ATOM 0 H ALA A 99 2.251 -16.864 -9.231 1.00 0.00 H new ATOM 0 HA ALA A 99 2.662 -19.603 -8.430 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.131 -19.459 -8.446 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.456 -19.400 -10.091 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.027 -17.907 -9.310 1.00 0.00 H new ATOM 1529 N VAL A 100 2.996 -18.732 -6.148 1.00 0.00 N ATOM 1530 CA VAL A 100 3.055 -18.208 -4.788 1.00 0.00 C ATOM 1531 C VAL A 100 4.470 -18.297 -4.226 1.00 0.00 C ATOM 1532 O VAL A 100 5.255 -19.173 -4.589 1.00 0.00 O ATOM 1533 CB VAL A 100 2.095 -18.966 -3.853 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.651 -18.744 -4.276 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.431 -20.449 -3.832 1.00 0.00 C ATOM 0 H VAL A 100 2.751 -19.720 -6.209 1.00 0.00 H new ATOM 0 HA VAL A 100 2.752 -17.162 -4.838 1.00 0.00 H new ATOM 0 HB VAL A 100 2.217 -18.575 -2.843 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.013 -19.287 -3.604 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.419 -17.680 -4.233 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.511 -19.105 -5.295 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.742 -20.969 -3.166 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.340 -20.857 -4.839 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.452 -20.586 -3.476 1.00 0.00 H new ATOM 1545 N PRO A 101 4.805 -17.369 -3.318 1.00 0.00 N ATOM 1546 CA PRO A 101 3.879 -16.321 -2.879 1.00 0.00 C ATOM 1547 C PRO A 101 3.605 -15.293 -3.972 1.00 0.00 C ATOM 1548 O PRO A 101 4.480 -14.986 -4.783 1.00 0.00 O ATOM 1549 CB PRO A 101 4.612 -15.669 -1.704 1.00 0.00 C ATOM 1550 CG PRO A 101 6.055 -15.934 -1.964 1.00 0.00 C ATOM 1551 CD PRO A 101 6.113 -17.270 -2.650 1.00 0.00 C ATOM 0 HA PRO A 101 2.901 -16.725 -2.618 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.408 -14.599 -1.655 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.296 -16.098 -0.753 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.488 -15.154 -2.591 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.623 -15.948 -1.034 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.934 -17.319 -3.365 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.262 -18.081 -1.937 1.00 0.00 H new ATOM 1559 N THR A 102 2.386 -14.763 -3.989 1.00 0.00 N ATOM 1560 CA THR A 102 1.997 -13.771 -4.983 1.00 0.00 C ATOM 1561 C THR A 102 1.477 -12.502 -4.318 1.00 0.00 C ATOM 1562 O THR A 102 0.386 -12.491 -3.745 1.00 0.00 O ATOM 1563 CB THR A 102 0.916 -14.321 -5.932 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.451 -15.395 -6.714 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.398 -13.226 -6.853 1.00 0.00 C ATOM 0 H THR A 102 1.651 -15.005 -3.325 1.00 0.00 H new ATOM 0 HA THR A 102 2.890 -13.535 -5.561 1.00 0.00 H new ATOM 0 HB THR A 102 0.087 -14.690 -5.328 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.384 -15.551 -6.460 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.365 -13.637 -7.514 1.00 0.00 H new ATOM 0 HG22 THR A 102 -0.034 -12.423 -6.256 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.221 -12.832 -7.449 1.00 0.00 H new ATOM 1573 N LEU A 103 2.261 -11.433 -4.399 1.00 0.00 N ATOM 1574 CA LEU A 103 1.878 -10.157 -3.805 1.00 0.00 C ATOM 1575 C LEU A 103 1.178 -9.268 -4.828 1.00 0.00 C ATOM 1576 O LEU A 103 1.825 -8.631 -5.660 1.00 0.00 O ATOM 1577 CB LEU A 103 3.110 -9.440 -3.250 1.00 0.00 C ATOM 1578 CG LEU A 103 2.845 -8.143 -2.485 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.149 -8.434 -1.165 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.144 -7.386 -2.251 1.00 0.00 C ATOM 0 H LEU A 103 3.166 -11.424 -4.870 1.00 0.00 H new ATOM 0 HA LEU A 103 1.183 -10.359 -2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.638 -10.127 -2.588 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.781 -9.218 -4.080 1.00 0.00 H new ATOM 0 HG LEU A 103 2.187 -7.517 -3.088 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.969 -7.499 -0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.198 -8.931 -1.357 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.780 -9.081 -0.556 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.936 -6.466 -1.705 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.827 -8.006 -1.670 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.602 -7.143 -3.210 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.148 -9.230 -4.761 1.00 0.00 N ATOM 1593 CA LEU A 104 -0.938 -8.418 -5.680 1.00 0.00 C ATOM 1594 C LEU A 104 -1.374 -7.115 -5.018 1.00 0.00 C ATOM 1595 O LEU A 104 -1.953 -7.121 -3.931 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.165 -9.197 -6.156 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.343 -8.358 -6.651 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -2.976 -7.626 -7.933 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.568 -9.234 -6.868 1.00 0.00 C ATOM 0 H LEU A 104 -0.699 -9.752 -4.080 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.314 -8.176 -6.540 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.857 -9.864 -6.961 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.512 -9.826 -5.336 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.581 -7.616 -5.889 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.827 -7.034 -8.270 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.127 -6.968 -7.746 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.710 -8.351 -8.703 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.397 -8.620 -7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.342 -9.999 -7.611 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.845 -9.712 -5.928 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.095 -5.998 -5.682 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.462 -4.686 -5.161 1.00 0.00 C ATOM 1613 C LYS A 105 -2.856 -4.284 -5.631 1.00 0.00 C ATOM 1614 O LYS A 105 -3.017 -3.721 -6.714 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.440 -3.636 -5.602 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.739 -2.240 -5.082 1.00 0.00 C ATOM 1617 CD LYS A 105 0.372 -1.265 -5.432 1.00 0.00 C ATOM 1618 CE LYS A 105 0.040 0.147 -4.972 1.00 0.00 C ATOM 1619 NZ LYS A 105 0.703 1.176 -5.819 1.00 0.00 N ATOM 0 H LYS A 105 -0.616 -5.975 -6.582 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.468 -4.743 -4.073 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.550 -3.938 -5.259 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.406 -3.609 -6.691 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.680 -1.887 -5.504 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -0.868 -2.274 -4.000 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.303 -1.591 -4.968 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.535 -1.269 -6.510 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -1.040 0.294 -5.000 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.352 0.274 -3.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 0.452 2.124 -5.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 1.735 1.052 -5.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 0.386 1.071 -6.804 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.859 -4.575 -4.811 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.239 -4.244 -5.144 1.00 0.00 C ATOM 1635 C TYR A 106 -5.349 -2.808 -5.648 1.00 0.00 C ATOM 1636 O TYR A 106 -5.032 -1.860 -4.930 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.141 -4.438 -3.924 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.566 -4.800 -4.276 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.842 -5.770 -5.231 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.638 -4.172 -3.651 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.143 -6.103 -5.557 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -9.941 -4.500 -3.969 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.189 -5.466 -4.922 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.486 -5.796 -5.242 1.00 0.00 O ATOM 0 H TYR A 106 -3.742 -5.040 -3.910 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.565 -4.915 -5.939 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.721 -5.222 -3.293 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.143 -3.521 -3.335 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.025 -6.273 -5.728 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.448 -3.415 -2.904 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.340 -6.857 -6.304 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.762 -4.003 -3.474 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.103 -5.257 -4.704 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.801 -2.656 -6.889 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.946 -1.334 -7.469 1.00 0.00 C ATOM 1656 C GLY A 107 -5.052 -1.129 -8.676 1.00 0.00 C ATOM 1657 O GLY A 107 -5.444 -0.482 -9.648 1.00 0.00 O ATOM 0 H GLY A 107 -6.069 -3.425 -7.503 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.985 -1.180 -7.760 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.712 -0.582 -6.715 1.00 0.00 H new ATOM 1661 N THR A 108 -3.844 -1.681 -8.616 1.00 0.00 N ATOM 1662 CA THR A 108 -2.890 -1.554 -9.711 1.00 0.00 C ATOM 1663 C THR A 108 -2.419 -2.922 -10.192 1.00 0.00 C ATOM 1664 O THR A 108 -2.358 -3.887 -9.430 1.00 0.00 O ATOM 1665 CB THR A 108 -1.665 -0.719 -9.295 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.014 -1.328 -8.174 1.00 0.00 O ATOM 1667 CG2 THR A 108 -2.075 0.702 -8.938 1.00 0.00 C ATOM 0 H THR A 108 -3.503 -2.221 -7.820 1.00 0.00 H new ATOM 0 HA THR A 108 -3.408 -1.045 -10.524 1.00 0.00 H new ATOM 0 HB THR A 108 -0.976 -0.681 -10.139 1.00 0.00 H new ATOM 0 HG1 THR A 108 -1.505 -2.134 -7.909 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.193 1.273 -8.647 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.544 1.173 -9.802 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.782 0.679 -8.109 1.00 0.00 H new ATOM 1675 N PRO A 109 -2.077 -3.010 -11.485 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.603 -4.255 -12.096 1.00 0.00 C ATOM 1677 C PRO A 109 -0.217 -4.653 -11.601 1.00 0.00 C ATOM 1678 O PRO A 109 0.334 -5.669 -12.025 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.563 -3.925 -13.590 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.394 -2.446 -13.647 1.00 0.00 C ATOM 1681 CD PRO A 109 -2.125 -1.900 -12.452 1.00 0.00 C ATOM 0 HA PRO A 109 -2.246 -5.100 -11.849 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.739 -4.437 -14.087 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.480 -4.238 -14.089 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.339 -2.172 -13.618 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.803 -2.042 -14.573 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.642 -1.005 -12.060 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.151 -1.627 -12.699 1.00 0.00 H new ATOM 1689 N GLN A 110 0.340 -3.847 -10.703 1.00 0.00 N ATOM 1690 CA GLN A 110 1.662 -4.117 -10.152 1.00 0.00 C ATOM 1691 C GLN A 110 1.610 -5.264 -9.149 1.00 0.00 C ATOM 1692 O GLN A 110 0.919 -5.185 -8.133 1.00 0.00 O ATOM 1693 CB GLN A 110 2.223 -2.862 -9.480 1.00 0.00 C ATOM 1694 CG GLN A 110 2.937 -1.925 -10.441 1.00 0.00 C ATOM 1695 CD GLN A 110 3.957 -1.044 -9.747 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.127 -1.011 -10.128 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.517 -0.323 -8.722 1.00 0.00 N ATOM 0 H GLN A 110 -0.103 -3.002 -10.342 1.00 0.00 H new ATOM 0 HA GLN A 110 2.318 -4.406 -10.973 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.408 -2.323 -8.998 1.00 0.00 H new ATOM 0 HB3 GLN A 110 2.916 -3.160 -8.694 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.435 -2.512 -11.213 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.202 -1.297 -10.943 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.538 -0.381 -8.440 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.158 0.289 -8.217 1.00 0.00 H new ATOM 1706 N LYS A 111 2.346 -6.332 -9.440 1.00 0.00 N ATOM 1707 CA LYS A 111 2.385 -7.497 -8.564 1.00 0.00 C ATOM 1708 C LYS A 111 3.807 -8.035 -8.437 1.00 0.00 C ATOM 1709 O LYS A 111 4.658 -7.773 -9.288 1.00 0.00 O ATOM 1710 CB LYS A 111 1.459 -8.593 -9.097 1.00 0.00 C ATOM 1711 CG LYS A 111 1.708 -8.944 -10.554 1.00 0.00 C ATOM 1712 CD LYS A 111 2.735 -10.056 -10.692 1.00 0.00 C ATOM 1713 CE LYS A 111 2.079 -11.427 -10.658 1.00 0.00 C ATOM 1714 NZ LYS A 111 1.230 -11.666 -11.859 1.00 0.00 N ATOM 0 H LYS A 111 2.924 -6.414 -10.276 1.00 0.00 H new ATOM 0 HA LYS A 111 2.042 -7.189 -7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.584 -9.489 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.424 -8.271 -8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.772 -9.252 -11.020 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.054 -8.059 -11.088 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.280 -9.935 -11.628 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.465 -9.981 -9.886 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.849 -12.196 -10.598 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.469 -11.516 -9.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.148 -12.689 -12.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.284 -11.265 -11.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.665 -11.211 -12.687 1.00 0.00 H new ATOM 1728 N LEU A 112 4.057 -8.787 -7.372 1.00 0.00 N ATOM 1729 CA LEU A 112 5.376 -9.364 -7.135 1.00 0.00 C ATOM 1730 C LEU A 112 5.278 -10.866 -6.893 1.00 0.00 C ATOM 1731 O LEU A 112 4.579 -11.316 -5.985 1.00 0.00 O ATOM 1732 CB LEU A 112 6.043 -8.685 -5.936 1.00 0.00 C ATOM 1733 CG LEU A 112 6.122 -7.159 -5.987 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.649 -6.608 -4.672 1.00 0.00 C ATOM 1735 CD2 LEU A 112 7.000 -6.709 -7.146 1.00 0.00 C ATOM 0 H LEU A 112 3.364 -9.012 -6.658 1.00 0.00 H new ATOM 0 HA LEU A 112 5.984 -9.197 -8.024 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.501 -8.971 -5.034 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.055 -9.078 -5.838 1.00 0.00 H new ATOM 0 HG LEU A 112 5.117 -6.767 -6.145 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.698 -5.521 -4.727 1.00 0.00 H new ATOM 0 HD12 LEU A 112 5.982 -6.900 -3.861 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.646 -7.007 -4.483 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.045 -5.620 -7.167 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.005 -7.111 -7.019 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.580 -7.073 -8.084 1.00 0.00 H new ATOM 1747 N VAL A 113 5.986 -11.639 -7.711 1.00 0.00 N ATOM 1748 CA VAL A 113 5.982 -13.092 -7.585 1.00 0.00 C ATOM 1749 C VAL A 113 7.071 -13.563 -6.628 1.00 0.00 C ATOM 1750 O VAL A 113 7.866 -12.764 -6.135 1.00 0.00 O ATOM 1751 CB VAL A 113 6.182 -13.775 -8.951 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.446 -15.105 -8.996 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.719 -12.861 -10.076 1.00 0.00 C ATOM 0 H VAL A 113 6.570 -11.283 -8.468 1.00 0.00 H new ATOM 0 HA VAL A 113 5.007 -13.373 -7.187 1.00 0.00 H new ATOM 0 HB VAL A 113 7.245 -13.971 -9.088 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.599 -15.573 -9.969 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.830 -15.760 -8.214 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.381 -14.937 -8.838 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.867 -13.359 -11.034 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.661 -12.632 -9.946 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.296 -11.937 -10.055 1.00 0.00 H new ATOM 1763 N GLU A 114 7.102 -14.867 -6.371 1.00 0.00 N ATOM 1764 CA GLU A 114 8.094 -15.445 -5.473 1.00 0.00 C ATOM 1765 C GLU A 114 9.409 -14.674 -5.547 1.00 0.00 C ATOM 1766 O GLU A 114 9.916 -14.191 -4.534 1.00 0.00 O ATOM 1767 CB GLU A 114 8.333 -16.916 -5.820 1.00 0.00 C ATOM 1768 CG GLU A 114 7.061 -17.679 -6.146 1.00 0.00 C ATOM 1769 CD GLU A 114 7.266 -19.182 -6.149 1.00 0.00 C ATOM 1770 OE1 GLU A 114 7.904 -19.696 -5.207 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.788 -19.843 -7.095 1.00 0.00 O ATOM 0 H GLU A 114 6.452 -15.543 -6.772 1.00 0.00 H new ATOM 0 HA GLU A 114 7.709 -15.377 -4.456 1.00 0.00 H new ATOM 0 HB2 GLU A 114 9.010 -16.974 -6.672 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.833 -17.402 -4.982 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.291 -17.423 -5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.693 -17.364 -7.123 1.00 0.00 H new ATOM 1778 N SER A 115 9.956 -14.563 -6.753 1.00 0.00 N ATOM 1779 CA SER A 115 11.214 -13.854 -6.959 1.00 0.00 C ATOM 1780 C SER A 115 11.088 -12.392 -6.544 1.00 0.00 C ATOM 1781 O SER A 115 11.900 -11.883 -5.772 1.00 0.00 O ATOM 1782 CB SER A 115 11.640 -13.945 -8.426 1.00 0.00 C ATOM 1783 OG SER A 115 13.051 -13.889 -8.551 1.00 0.00 O ATOM 0 H SER A 115 9.548 -14.955 -7.602 1.00 0.00 H new ATOM 0 HA SER A 115 11.975 -14.325 -6.337 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.270 -14.875 -8.859 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.189 -13.129 -8.990 1.00 0.00 H new ATOM 0 HG SER A 115 13.298 -13.951 -9.497 1.00 0.00 H new ATOM 1789 N GLU A 116 10.064 -11.722 -7.063 1.00 0.00 N ATOM 1790 CA GLU A 116 9.832 -10.317 -6.747 1.00 0.00 C ATOM 1791 C GLU A 116 9.395 -10.151 -5.295 1.00 0.00 C ATOM 1792 O GLU A 116 9.308 -9.033 -4.785 1.00 0.00 O ATOM 1793 CB GLU A 116 8.771 -9.730 -7.681 1.00 0.00 C ATOM 1794 CG GLU A 116 9.082 -9.926 -9.155 1.00 0.00 C ATOM 1795 CD GLU A 116 8.222 -9.059 -10.053 1.00 0.00 C ATOM 1796 OE1 GLU A 116 8.586 -7.884 -10.268 1.00 0.00 O ATOM 1797 OE2 GLU A 116 7.184 -9.555 -10.541 1.00 0.00 O ATOM 0 H GLU A 116 9.382 -12.129 -7.704 1.00 0.00 H new ATOM 0 HA GLU A 116 10.769 -9.779 -6.890 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.808 -10.189 -7.457 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.670 -8.664 -7.478 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.133 -9.698 -9.334 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.934 -10.973 -9.418 1.00 0.00 H new ATOM 1804 N CYS A 117 9.121 -11.271 -4.634 1.00 0.00 N ATOM 1805 CA CYS A 117 8.691 -11.250 -3.240 1.00 0.00 C ATOM 1806 C CYS A 117 9.887 -11.369 -2.301 1.00 0.00 C ATOM 1807 O CYS A 117 9.792 -11.047 -1.116 1.00 0.00 O ATOM 1808 CB CYS A 117 7.703 -12.387 -2.973 1.00 0.00 C ATOM 1809 SG CYS A 117 6.080 -12.147 -3.732 1.00 0.00 S ATOM 0 H CYS A 117 9.189 -12.204 -5.041 1.00 0.00 H new ATOM 0 HA CYS A 117 8.197 -10.297 -3.051 1.00 0.00 H new ATOM 0 HB2 CYS A 117 8.130 -13.320 -3.342 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.576 -12.498 -1.896 1.00 0.00 H new ATOM 0 HG CYS A 117 5.582 -13.301 -4.065 1.00 0.00 H new ATOM 1815 N CYS A 118 11.010 -11.832 -2.837 1.00 0.00 N ATOM 1816 CA CYS A 118 12.225 -11.995 -2.046 1.00 0.00 C ATOM 1817 C CYS A 118 13.221 -10.880 -2.344 1.00 0.00 C ATOM 1818 O CYS A 118 14.279 -10.797 -1.720 1.00 0.00 O ATOM 1819 CB CYS A 118 12.864 -13.356 -2.329 1.00 0.00 C ATOM 1820 SG CYS A 118 14.478 -13.590 -1.549 1.00 0.00 S ATOM 0 H CYS A 118 11.105 -12.101 -3.816 1.00 0.00 H new ATOM 0 HA CYS A 118 11.953 -11.942 -0.992 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.189 -14.140 -1.986 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.972 -13.478 -3.407 1.00 0.00 H new ATOM 0 HG CYS A 118 15.013 -12.431 -1.302 1.00 0.00 H new ATOM 1826 N GLN A 119 12.876 -10.025 -3.302 1.00 0.00 N ATOM 1827 CA GLN A 119 13.743 -8.916 -3.683 1.00 0.00 C ATOM 1828 C GLN A 119 13.314 -7.627 -2.990 1.00 0.00 C ATOM 1829 O GLN A 119 12.489 -6.876 -3.509 1.00 0.00 O ATOM 1830 CB GLN A 119 13.722 -8.724 -5.201 1.00 0.00 C ATOM 1831 CG GLN A 119 14.743 -9.578 -5.936 1.00 0.00 C ATOM 1832 CD GLN A 119 14.981 -10.913 -5.260 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.663 -10.992 -4.237 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.420 -11.974 -5.829 1.00 0.00 N ATOM 0 H GLN A 119 12.004 -10.079 -3.828 1.00 0.00 H new ATOM 0 HA GLN A 119 14.758 -9.156 -3.368 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.726 -8.961 -5.575 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.907 -7.674 -5.429 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.401 -9.748 -6.957 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.686 -9.035 -6.001 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.863 -11.863 -6.676 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.546 -12.899 -5.419 1.00 0.00 H new ATOM 1843 N SER A 120 13.880 -7.377 -1.813 1.00 0.00 N ATOM 1844 CA SER A 120 13.553 -6.181 -1.046 1.00 0.00 C ATOM 1845 C SER A 120 13.495 -4.954 -1.951 1.00 0.00 C ATOM 1846 O SER A 120 12.603 -4.116 -1.824 1.00 0.00 O ATOM 1847 CB SER A 120 14.584 -5.963 0.063 1.00 0.00 C ATOM 1848 OG SER A 120 15.840 -6.514 -0.293 1.00 0.00 O ATOM 0 H SER A 120 14.567 -7.987 -1.370 1.00 0.00 H new ATOM 0 HA SER A 120 12.571 -6.325 -0.596 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.693 -4.896 0.258 1.00 0.00 H new ATOM 0 HB3 SER A 120 14.231 -6.421 0.987 1.00 0.00 H new ATOM 0 HG SER A 120 16.482 -6.360 0.431 1.00 0.00 H new ATOM 1854 N SER A 121 14.455 -4.857 -2.866 1.00 0.00 N ATOM 1855 CA SER A 121 14.517 -3.731 -3.791 1.00 0.00 C ATOM 1856 C SER A 121 13.164 -3.499 -4.456 1.00 0.00 C ATOM 1857 O SER A 121 12.756 -2.358 -4.679 1.00 0.00 O ATOM 1858 CB SER A 121 15.586 -3.978 -4.857 1.00 0.00 C ATOM 1859 OG SER A 121 15.910 -2.780 -5.542 1.00 0.00 O ATOM 0 H SER A 121 15.200 -5.544 -2.986 1.00 0.00 H new ATOM 0 HA SER A 121 14.780 -2.839 -3.222 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.482 -4.387 -4.390 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.229 -4.722 -5.569 1.00 0.00 H new ATOM 0 HG SER A 121 16.596 -2.964 -6.217 1.00 0.00 H new ATOM 1865 N LEU A 122 12.472 -4.588 -4.772 1.00 0.00 N ATOM 1866 CA LEU A 122 11.164 -4.505 -5.412 1.00 0.00 C ATOM 1867 C LEU A 122 10.071 -4.234 -4.383 1.00 0.00 C ATOM 1868 O LEU A 122 9.164 -3.437 -4.621 1.00 0.00 O ATOM 1869 CB LEU A 122 10.860 -5.801 -6.166 1.00 0.00 C ATOM 1870 CG LEU A 122 11.663 -6.036 -7.446 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.560 -7.490 -7.881 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.182 -5.111 -8.554 1.00 0.00 C ATOM 0 H LEU A 122 12.795 -5.539 -4.595 1.00 0.00 H new ATOM 0 HA LEU A 122 11.185 -3.676 -6.120 1.00 0.00 H new ATOM 0 HB2 LEU A 122 11.035 -6.640 -5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.800 -5.811 -6.419 1.00 0.00 H new ATOM 0 HG LEU A 122 12.710 -5.812 -7.242 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.138 -7.639 -8.793 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.953 -8.134 -7.094 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.516 -7.741 -8.068 1.00 0.00 H new ATOM 0 HD21 LEU A 122 11.764 -5.292 -9.457 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.128 -5.303 -8.757 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.308 -4.074 -8.243 1.00 0.00 H new ATOM 1884 N VAL A 123 10.164 -4.902 -3.237 1.00 0.00 N ATOM 1885 CA VAL A 123 9.185 -4.731 -2.171 1.00 0.00 C ATOM 1886 C VAL A 123 9.058 -3.265 -1.771 1.00 0.00 C ATOM 1887 O VAL A 123 7.953 -2.752 -1.601 1.00 0.00 O ATOM 1888 CB VAL A 123 9.559 -5.560 -0.927 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.615 -5.251 0.224 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.547 -7.045 -1.255 1.00 0.00 C ATOM 0 H VAL A 123 10.908 -5.567 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 123 8.229 -5.083 -2.560 1.00 0.00 H new ATOM 0 HB VAL A 123 10.568 -5.288 -0.619 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.895 -5.846 1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.679 -4.192 0.473 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.593 -5.494 -0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.813 -7.616 -0.366 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.551 -7.336 -1.588 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.268 -7.249 -2.046 1.00 0.00 H new ATOM 1900 N GLU A 124 10.198 -2.596 -1.624 1.00 0.00 N ATOM 1901 CA GLU A 124 10.213 -1.189 -1.244 1.00 0.00 C ATOM 1902 C GLU A 124 9.672 -0.315 -2.372 1.00 0.00 C ATOM 1903 O GLU A 124 9.141 0.769 -2.131 1.00 0.00 O ATOM 1904 CB GLU A 124 11.634 -0.751 -0.883 1.00 0.00 C ATOM 1905 CG GLU A 124 12.604 -0.805 -2.051 1.00 0.00 C ATOM 1906 CD GLU A 124 13.938 -0.159 -1.733 1.00 0.00 C ATOM 1907 OE1 GLU A 124 13.970 1.075 -1.542 1.00 0.00 O ATOM 1908 OE2 GLU A 124 14.951 -0.887 -1.674 1.00 0.00 O ATOM 0 H GLU A 124 11.122 -3.006 -1.762 1.00 0.00 H new ATOM 0 HA GLU A 124 9.570 -1.068 -0.372 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.603 0.267 -0.494 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.008 -1.387 -0.081 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.767 -1.845 -2.335 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.159 -0.305 -2.911 1.00 0.00 H new ATOM 1915 N MET A 125 9.810 -0.795 -3.604 1.00 0.00 N ATOM 1916 CA MET A 125 9.334 -0.059 -4.769 1.00 0.00 C ATOM 1917 C MET A 125 7.811 -0.091 -4.848 1.00 0.00 C ATOM 1918 O MET A 125 7.152 0.942 -4.728 1.00 0.00 O ATOM 1919 CB MET A 125 9.936 -0.642 -6.048 1.00 0.00 C ATOM 1920 CG MET A 125 9.601 0.158 -7.297 1.00 0.00 C ATOM 1921 SD MET A 125 8.083 -0.401 -8.094 1.00 0.00 S ATOM 1922 CE MET A 125 8.601 -1.993 -8.730 1.00 0.00 C ATOM 0 H MET A 125 10.248 -1.690 -3.821 1.00 0.00 H new ATOM 0 HA MET A 125 9.652 0.979 -4.667 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.019 -0.694 -5.939 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.579 -1.664 -6.175 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.502 1.211 -7.033 1.00 0.00 H new ATOM 0 HG3 MET A 125 10.427 0.083 -8.004 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.970 -2.270 -9.574 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.639 -1.934 -9.057 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.510 -2.745 -7.946 1.00 0.00 H new ATOM 1932 N ILE A 126 7.259 -1.283 -5.051 1.00 0.00 N ATOM 1933 CA ILE A 126 5.814 -1.449 -5.145 1.00 0.00 C ATOM 1934 C ILE A 126 5.094 -0.597 -4.106 1.00 0.00 C ATOM 1935 O ILE A 126 3.956 -0.175 -4.313 1.00 0.00 O ATOM 1936 CB ILE A 126 5.403 -2.921 -4.959 1.00 0.00 C ATOM 1937 CG1 ILE A 126 4.011 -3.163 -5.545 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.437 -3.298 -3.485 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.744 -4.611 -5.892 1.00 0.00 C ATOM 0 H ILE A 126 7.791 -2.147 -5.153 1.00 0.00 H new ATOM 0 HA ILE A 126 5.524 -1.123 -6.144 1.00 0.00 H new ATOM 0 HB ILE A 126 6.115 -3.552 -5.492 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.261 -2.825 -4.830 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.893 -2.555 -6.442 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.144 -4.342 -3.369 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.446 -3.159 -3.097 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.745 -2.663 -2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.739 -4.707 -6.302 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.471 -4.948 -6.631 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.830 -5.222 -4.994 1.00 0.00 H new ATOM 1951 N PHE A 127 5.765 -0.345 -2.987 1.00 0.00 N ATOM 1952 CA PHE A 127 5.190 0.458 -1.914 1.00 0.00 C ATOM 1953 C PHE A 127 5.570 1.927 -2.071 1.00 0.00 C ATOM 1954 O PHE A 127 4.730 2.816 -1.929 1.00 0.00 O ATOM 1955 CB PHE A 127 5.660 -0.059 -0.553 1.00 0.00 C ATOM 1956 CG PHE A 127 5.272 -1.486 -0.287 1.00 0.00 C ATOM 1957 CD1 PHE A 127 4.008 -1.947 -0.619 1.00 0.00 C ATOM 1958 CD2 PHE A 127 6.171 -2.365 0.294 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.649 -3.259 -0.374 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.817 -3.679 0.540 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.554 -4.126 0.205 1.00 0.00 C ATOM 0 H PHE A 127 6.708 -0.685 -2.800 1.00 0.00 H new ATOM 0 HA PHE A 127 4.105 0.373 -1.972 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.745 0.031 -0.494 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.244 0.574 0.231 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.296 -1.274 -1.074 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.160 -2.020 0.558 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.660 -3.606 -0.636 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.527 -4.355 0.993 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.275 -5.152 0.396 1.00 0.00 H new ATOM 1971 N SER A 128 6.842 2.175 -2.365 1.00 0.00 N ATOM 1972 CA SER A 128 7.336 3.536 -2.538 1.00 0.00 C ATOM 1973 C SER A 128 6.447 4.319 -3.499 1.00 0.00 C ATOM 1974 O SER A 128 5.979 5.411 -3.178 1.00 0.00 O ATOM 1975 CB SER A 128 8.775 3.518 -3.057 1.00 0.00 C ATOM 1976 OG SER A 128 9.703 3.473 -1.986 1.00 0.00 O ATOM 0 H SER A 128 7.550 1.451 -2.488 1.00 0.00 H new ATOM 0 HA SER A 128 7.314 4.029 -1.566 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.920 2.654 -3.705 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.957 4.405 -3.663 1.00 0.00 H new ATOM 0 HG SER A 128 9.813 2.546 -1.687 1.00 0.00 H new ATOM 1982 N GLU A 129 6.218 3.751 -4.679 1.00 0.00 N ATOM 1983 CA GLU A 129 5.386 4.396 -5.688 1.00 0.00 C ATOM 1984 C GLU A 129 5.563 5.911 -5.652 1.00 0.00 C ATOM 1985 O GLU A 129 4.631 6.663 -5.938 1.00 0.00 O ATOM 1986 CB GLU A 129 3.914 4.038 -5.471 1.00 0.00 C ATOM 1987 CG GLU A 129 3.180 5.007 -4.559 1.00 0.00 C ATOM 1988 CD GLU A 129 2.061 4.342 -3.782 1.00 0.00 C ATOM 1989 OE1 GLU A 129 2.363 3.573 -2.845 1.00 0.00 O ATOM 1990 OE2 GLU A 129 0.882 4.591 -4.110 1.00 0.00 O ATOM 0 H GLU A 129 6.597 2.846 -4.959 1.00 0.00 H new ATOM 0 HA GLU A 129 5.700 4.034 -6.667 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.410 4.008 -6.437 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.851 3.035 -5.048 1.00 0.00 H new ATOM 0 HG2 GLU A 129 3.889 5.450 -3.860 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.769 5.821 -5.156 1.00 0.00 H new ATOM 1997 N ASP A 130 6.765 6.352 -5.298 1.00 0.00 N ATOM 1998 CA ASP A 130 7.066 7.777 -5.224 1.00 0.00 C ATOM 1999 C ASP A 130 8.100 8.169 -6.275 1.00 0.00 C ATOM 2000 O ASP A 130 9.298 7.951 -6.092 1.00 0.00 O ATOM 2001 CB ASP A 130 7.575 8.141 -3.829 1.00 0.00 C ATOM 2002 CG ASP A 130 8.079 9.569 -3.751 1.00 0.00 C ATOM 2003 OD1 ASP A 130 7.573 10.420 -4.513 1.00 0.00 O ATOM 2004 OD2 ASP A 130 8.978 9.836 -2.927 1.00 0.00 O ATOM 0 H ASP A 130 7.547 5.743 -5.058 1.00 0.00 H new ATOM 0 HA ASP A 130 6.147 8.328 -5.421 1.00 0.00 H new ATOM 0 HB2 ASP A 130 6.772 8.002 -3.105 1.00 0.00 H new ATOM 0 HB3 ASP A 130 8.378 7.459 -3.549 1.00 0.00 H new TER 2009 ASP A 130