USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 758 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -107:sc= 0.0706 (180deg=-0.0397) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl 171:sc= -1.32 (180deg=-1.65) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -1.3 K(o=-1.3,f=-10!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.402 X(o=-0.4,f=-0.04) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 58 MET CE :methyl -169:sc= -1.84 (180deg=-2.6) USER MOD Single : A 60 THR OG1 : rot -42:sc= 0.561 USER MOD Single : A 65 GLN : amide:sc=-0.00363 X(o=-0.0036,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= -0.196 USER MOD Single : A 76 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.167) USER MOD Single : A 79 HIS : no HE2:sc= -1.62 K(o=-1.6,f=-3.4!) USER MOD Single : A 82 LYS NZ :NH3+ -166:sc=-0.00259 (180deg=-0.114) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 36:sc= -0.0169! USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.188 K(o=-0.19,f=-2.3!) USER MOD Single : A 96 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0781) USER MOD Single : A 97 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.232) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.240 8.991 -15.844 1.00 0.00 N ATOM 2 CA MET A 1 18.784 8.974 -15.924 1.00 0.00 C ATOM 3 C MET A 1 18.267 7.554 -16.134 1.00 0.00 C ATOM 4 O MET A 1 18.974 6.699 -16.665 1.00 0.00 O ATOM 5 CB MET A 1 18.304 9.877 -17.062 1.00 0.00 C ATOM 6 CG MET A 1 18.531 9.286 -18.444 1.00 0.00 C ATOM 7 SD MET A 1 18.331 10.501 -19.761 1.00 0.00 S ATOM 8 CE MET A 1 17.535 9.507 -21.020 1.00 0.00 C ATOM 0 H1 MET A 1 20.532 9.160 -14.860 1.00 0.00 H new ATOM 0 H2 MET A 1 20.616 8.076 -16.164 1.00 0.00 H new ATOM 0 H3 MET A 1 20.612 9.749 -16.451 1.00 0.00 H new ATOM 0 HA MET A 1 18.389 9.350 -14.980 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.241 10.077 -16.932 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.819 10.835 -16.996 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.535 8.864 -18.494 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.832 8.465 -18.603 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.345 10.120 -21.901 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.184 8.674 -21.290 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.591 9.121 -20.636 1.00 0.00 H new ATOM 18 N ALA A 2 17.029 7.311 -15.713 1.00 0.00 N ATOM 19 CA ALA A 2 16.418 5.996 -15.857 1.00 0.00 C ATOM 20 C ALA A 2 14.989 6.109 -16.375 1.00 0.00 C ATOM 21 O ALA A 2 14.082 6.505 -15.642 1.00 0.00 O ATOM 22 CB ALA A 2 16.444 5.254 -14.528 1.00 0.00 C ATOM 0 H ALA A 2 16.431 8.008 -15.270 1.00 0.00 H new ATOM 0 HA ALA A 2 16.997 5.431 -16.587 1.00 0.00 H new ATOM 0 HB1 ALA A 2 15.984 4.273 -14.650 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.476 5.133 -14.199 1.00 0.00 H new ATOM 0 HB3 ALA A 2 15.890 5.824 -13.782 1.00 0.00 H new ATOM 28 N ARG A 3 14.794 5.759 -17.642 1.00 0.00 N ATOM 29 CA ARG A 3 13.474 5.823 -18.258 1.00 0.00 C ATOM 30 C ARG A 3 12.448 5.057 -17.427 1.00 0.00 C ATOM 31 O ARG A 3 12.453 3.827 -17.396 1.00 0.00 O ATOM 32 CB ARG A 3 13.522 5.255 -19.677 1.00 0.00 C ATOM 33 CG ARG A 3 14.458 6.011 -20.605 1.00 0.00 C ATOM 34 CD ARG A 3 14.621 5.297 -21.938 1.00 0.00 C ATOM 35 NE ARG A 3 13.440 5.443 -22.785 1.00 0.00 N ATOM 36 CZ ARG A 3 13.352 4.946 -24.013 1.00 0.00 C ATOM 37 NH1 ARG A 3 14.369 4.275 -24.536 1.00 0.00 N ATOM 38 NH2 ARG A 3 12.244 5.120 -24.722 1.00 0.00 N ATOM 0 H ARG A 3 15.533 5.428 -18.262 1.00 0.00 H new ATOM 0 HA ARG A 3 13.172 6.869 -18.302 1.00 0.00 H new ATOM 0 HB2 ARG A 3 13.834 4.212 -19.631 1.00 0.00 H new ATOM 0 HB3 ARG A 3 12.517 5.269 -20.099 1.00 0.00 H new ATOM 0 HG2 ARG A 3 14.070 7.016 -20.775 1.00 0.00 H new ATOM 0 HG3 ARG A 3 15.432 6.121 -20.129 1.00 0.00 H new ATOM 0 HD2 ARG A 3 15.492 5.695 -22.459 1.00 0.00 H new ATOM 0 HD3 ARG A 3 14.812 4.238 -21.761 1.00 0.00 H new ATOM 0 HE ARG A 3 12.640 5.954 -22.413 1.00 0.00 H new ATOM 0 HH11 ARG A 3 15.223 4.139 -23.995 1.00 0.00 H new ATOM 0 HH12 ARG A 3 14.298 3.895 -25.480 1.00 0.00 H new ATOM 0 HH21 ARG A 3 11.459 5.636 -24.324 1.00 0.00 H new ATOM 0 HH22 ARG A 3 12.177 4.738 -25.665 1.00 0.00 H new ATOM 52 N GLY A 4 11.571 5.794 -16.753 1.00 0.00 N ATOM 53 CA GLY A 4 10.552 5.168 -15.931 1.00 0.00 C ATOM 54 C GLY A 4 9.224 5.041 -16.650 1.00 0.00 C ATOM 55 O GLY A 4 8.164 5.164 -16.036 1.00 0.00 O ATOM 0 H GLY A 4 11.548 6.814 -16.761 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.893 4.178 -15.626 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.414 5.752 -15.021 1.00 0.00 H new ATOM 59 N SER A 5 9.280 4.795 -17.955 1.00 0.00 N ATOM 60 CA SER A 5 8.072 4.657 -18.759 1.00 0.00 C ATOM 61 C SER A 5 7.167 3.564 -18.198 1.00 0.00 C ATOM 62 O SER A 5 7.512 2.897 -17.223 1.00 0.00 O ATOM 63 CB SER A 5 8.434 4.338 -20.212 1.00 0.00 C ATOM 64 OG SER A 5 9.168 5.399 -20.798 1.00 0.00 O ATOM 0 H SER A 5 10.149 4.687 -18.478 1.00 0.00 H new ATOM 0 HA SER A 5 7.533 5.604 -18.725 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.021 3.420 -20.251 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.525 4.160 -20.786 1.00 0.00 H new ATOM 0 HG SER A 5 9.389 5.171 -21.725 1.00 0.00 H new ATOM 70 N VAL A 6 6.007 3.387 -18.821 1.00 0.00 N ATOM 71 CA VAL A 6 5.052 2.375 -18.385 1.00 0.00 C ATOM 72 C VAL A 6 4.324 1.758 -19.574 1.00 0.00 C ATOM 73 O VAL A 6 3.796 2.469 -20.429 1.00 0.00 O ATOM 74 CB VAL A 6 4.013 2.965 -17.412 1.00 0.00 C ATOM 75 CG1 VAL A 6 3.178 1.858 -16.787 1.00 0.00 C ATOM 76 CG2 VAL A 6 4.701 3.797 -16.340 1.00 0.00 C ATOM 0 H VAL A 6 5.705 3.931 -19.629 1.00 0.00 H new ATOM 0 HA VAL A 6 5.623 1.602 -17.871 1.00 0.00 H new ATOM 0 HB VAL A 6 3.344 3.618 -17.973 1.00 0.00 H new ATOM 0 HG11 VAL A 6 2.450 2.294 -16.103 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.656 1.309 -17.571 1.00 0.00 H new ATOM 0 HG13 VAL A 6 3.829 1.177 -16.239 1.00 0.00 H new ATOM 0 HG21 VAL A 6 3.953 4.206 -15.661 1.00 0.00 H new ATOM 0 HG22 VAL A 6 5.394 3.168 -15.780 1.00 0.00 H new ATOM 0 HG23 VAL A 6 5.250 4.613 -16.809 1.00 0.00 H new ATOM 86 N SER A 7 4.301 0.429 -19.622 1.00 0.00 N ATOM 87 CA SER A 7 3.641 -0.285 -20.709 1.00 0.00 C ATOM 88 C SER A 7 2.124 -0.174 -20.590 1.00 0.00 C ATOM 89 O SER A 7 1.600 0.225 -19.549 1.00 0.00 O ATOM 90 CB SER A 7 4.059 -1.757 -20.708 1.00 0.00 C ATOM 91 OG SER A 7 5.243 -1.952 -21.462 1.00 0.00 O ATOM 0 H SER A 7 4.732 -0.174 -18.921 1.00 0.00 H new ATOM 0 HA SER A 7 3.948 0.171 -21.650 1.00 0.00 H new ATOM 0 HB2 SER A 7 4.218 -2.092 -19.683 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.256 -2.367 -21.122 1.00 0.00 H new ATOM 0 HG SER A 7 5.490 -2.900 -21.444 1.00 0.00 H new ATOM 97 N ASP A 8 1.425 -0.531 -21.662 1.00 0.00 N ATOM 98 CA ASP A 8 -0.032 -0.473 -21.678 1.00 0.00 C ATOM 99 C ASP A 8 -0.622 -1.340 -20.570 1.00 0.00 C ATOM 100 O ASP A 8 -1.383 -0.858 -19.731 1.00 0.00 O ATOM 101 CB ASP A 8 -0.566 -0.927 -23.037 1.00 0.00 C ATOM 102 CG ASP A 8 -0.519 0.176 -24.076 1.00 0.00 C ATOM 103 OD1 ASP A 8 0.473 0.934 -24.093 1.00 0.00 O ATOM 104 OD2 ASP A 8 -1.475 0.282 -24.872 1.00 0.00 O ATOM 0 H ASP A 8 1.844 -0.863 -22.531 1.00 0.00 H new ATOM 0 HA ASP A 8 -0.333 0.560 -21.505 1.00 0.00 H new ATOM 0 HB2 ASP A 8 0.018 -1.778 -23.388 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -1.594 -1.271 -22.923 1.00 0.00 H new ATOM 109 N GLU A 9 -0.268 -2.620 -20.575 1.00 0.00 N ATOM 110 CA GLU A 9 -0.765 -3.555 -19.571 1.00 0.00 C ATOM 111 C GLU A 9 -0.375 -3.102 -18.167 1.00 0.00 C ATOM 112 O GLU A 9 -1.232 -2.901 -17.308 1.00 0.00 O ATOM 113 CB GLU A 9 -0.221 -4.960 -19.836 1.00 0.00 C ATOM 114 CG GLU A 9 -0.945 -5.692 -20.953 1.00 0.00 C ATOM 115 CD GLU A 9 -2.269 -6.279 -20.504 1.00 0.00 C ATOM 116 OE1 GLU A 9 -2.651 -6.055 -19.336 1.00 0.00 O ATOM 117 OE2 GLU A 9 -2.924 -6.963 -21.318 1.00 0.00 O ATOM 0 H GLU A 9 0.361 -3.035 -21.263 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.853 -3.577 -19.638 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.838 -4.889 -20.086 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.294 -5.547 -18.921 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.119 -5.004 -21.780 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.307 -6.491 -21.332 1.00 0.00 H new ATOM 124 N GLU A 10 0.927 -2.944 -17.943 1.00 0.00 N ATOM 125 CA GLU A 10 1.431 -2.518 -16.643 1.00 0.00 C ATOM 126 C GLU A 10 0.703 -1.266 -16.161 1.00 0.00 C ATOM 127 O GLU A 10 0.158 -1.237 -15.058 1.00 0.00 O ATOM 128 CB GLU A 10 2.935 -2.249 -16.717 1.00 0.00 C ATOM 129 CG GLU A 10 3.502 -1.608 -15.462 1.00 0.00 C ATOM 130 CD GLU A 10 3.409 -2.516 -14.251 1.00 0.00 C ATOM 131 OE1 GLU A 10 2.931 -3.660 -14.402 1.00 0.00 O ATOM 132 OE2 GLU A 10 3.814 -2.084 -13.152 1.00 0.00 O ATOM 0 H GLU A 10 1.650 -3.105 -18.644 1.00 0.00 H new ATOM 0 HA GLU A 10 1.248 -3.322 -15.930 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.455 -3.189 -16.901 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.138 -1.600 -17.569 1.00 0.00 H new ATOM 0 HG2 GLU A 10 4.545 -1.343 -15.633 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.967 -0.681 -15.258 1.00 0.00 H new ATOM 139 N MET A 11 0.700 -0.233 -16.997 1.00 0.00 N ATOM 140 CA MET A 11 0.038 1.022 -16.657 1.00 0.00 C ATOM 141 C MET A 11 -1.389 0.774 -16.182 1.00 0.00 C ATOM 142 O MET A 11 -1.734 1.074 -15.040 1.00 0.00 O ATOM 143 CB MET A 11 0.030 1.962 -17.864 1.00 0.00 C ATOM 144 CG MET A 11 -0.488 3.355 -17.546 1.00 0.00 C ATOM 145 SD MET A 11 0.838 4.522 -17.181 1.00 0.00 S ATOM 146 CE MET A 11 0.121 5.434 -15.816 1.00 0.00 C ATOM 0 H MET A 11 1.148 -0.240 -17.913 1.00 0.00 H new ATOM 0 HA MET A 11 0.595 1.489 -15.845 1.00 0.00 H new ATOM 0 HB2 MET A 11 1.043 2.041 -18.259 1.00 0.00 H new ATOM 0 HB3 MET A 11 -0.586 1.525 -18.650 1.00 0.00 H new ATOM 0 HG2 MET A 11 -1.069 3.724 -18.391 1.00 0.00 H new ATOM 0 HG3 MET A 11 -1.164 3.301 -16.693 1.00 0.00 H new ATOM 0 HE1 MET A 11 0.877 6.083 -15.375 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.710 6.039 -16.179 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.241 4.735 -15.062 1.00 0.00 H new ATOM 156 N MET A 12 -2.214 0.222 -17.066 1.00 0.00 N ATOM 157 CA MET A 12 -3.605 -0.068 -16.735 1.00 0.00 C ATOM 158 C MET A 12 -3.716 -0.682 -15.343 1.00 0.00 C ATOM 159 O MET A 12 -4.468 -0.195 -14.499 1.00 0.00 O ATOM 160 CB MET A 12 -4.211 -1.015 -17.773 1.00 0.00 C ATOM 161 CG MET A 12 -5.391 -0.420 -18.522 1.00 0.00 C ATOM 162 SD MET A 12 -6.851 -0.228 -17.481 1.00 0.00 S ATOM 163 CE MET A 12 -7.873 -1.571 -18.079 1.00 0.00 C ATOM 0 H MET A 12 -1.944 -0.033 -18.016 1.00 0.00 H new ATOM 0 HA MET A 12 -4.158 0.871 -16.743 1.00 0.00 H new ATOM 0 HB2 MET A 12 -3.440 -1.296 -18.490 1.00 0.00 H new ATOM 0 HB3 MET A 12 -4.531 -1.930 -17.275 1.00 0.00 H new ATOM 0 HG2 MET A 12 -5.107 0.552 -18.926 1.00 0.00 H new ATOM 0 HG3 MET A 12 -5.636 -1.058 -19.371 1.00 0.00 H new ATOM 0 HE1 MET A 12 -8.815 -1.584 -17.530 1.00 0.00 H new ATOM 0 HE2 MET A 12 -8.074 -1.430 -19.141 1.00 0.00 H new ATOM 0 HE3 MET A 12 -7.354 -2.518 -17.930 1.00 0.00 H new ATOM 173 N GLU A 13 -2.963 -1.752 -15.111 1.00 0.00 N ATOM 174 CA GLU A 13 -2.979 -2.431 -13.820 1.00 0.00 C ATOM 175 C GLU A 13 -2.761 -1.439 -12.681 1.00 0.00 C ATOM 176 O GLU A 13 -3.578 -1.342 -11.763 1.00 0.00 O ATOM 177 CB GLU A 13 -1.902 -3.518 -13.777 1.00 0.00 C ATOM 178 CG GLU A 13 -2.413 -4.861 -13.284 1.00 0.00 C ATOM 179 CD GLU A 13 -2.133 -5.986 -14.262 1.00 0.00 C ATOM 180 OE1 GLU A 13 -1.753 -7.085 -13.807 1.00 0.00 O ATOM 181 OE2 GLU A 13 -2.294 -5.768 -15.480 1.00 0.00 O ATOM 0 H GLU A 13 -2.335 -2.167 -15.799 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.958 -2.894 -13.694 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -1.483 -3.642 -14.776 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -1.090 -3.188 -13.129 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.948 -5.093 -12.326 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -3.487 -4.795 -13.109 1.00 0.00 H new ATOM 188 N LEU A 14 -1.656 -0.705 -12.746 1.00 0.00 N ATOM 189 CA LEU A 14 -1.330 0.279 -11.719 1.00 0.00 C ATOM 190 C LEU A 14 -2.458 1.292 -11.559 1.00 0.00 C ATOM 191 O LEU A 14 -2.827 1.654 -10.441 1.00 0.00 O ATOM 192 CB LEU A 14 -0.028 1.000 -12.072 1.00 0.00 C ATOM 193 CG LEU A 14 1.265 0.259 -11.729 1.00 0.00 C ATOM 194 CD1 LEU A 14 1.076 -1.242 -11.883 1.00 0.00 C ATOM 195 CD2 LEU A 14 2.408 0.747 -12.606 1.00 0.00 C ATOM 0 H LEU A 14 -0.971 -0.772 -13.498 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.202 -0.247 -10.773 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.030 1.209 -13.142 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.019 1.962 -11.560 1.00 0.00 H new ATOM 0 HG LEU A 14 1.517 0.468 -10.689 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.006 -1.753 -11.635 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.286 -1.580 -11.212 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.800 -1.470 -12.912 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.320 0.209 -12.348 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.165 0.568 -13.653 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.559 1.815 -12.446 1.00 0.00 H new ATOM 207 N ARG A 15 -3.005 1.746 -12.682 1.00 0.00 N ATOM 208 CA ARG A 15 -4.092 2.715 -12.666 1.00 0.00 C ATOM 209 C ARG A 15 -5.249 2.222 -11.802 1.00 0.00 C ATOM 210 O ARG A 15 -5.584 2.834 -10.789 1.00 0.00 O ATOM 211 CB ARG A 15 -4.585 2.986 -14.089 1.00 0.00 C ATOM 212 CG ARG A 15 -3.543 3.646 -14.979 1.00 0.00 C ATOM 213 CD ARG A 15 -3.265 5.076 -14.545 1.00 0.00 C ATOM 214 NE ARG A 15 -4.341 5.985 -14.935 1.00 0.00 N ATOM 215 CZ ARG A 15 -4.192 7.301 -15.031 1.00 0.00 C ATOM 216 NH1 ARG A 15 -3.019 7.860 -14.766 1.00 0.00 N ATOM 217 NH2 ARG A 15 -5.217 8.062 -15.393 1.00 0.00 N ATOM 0 H ARG A 15 -2.712 1.457 -13.615 1.00 0.00 H new ATOM 0 HA ARG A 15 -3.710 3.642 -12.238 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -4.894 2.045 -14.543 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -5.468 3.623 -14.043 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -2.619 3.069 -14.948 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -3.889 3.639 -16.013 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -3.137 5.108 -13.463 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -2.327 5.413 -14.987 1.00 0.00 H new ATOM 0 HE ARG A 15 -5.256 5.587 -15.145 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -2.228 7.279 -14.488 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.907 8.871 -14.841 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -6.121 7.636 -15.598 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -5.101 9.073 -15.466 1.00 0.00 H new ATOM 231 N GLU A 16 -5.854 1.111 -12.211 1.00 0.00 N ATOM 232 CA GLU A 16 -6.974 0.537 -11.474 1.00 0.00 C ATOM 233 C GLU A 16 -6.585 0.251 -10.028 1.00 0.00 C ATOM 234 O GLU A 16 -7.398 0.392 -9.115 1.00 0.00 O ATOM 235 CB GLU A 16 -7.450 -0.751 -12.149 1.00 0.00 C ATOM 236 CG GLU A 16 -6.374 -1.819 -12.251 1.00 0.00 C ATOM 237 CD GLU A 16 -6.893 -3.118 -12.835 1.00 0.00 C ATOM 238 OE1 GLU A 16 -8.000 -3.544 -12.441 1.00 0.00 O ATOM 239 OE2 GLU A 16 -6.194 -3.710 -13.683 1.00 0.00 O ATOM 0 H GLU A 16 -5.588 0.591 -13.047 1.00 0.00 H new ATOM 0 HA GLU A 16 -7.787 1.263 -11.476 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.296 -1.152 -11.591 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -7.811 -0.515 -13.150 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -5.557 -1.448 -12.870 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.962 -2.010 -11.260 1.00 0.00 H new ATOM 246 N ALA A 17 -5.334 -0.150 -9.825 1.00 0.00 N ATOM 247 CA ALA A 17 -4.835 -0.454 -8.490 1.00 0.00 C ATOM 248 C ALA A 17 -4.970 0.752 -7.566 1.00 0.00 C ATOM 249 O ALA A 17 -5.386 0.621 -6.415 1.00 0.00 O ATOM 250 CB ALA A 17 -3.385 -0.908 -8.559 1.00 0.00 C ATOM 0 H ALA A 17 -4.647 -0.272 -10.569 1.00 0.00 H new ATOM 0 HA ALA A 17 -5.438 -1.263 -8.079 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.026 -1.132 -7.555 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.313 -1.802 -9.178 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.776 -0.116 -8.994 1.00 0.00 H new ATOM 256 N PHE A 18 -4.615 1.925 -8.077 1.00 0.00 N ATOM 257 CA PHE A 18 -4.695 3.155 -7.297 1.00 0.00 C ATOM 258 C PHE A 18 -6.147 3.583 -7.105 1.00 0.00 C ATOM 259 O PHE A 18 -6.549 3.983 -6.012 1.00 0.00 O ATOM 260 CB PHE A 18 -3.909 4.273 -7.984 1.00 0.00 C ATOM 261 CG PHE A 18 -2.544 3.849 -8.446 1.00 0.00 C ATOM 262 CD1 PHE A 18 -1.772 2.994 -7.677 1.00 0.00 C ATOM 263 CD2 PHE A 18 -2.033 4.307 -9.650 1.00 0.00 C ATOM 264 CE1 PHE A 18 -0.516 2.601 -8.100 1.00 0.00 C ATOM 265 CE2 PHE A 18 -0.777 3.918 -10.078 1.00 0.00 C ATOM 266 CZ PHE A 18 -0.018 3.064 -9.301 1.00 0.00 C ATOM 0 H PHE A 18 -4.269 2.051 -9.028 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.258 2.963 -6.317 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.478 4.633 -8.841 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.807 5.111 -7.295 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -2.156 2.630 -6.735 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.622 4.975 -10.261 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.075 1.932 -7.491 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.390 4.281 -11.018 1.00 0.00 H new ATOM 0 HZ PHE A 18 0.963 2.759 -9.633 1.00 0.00 H new ATOM 276 N ALA A 19 -6.930 3.497 -8.175 1.00 0.00 N ATOM 277 CA ALA A 19 -8.337 3.873 -8.125 1.00 0.00 C ATOM 278 C ALA A 19 -9.136 2.900 -7.266 1.00 0.00 C ATOM 279 O ALA A 19 -10.254 3.198 -6.845 1.00 0.00 O ATOM 280 CB ALA A 19 -8.917 3.939 -9.531 1.00 0.00 C ATOM 0 H ALA A 19 -6.613 3.170 -9.088 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.407 4.860 -7.669 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -9.969 4.221 -9.478 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -8.372 4.680 -10.115 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.827 2.963 -10.008 1.00 0.00 H new ATOM 286 N LYS A 20 -8.556 1.732 -7.009 1.00 0.00 N ATOM 287 CA LYS A 20 -9.214 0.713 -6.200 1.00 0.00 C ATOM 288 C LYS A 20 -9.379 1.185 -4.759 1.00 0.00 C ATOM 289 O LYS A 20 -10.496 1.274 -4.249 1.00 0.00 O ATOM 290 CB LYS A 20 -8.410 -0.589 -6.231 1.00 0.00 C ATOM 291 CG LYS A 20 -9.170 -1.760 -6.828 1.00 0.00 C ATOM 292 CD LYS A 20 -9.483 -1.530 -8.297 1.00 0.00 C ATOM 293 CE LYS A 20 -10.857 -2.069 -8.666 1.00 0.00 C ATOM 294 NZ LYS A 20 -11.107 -1.997 -10.132 1.00 0.00 N ATOM 0 H LYS A 20 -7.631 1.468 -7.349 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.203 0.533 -6.621 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.497 -0.429 -6.805 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.107 -0.843 -5.215 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.581 -2.671 -6.719 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.098 -1.912 -6.277 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.439 -0.463 -8.517 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.724 -2.014 -8.912 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.942 -3.104 -8.334 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.623 -1.501 -8.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -12.053 -2.374 -10.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.051 -1.007 -10.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.391 -2.560 -10.634 1.00 0.00 H new ATOM 308 N VAL A 21 -8.261 1.488 -4.108 1.00 0.00 N ATOM 309 CA VAL A 21 -8.283 1.954 -2.726 1.00 0.00 C ATOM 310 C VAL A 21 -8.763 3.399 -2.642 1.00 0.00 C ATOM 311 O VAL A 21 -9.290 3.830 -1.616 1.00 0.00 O ATOM 312 CB VAL A 21 -6.891 1.849 -2.076 1.00 0.00 C ATOM 313 CG1 VAL A 21 -6.522 0.393 -1.837 1.00 0.00 C ATOM 314 CG2 VAL A 21 -5.845 2.537 -2.941 1.00 0.00 C ATOM 0 H VAL A 21 -7.328 1.419 -4.515 1.00 0.00 H new ATOM 0 HA VAL A 21 -8.977 1.311 -2.186 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.921 2.355 -1.111 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.535 0.338 -1.377 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.257 -0.065 -1.175 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.509 -0.140 -2.788 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.868 2.453 -2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -5.814 2.062 -3.922 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.103 3.590 -3.056 1.00 0.00 H new ATOM 324 N ASP A 22 -8.578 4.142 -3.727 1.00 0.00 N ATOM 325 CA ASP A 22 -8.994 5.540 -3.777 1.00 0.00 C ATOM 326 C ASP A 22 -10.515 5.654 -3.760 1.00 0.00 C ATOM 327 O ASP A 22 -11.166 5.604 -4.804 1.00 0.00 O ATOM 328 CB ASP A 22 -8.434 6.216 -5.029 1.00 0.00 C ATOM 329 CG ASP A 22 -7.109 6.906 -4.771 1.00 0.00 C ATOM 330 OD1 ASP A 22 -6.070 6.211 -4.759 1.00 0.00 O ATOM 331 OD2 ASP A 22 -7.110 8.140 -4.580 1.00 0.00 O ATOM 0 H ASP A 22 -8.143 3.801 -4.584 1.00 0.00 H new ATOM 0 HA ASP A 22 -8.599 6.043 -2.894 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.305 5.471 -5.814 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.155 6.946 -5.397 1.00 0.00 H new ATOM 336 N THR A 23 -11.078 5.809 -2.565 1.00 0.00 N ATOM 337 CA THR A 23 -12.522 5.929 -2.410 1.00 0.00 C ATOM 338 C THR A 23 -13.017 7.286 -2.896 1.00 0.00 C ATOM 339 O THR A 23 -14.113 7.399 -3.444 1.00 0.00 O ATOM 340 CB THR A 23 -12.947 5.735 -0.943 1.00 0.00 C ATOM 341 OG1 THR A 23 -14.369 5.580 -0.861 1.00 0.00 O ATOM 342 CG2 THR A 23 -12.513 6.919 -0.092 1.00 0.00 C ATOM 0 H THR A 23 -10.555 5.854 -1.690 1.00 0.00 H new ATOM 0 HA THR A 23 -12.971 5.143 -3.018 1.00 0.00 H new ATOM 0 HB THR A 23 -12.460 4.837 -0.564 1.00 0.00 H new ATOM 0 HG1 THR A 23 -14.631 5.456 0.075 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.825 6.759 0.940 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.428 7.018 -0.132 1.00 0.00 H new ATOM 0 HG23 THR A 23 -12.975 7.830 -0.473 1.00 0.00 H new ATOM 350 N ASP A 24 -12.201 8.315 -2.691 1.00 0.00 N ATOM 351 CA ASP A 24 -12.555 9.666 -3.111 1.00 0.00 C ATOM 352 C ASP A 24 -11.984 9.974 -4.492 1.00 0.00 C ATOM 353 O ASP A 24 -12.341 10.974 -5.113 1.00 0.00 O ATOM 354 CB ASP A 24 -12.043 10.688 -2.094 1.00 0.00 C ATOM 355 CG ASP A 24 -10.573 11.007 -2.284 1.00 0.00 C ATOM 356 OD1 ASP A 24 -10.171 12.152 -1.986 1.00 0.00 O ATOM 357 OD2 ASP A 24 -9.825 10.113 -2.730 1.00 0.00 O ATOM 0 H ASP A 24 -11.291 8.239 -2.237 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.642 9.731 -3.165 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -12.625 11.605 -2.181 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.201 10.304 -1.086 1.00 0.00 H new ATOM 362 N GLY A 25 -11.093 9.107 -4.966 1.00 0.00 N ATOM 363 CA GLY A 25 -10.487 9.304 -6.268 1.00 0.00 C ATOM 364 C GLY A 25 -9.714 10.606 -6.358 1.00 0.00 C ATOM 365 O GLY A 25 -10.052 11.483 -7.151 1.00 0.00 O ATOM 0 H GLY A 25 -10.781 8.272 -4.470 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.817 8.472 -6.483 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.264 9.293 -7.032 1.00 0.00 H new ATOM 369 N ASN A 26 -8.674 10.731 -5.539 1.00 0.00 N ATOM 370 CA ASN A 26 -7.852 11.935 -5.528 1.00 0.00 C ATOM 371 C ASN A 26 -6.448 11.641 -6.044 1.00 0.00 C ATOM 372 O ASN A 26 -5.564 12.495 -5.993 1.00 0.00 O ATOM 373 CB ASN A 26 -7.777 12.513 -4.112 1.00 0.00 C ATOM 374 CG ASN A 26 -7.037 11.599 -3.154 1.00 0.00 C ATOM 375 OD1 ASN A 26 -6.700 10.465 -3.496 1.00 0.00 O ATOM 376 ND2 ASN A 26 -6.782 12.089 -1.947 1.00 0.00 N ATOM 0 H ASN A 26 -8.381 10.014 -4.875 1.00 0.00 H new ATOM 0 HA ASN A 26 -8.316 12.667 -6.189 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.279 13.482 -4.144 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.786 12.686 -3.739 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.288 11.520 -1.260 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -7.080 13.035 -1.707 1.00 0.00 H new ATOM 383 N GLY A 27 -6.249 10.425 -6.544 1.00 0.00 N ATOM 384 CA GLY A 27 -4.951 10.039 -7.064 1.00 0.00 C ATOM 385 C GLY A 27 -3.888 9.985 -5.985 1.00 0.00 C ATOM 386 O GLY A 27 -2.692 10.018 -6.279 1.00 0.00 O ATOM 0 H GLY A 27 -6.965 9.700 -6.598 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.030 9.062 -7.541 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.646 10.747 -7.835 1.00 0.00 H new ATOM 390 N TYR A 28 -4.321 9.903 -4.732 1.00 0.00 N ATOM 391 CA TYR A 28 -3.397 9.849 -3.605 1.00 0.00 C ATOM 392 C TYR A 28 -3.662 8.617 -2.743 1.00 0.00 C ATOM 393 O TYR A 28 -4.792 8.138 -2.657 1.00 0.00 O ATOM 394 CB TYR A 28 -3.521 11.115 -2.757 1.00 0.00 C ATOM 395 CG TYR A 28 -2.839 12.319 -3.364 1.00 0.00 C ATOM 396 CD1 TYR A 28 -1.476 12.308 -3.635 1.00 0.00 C ATOM 397 CD2 TYR A 28 -3.558 13.471 -3.666 1.00 0.00 C ATOM 398 CE1 TYR A 28 -0.849 13.407 -4.190 1.00 0.00 C ATOM 399 CE2 TYR A 28 -2.938 14.573 -4.222 1.00 0.00 C ATOM 400 CZ TYR A 28 -1.585 14.537 -4.482 1.00 0.00 C ATOM 401 OH TYR A 28 -0.964 15.634 -5.035 1.00 0.00 O ATOM 0 H TYR A 28 -5.307 9.872 -4.471 1.00 0.00 H new ATOM 0 HA TYR A 28 -2.383 9.783 -4.000 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -4.577 11.342 -2.610 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.096 10.925 -1.772 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -0.897 11.425 -3.408 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.618 13.504 -3.462 1.00 0.00 H new ATOM 0 HE1 TYR A 28 0.211 13.382 -4.394 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -3.511 15.459 -4.452 1.00 0.00 H new ATOM 0 HH TYR A 28 -1.623 16.344 -5.180 1.00 0.00 H new ATOM 411 N ILE A 29 -2.610 8.112 -2.108 1.00 0.00 N ATOM 412 CA ILE A 29 -2.727 6.939 -1.252 1.00 0.00 C ATOM 413 C ILE A 29 -1.943 7.123 0.044 1.00 0.00 C ATOM 414 O ILE A 29 -0.725 7.295 0.025 1.00 0.00 O ATOM 415 CB ILE A 29 -2.227 5.669 -1.965 1.00 0.00 C ATOM 416 CG1 ILE A 29 -3.141 5.325 -3.142 1.00 0.00 C ATOM 417 CG2 ILE A 29 -2.154 4.505 -0.986 1.00 0.00 C ATOM 418 CD1 ILE A 29 -2.718 4.082 -3.894 1.00 0.00 C ATOM 0 H ILE A 29 -1.667 8.497 -2.170 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.786 6.823 -1.020 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.225 5.858 -2.350 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.158 5.188 -2.774 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.163 6.168 -3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -1.799 3.615 -1.505 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.466 4.752 -0.177 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.145 4.314 -0.574 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.412 3.899 -4.715 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.713 4.222 -4.293 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.724 3.228 -3.217 1.00 0.00 H new ATOM 430 N SER A 30 -2.651 7.084 1.168 1.00 0.00 N ATOM 431 CA SER A 30 -2.023 7.248 2.474 1.00 0.00 C ATOM 432 C SER A 30 -1.730 5.892 3.111 1.00 0.00 C ATOM 433 O SER A 30 -1.876 4.850 2.473 1.00 0.00 O ATOM 434 CB SER A 30 -2.921 8.074 3.396 1.00 0.00 C ATOM 435 OG SER A 30 -4.050 7.325 3.813 1.00 0.00 O ATOM 0 H SER A 30 -3.660 6.940 1.201 1.00 0.00 H new ATOM 0 HA SER A 30 -1.079 7.774 2.332 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.353 8.397 4.268 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.249 8.975 2.878 1.00 0.00 H new ATOM 0 HG SER A 30 -4.607 7.874 4.403 1.00 0.00 H new ATOM 441 N PHE A 31 -1.317 5.916 4.373 1.00 0.00 N ATOM 442 CA PHE A 31 -1.002 4.691 5.097 1.00 0.00 C ATOM 443 C PHE A 31 -2.274 3.924 5.448 1.00 0.00 C ATOM 444 O PHE A 31 -2.252 2.705 5.608 1.00 0.00 O ATOM 445 CB PHE A 31 -0.219 5.013 6.372 1.00 0.00 C ATOM 446 CG PHE A 31 -0.333 3.952 7.429 1.00 0.00 C ATOM 447 CD1 PHE A 31 -1.342 4.005 8.377 1.00 0.00 C ATOM 448 CD2 PHE A 31 0.571 2.902 7.476 1.00 0.00 C ATOM 449 CE1 PHE A 31 -1.449 3.030 9.351 1.00 0.00 C ATOM 450 CE2 PHE A 31 0.468 1.924 8.447 1.00 0.00 C ATOM 451 CZ PHE A 31 -0.542 1.989 9.387 1.00 0.00 C ATOM 0 H PHE A 31 -1.193 6.771 4.916 1.00 0.00 H new ATOM 0 HA PHE A 31 -0.388 4.065 4.450 1.00 0.00 H new ATOM 0 HB2 PHE A 31 0.832 5.151 6.118 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.575 5.959 6.779 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.053 4.818 8.355 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.365 2.848 6.746 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -2.241 3.082 10.083 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.177 1.109 8.471 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.622 1.227 10.149 1.00 0.00 H new ATOM 461 N ASN A 32 -3.381 4.650 5.566 1.00 0.00 N ATOM 462 CA ASN A 32 -4.663 4.040 5.899 1.00 0.00 C ATOM 463 C ASN A 32 -5.168 3.173 4.749 1.00 0.00 C ATOM 464 O ASN A 32 -5.517 2.010 4.944 1.00 0.00 O ATOM 465 CB ASN A 32 -5.695 5.120 6.230 1.00 0.00 C ATOM 466 CG ASN A 32 -6.919 4.557 6.926 1.00 0.00 C ATOM 467 OD1 ASN A 32 -7.998 4.474 6.338 1.00 0.00 O ATOM 468 ND2 ASN A 32 -6.757 4.165 8.184 1.00 0.00 N ATOM 0 H ASN A 32 -3.416 5.661 5.436 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.519 3.405 6.773 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.234 5.876 6.866 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.001 5.620 5.311 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.545 3.777 8.703 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -5.845 4.252 8.632 1.00 0.00 H new ATOM 475 N GLU A 33 -5.204 3.750 3.552 1.00 0.00 N ATOM 476 CA GLU A 33 -5.666 3.031 2.371 1.00 0.00 C ATOM 477 C GLU A 33 -4.927 1.703 2.219 1.00 0.00 C ATOM 478 O GLU A 33 -5.545 0.640 2.158 1.00 0.00 O ATOM 479 CB GLU A 33 -5.469 3.883 1.117 1.00 0.00 C ATOM 480 CG GLU A 33 -6.094 5.265 1.216 1.00 0.00 C ATOM 481 CD GLU A 33 -7.040 5.561 0.067 1.00 0.00 C ATOM 482 OE1 GLU A 33 -6.615 5.425 -1.099 1.00 0.00 O ATOM 483 OE2 GLU A 33 -8.203 5.928 0.335 1.00 0.00 O ATOM 0 H GLU A 33 -4.919 4.713 3.375 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.729 2.824 2.496 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.401 3.989 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.897 3.360 0.262 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.636 5.348 2.158 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.305 6.016 1.235 1.00 0.00 H new ATOM 490 N LEU A 34 -3.603 1.774 2.158 1.00 0.00 N ATOM 491 CA LEU A 34 -2.778 0.581 2.012 1.00 0.00 C ATOM 492 C LEU A 34 -2.995 -0.376 3.180 1.00 0.00 C ATOM 493 O LEU A 34 -3.217 -1.570 2.984 1.00 0.00 O ATOM 494 CB LEU A 34 -1.301 0.964 1.920 1.00 0.00 C ATOM 495 CG LEU A 34 -0.830 1.500 0.567 1.00 0.00 C ATOM 496 CD1 LEU A 34 0.668 1.769 0.591 1.00 0.00 C ATOM 497 CD2 LEU A 34 -1.180 0.523 -0.545 1.00 0.00 C ATOM 0 H LEU A 34 -3.077 2.646 2.207 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.073 0.077 1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.094 1.718 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.703 0.088 2.169 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.344 2.441 0.372 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.985 2.150 -0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 34 0.893 2.507 1.361 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.200 0.843 0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.837 0.921 -1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.694 -0.434 -0.355 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.260 0.381 -0.578 1.00 0.00 H new ATOM 509 N ASN A 35 -2.930 0.157 4.395 1.00 0.00 N ATOM 510 CA ASN A 35 -3.122 -0.649 5.596 1.00 0.00 C ATOM 511 C ASN A 35 -4.405 -1.468 5.503 1.00 0.00 C ATOM 512 O ASN A 35 -4.417 -2.660 5.810 1.00 0.00 O ATOM 513 CB ASN A 35 -3.164 0.246 6.836 1.00 0.00 C ATOM 514 CG ASN A 35 -3.805 -0.443 8.025 1.00 0.00 C ATOM 515 OD1 ASN A 35 -4.652 0.134 8.707 1.00 0.00 O ATOM 516 ND2 ASN A 35 -3.401 -1.682 8.279 1.00 0.00 N ATOM 0 H ASN A 35 -2.746 1.144 4.575 1.00 0.00 H new ATOM 0 HA ASN A 35 -2.279 -1.335 5.680 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -2.150 0.547 7.098 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.717 1.156 6.605 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.796 -2.196 9.067 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.696 -2.120 7.686 1.00 0.00 H new ATOM 523 N ASP A 36 -5.484 -0.820 5.077 1.00 0.00 N ATOM 524 CA ASP A 36 -6.773 -1.489 4.941 1.00 0.00 C ATOM 525 C ASP A 36 -6.777 -2.424 3.736 1.00 0.00 C ATOM 526 O ASP A 36 -7.483 -3.432 3.721 1.00 0.00 O ATOM 527 CB ASP A 36 -7.894 -0.457 4.806 1.00 0.00 C ATOM 528 CG ASP A 36 -9.152 -0.868 5.546 1.00 0.00 C ATOM 529 OD1 ASP A 36 -9.843 -1.796 5.074 1.00 0.00 O ATOM 530 OD2 ASP A 36 -9.445 -0.262 6.597 1.00 0.00 O ATOM 0 H ASP A 36 -5.492 0.167 4.820 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.942 -2.084 5.839 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -7.548 0.503 5.189 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -8.127 -0.314 3.751 1.00 0.00 H new ATOM 535 N LEU A 37 -5.984 -2.082 2.726 1.00 0.00 N ATOM 536 CA LEU A 37 -5.896 -2.889 1.515 1.00 0.00 C ATOM 537 C LEU A 37 -5.224 -4.228 1.802 1.00 0.00 C ATOM 538 O LEU A 37 -5.673 -5.274 1.329 1.00 0.00 O ATOM 539 CB LEU A 37 -5.120 -2.138 0.432 1.00 0.00 C ATOM 540 CG LEU A 37 -5.247 -2.689 -0.989 1.00 0.00 C ATOM 541 CD1 LEU A 37 -4.461 -3.983 -1.132 1.00 0.00 C ATOM 542 CD2 LEU A 37 -6.709 -2.908 -1.348 1.00 0.00 C ATOM 0 H LEU A 37 -5.393 -1.251 2.722 1.00 0.00 H new ATOM 0 HA LEU A 37 -6.909 -3.079 1.160 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.452 -1.100 0.429 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.065 -2.134 0.706 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.830 -1.957 -1.680 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -4.563 -4.360 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.409 -3.795 -0.919 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.847 -4.723 -0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.780 -3.300 -2.363 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.152 -3.620 -0.652 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.244 -1.961 -1.287 1.00 0.00 H new ATOM 554 N PHE A 38 -4.147 -4.190 2.579 1.00 0.00 N ATOM 555 CA PHE A 38 -3.414 -5.400 2.931 1.00 0.00 C ATOM 556 C PHE A 38 -4.097 -6.136 4.079 1.00 0.00 C ATOM 557 O PHE A 38 -4.043 -7.363 4.166 1.00 0.00 O ATOM 558 CB PHE A 38 -1.974 -5.055 3.315 1.00 0.00 C ATOM 559 CG PHE A 38 -1.299 -4.127 2.346 1.00 0.00 C ATOM 560 CD1 PHE A 38 -0.395 -3.177 2.791 1.00 0.00 C ATOM 561 CD2 PHE A 38 -1.571 -4.204 0.990 1.00 0.00 C ATOM 562 CE1 PHE A 38 0.227 -2.322 1.902 1.00 0.00 C ATOM 563 CE2 PHE A 38 -0.952 -3.352 0.095 1.00 0.00 C ATOM 564 CZ PHE A 38 -0.052 -2.409 0.552 1.00 0.00 C ATOM 0 H PHE A 38 -3.762 -3.333 2.977 1.00 0.00 H new ATOM 0 HA PHE A 38 -3.403 -6.055 2.060 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.970 -4.599 4.305 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.395 -5.976 3.386 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.174 -3.104 3.846 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.275 -4.938 0.628 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.931 -1.586 2.262 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -1.172 -3.423 -0.960 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.433 -1.741 -0.145 1.00 0.00 H new ATOM 574 N LYS A 39 -4.741 -5.378 4.960 1.00 0.00 N ATOM 575 CA LYS A 39 -5.436 -5.955 6.104 1.00 0.00 C ATOM 576 C LYS A 39 -6.726 -6.642 5.667 1.00 0.00 C ATOM 577 O LYS A 39 -6.945 -7.816 5.961 1.00 0.00 O ATOM 578 CB LYS A 39 -5.748 -4.872 7.138 1.00 0.00 C ATOM 579 CG LYS A 39 -6.283 -5.419 8.450 1.00 0.00 C ATOM 580 CD LYS A 39 -5.177 -5.578 9.480 1.00 0.00 C ATOM 581 CE LYS A 39 -5.544 -4.916 10.799 1.00 0.00 C ATOM 582 NZ LYS A 39 -4.960 -5.638 11.963 1.00 0.00 N ATOM 0 H LYS A 39 -4.796 -4.361 4.903 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.782 -6.701 6.555 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.842 -4.299 7.336 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.478 -4.180 6.718 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.050 -4.749 8.839 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.760 -6.383 8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.982 -6.638 9.645 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -4.255 -5.140 9.096 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.192 -3.884 10.798 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.629 -4.883 10.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -5.233 -5.156 12.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -5.315 -6.615 11.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.923 -5.648 11.881 1.00 0.00 H new ATOM 596 N ALA A 40 -7.576 -5.903 4.962 1.00 0.00 N ATOM 597 CA ALA A 40 -8.842 -6.442 4.481 1.00 0.00 C ATOM 598 C ALA A 40 -8.616 -7.654 3.585 1.00 0.00 C ATOM 599 O ALA A 40 -9.508 -8.484 3.412 1.00 0.00 O ATOM 600 CB ALA A 40 -9.623 -5.369 3.737 1.00 0.00 C ATOM 0 H ALA A 40 -7.411 -4.928 4.711 1.00 0.00 H new ATOM 0 HA ALA A 40 -9.424 -6.765 5.344 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -10.566 -5.785 3.383 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.824 -4.534 4.408 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.039 -5.018 2.886 1.00 0.00 H new ATOM 606 N ALA A 41 -7.419 -7.750 3.015 1.00 0.00 N ATOM 607 CA ALA A 41 -7.077 -8.862 2.137 1.00 0.00 C ATOM 608 C ALA A 41 -7.249 -10.198 2.851 1.00 0.00 C ATOM 609 O ALA A 41 -7.410 -11.239 2.213 1.00 0.00 O ATOM 610 CB ALA A 41 -5.652 -8.712 1.627 1.00 0.00 C ATOM 0 H ALA A 41 -6.670 -7.070 3.146 1.00 0.00 H new ATOM 0 HA ALA A 41 -7.759 -8.845 1.287 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -5.410 -9.549 0.972 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.561 -7.779 1.071 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -4.963 -8.700 2.471 1.00 0.00 H new ATOM 616 N CYS A 42 -7.211 -10.162 4.179 1.00 0.00 N ATOM 617 CA CYS A 42 -7.360 -11.372 4.981 1.00 0.00 C ATOM 618 C CYS A 42 -6.310 -12.411 4.598 1.00 0.00 C ATOM 619 O CYS A 42 -6.564 -13.294 3.778 1.00 0.00 O ATOM 620 CB CYS A 42 -8.761 -11.958 4.803 1.00 0.00 C ATOM 621 SG CYS A 42 -10.038 -11.123 5.776 1.00 0.00 S ATOM 0 H CYS A 42 -7.078 -9.309 4.723 1.00 0.00 H new ATOM 0 HA CYS A 42 -7.216 -11.104 6.028 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -9.033 -11.909 3.748 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -8.740 -13.012 5.079 1.00 0.00 H new ATOM 0 HG CYS A 42 -11.188 -11.688 5.558 1.00 0.00 H new ATOM 627 N LEU A 43 -5.129 -12.297 5.196 1.00 0.00 N ATOM 628 CA LEU A 43 -4.038 -13.226 4.918 1.00 0.00 C ATOM 629 C LEU A 43 -3.592 -13.938 6.189 1.00 0.00 C ATOM 630 O LEU A 43 -3.824 -13.474 7.306 1.00 0.00 O ATOM 631 CB LEU A 43 -2.857 -12.483 4.294 1.00 0.00 C ATOM 632 CG LEU A 43 -2.933 -12.247 2.784 1.00 0.00 C ATOM 633 CD1 LEU A 43 -2.891 -13.571 2.035 1.00 0.00 C ATOM 634 CD2 LEU A 43 -4.192 -11.471 2.428 1.00 0.00 C ATOM 0 H LEU A 43 -4.902 -11.571 5.876 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.401 -13.975 4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.760 -11.516 4.788 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.947 -13.043 4.508 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.069 -11.655 2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.946 -13.384 0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.961 -14.090 2.266 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.736 -14.188 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.229 -11.312 1.350 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.069 -12.037 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.181 -10.507 2.936 1.00 0.00 H new ATOM 646 N PRO A 44 -2.932 -15.095 6.021 1.00 0.00 N ATOM 647 CA PRO A 44 -2.436 -15.894 7.144 1.00 0.00 C ATOM 648 C PRO A 44 -1.272 -15.222 7.865 1.00 0.00 C ATOM 649 O PRO A 44 -0.799 -15.711 8.892 1.00 0.00 O ATOM 650 CB PRO A 44 -1.974 -17.193 6.478 1.00 0.00 C ATOM 651 CG PRO A 44 -1.656 -16.807 5.075 1.00 0.00 C ATOM 652 CD PRO A 44 -2.619 -15.709 4.719 1.00 0.00 C ATOM 0 HA PRO A 44 -3.199 -16.039 7.909 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.101 -17.608 6.982 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.753 -17.954 6.512 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.625 -16.465 4.989 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -1.767 -17.657 4.402 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -2.173 -14.990 4.032 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -3.513 -16.100 4.234 1.00 0.00 H new ATOM 660 N LEU A 45 -0.814 -14.100 7.321 1.00 0.00 N ATOM 661 CA LEU A 45 0.295 -13.360 7.912 1.00 0.00 C ATOM 662 C LEU A 45 -0.140 -12.664 9.199 1.00 0.00 C ATOM 663 O LEU A 45 -1.303 -12.306 9.378 1.00 0.00 O ATOM 664 CB LEU A 45 0.834 -12.329 6.919 1.00 0.00 C ATOM 665 CG LEU A 45 2.056 -12.756 6.105 1.00 0.00 C ATOM 666 CD1 LEU A 45 1.745 -14.002 5.290 1.00 0.00 C ATOM 667 CD2 LEU A 45 2.514 -11.624 5.198 1.00 0.00 C ATOM 0 H LEU A 45 -1.194 -13.683 6.471 1.00 0.00 H new ATOM 0 HA LEU A 45 1.086 -14.070 8.153 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.034 -12.069 6.226 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.087 -11.422 7.469 1.00 0.00 H new ATOM 0 HG LEU A 45 2.865 -12.991 6.796 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.626 -14.291 4.717 1.00 0.00 H new ATOM 0 HD12 LEU A 45 1.465 -14.815 5.960 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.921 -13.794 4.608 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.385 -11.945 4.626 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.709 -11.358 4.514 1.00 0.00 H new ATOM 0 HD23 LEU A 45 2.778 -10.757 5.803 1.00 0.00 H new ATOM 679 N PRO A 46 0.818 -12.467 10.118 1.00 0.00 N ATOM 680 CA PRO A 46 0.560 -11.811 11.403 1.00 0.00 C ATOM 681 C PRO A 46 0.268 -10.323 11.245 1.00 0.00 C ATOM 682 O PRO A 46 0.050 -9.837 10.136 1.00 0.00 O ATOM 683 CB PRO A 46 1.862 -12.021 12.177 1.00 0.00 C ATOM 684 CG PRO A 46 2.906 -12.184 11.126 1.00 0.00 C ATOM 685 CD PRO A 46 2.227 -12.870 9.972 1.00 0.00 C ATOM 0 HA PRO A 46 -0.318 -12.222 11.901 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.080 -11.171 12.823 1.00 0.00 H new ATOM 0 HB3 PRO A 46 1.804 -12.901 12.817 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.309 -11.218 10.823 1.00 0.00 H new ATOM 0 HG3 PRO A 46 3.743 -12.777 11.495 1.00 0.00 H new ATOM 0 HD2 PRO A 46 2.640 -12.550 9.015 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.343 -13.953 10.023 1.00 0.00 H new ATOM 693 N GLY A 47 0.264 -9.603 12.363 1.00 0.00 N ATOM 694 CA GLY A 47 -0.002 -8.177 12.326 1.00 0.00 C ATOM 695 C GLY A 47 1.217 -7.370 11.927 1.00 0.00 C ATOM 696 O GLY A 47 1.142 -6.515 11.043 1.00 0.00 O ATOM 0 H GLY A 47 0.440 -9.982 13.293 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.811 -7.980 11.622 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.346 -7.849 13.307 1.00 0.00 H new ATOM 700 N TYR A 48 2.343 -7.639 12.580 1.00 0.00 N ATOM 701 CA TYR A 48 3.582 -6.928 12.290 1.00 0.00 C ATOM 702 C TYR A 48 3.953 -7.056 10.816 1.00 0.00 C ATOM 703 O TYR A 48 4.580 -6.166 10.242 1.00 0.00 O ATOM 704 CB TYR A 48 4.719 -7.465 13.162 1.00 0.00 C ATOM 705 CG TYR A 48 5.420 -8.667 12.569 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.515 -8.511 11.728 1.00 0.00 C ATOM 707 CD2 TYR A 48 4.988 -9.957 12.849 1.00 0.00 C ATOM 708 CE1 TYR A 48 7.159 -9.605 11.184 1.00 0.00 C ATOM 709 CE2 TYR A 48 5.627 -11.057 12.311 1.00 0.00 C ATOM 710 CZ TYR A 48 6.712 -10.875 11.479 1.00 0.00 C ATOM 711 OH TYR A 48 7.350 -11.969 10.939 1.00 0.00 O ATOM 0 H TYR A 48 2.423 -8.344 13.313 1.00 0.00 H new ATOM 0 HA TYR A 48 3.426 -5.873 12.516 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.449 -6.671 13.322 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.320 -7.733 14.140 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.869 -7.517 11.496 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.138 -10.102 13.499 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.008 -9.466 10.531 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.279 -12.053 12.540 1.00 0.00 H new ATOM 0 HH TYR A 48 6.911 -12.789 11.248 1.00 0.00 H new ATOM 721 N ARG A 49 3.561 -8.172 10.209 1.00 0.00 N ATOM 722 CA ARG A 49 3.851 -8.419 8.802 1.00 0.00 C ATOM 723 C ARG A 49 3.206 -7.355 7.919 1.00 0.00 C ATOM 724 O ARG A 49 3.895 -6.607 7.225 1.00 0.00 O ATOM 725 CB ARG A 49 3.354 -9.807 8.393 1.00 0.00 C ATOM 726 CG ARG A 49 4.473 -10.795 8.109 1.00 0.00 C ATOM 727 CD ARG A 49 5.384 -10.301 6.996 1.00 0.00 C ATOM 728 NE ARG A 49 5.684 -11.351 6.027 1.00 0.00 N ATOM 729 CZ ARG A 49 6.508 -11.187 4.997 1.00 0.00 C ATOM 730 NH1 ARG A 49 7.110 -10.022 4.804 1.00 0.00 N ATOM 731 NH2 ARG A 49 6.730 -12.191 4.158 1.00 0.00 N ATOM 0 H ARG A 49 3.042 -8.919 10.670 1.00 0.00 H new ATOM 0 HA ARG A 49 4.931 -8.373 8.666 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.722 -10.206 9.186 1.00 0.00 H new ATOM 0 HB3 ARG A 49 2.730 -9.713 7.505 1.00 0.00 H new ATOM 0 HG2 ARG A 49 5.058 -10.955 9.015 1.00 0.00 H new ATOM 0 HG3 ARG A 49 4.047 -11.759 7.831 1.00 0.00 H new ATOM 0 HD2 ARG A 49 4.911 -9.462 6.486 1.00 0.00 H new ATOM 0 HD3 ARG A 49 6.314 -9.929 7.427 1.00 0.00 H new ATOM 0 HE ARG A 49 5.237 -12.260 6.147 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.942 -9.248 5.447 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.742 -9.899 4.013 1.00 0.00 H new ATOM 0 HH21 ARG A 49 6.268 -13.089 4.303 1.00 0.00 H new ATOM 0 HH22 ARG A 49 7.362 -12.065 3.368 1.00 0.00 H new ATOM 745 N VAL A 50 1.879 -7.293 7.948 1.00 0.00 N ATOM 746 CA VAL A 50 1.140 -6.321 7.151 1.00 0.00 C ATOM 747 C VAL A 50 1.563 -4.897 7.492 1.00 0.00 C ATOM 748 O VAL A 50 1.645 -4.036 6.616 1.00 0.00 O ATOM 749 CB VAL A 50 -0.379 -6.459 7.364 1.00 0.00 C ATOM 750 CG1 VAL A 50 -0.717 -6.414 8.846 1.00 0.00 C ATOM 751 CG2 VAL A 50 -1.124 -5.371 6.606 1.00 0.00 C ATOM 0 H VAL A 50 1.293 -7.905 8.516 1.00 0.00 H new ATOM 0 HA VAL A 50 1.372 -6.526 6.106 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.697 -7.425 6.973 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -1.795 -6.513 8.977 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.213 -7.233 9.359 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -0.386 -5.464 9.266 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.196 -5.484 6.768 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -0.804 -4.393 6.965 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.907 -5.456 5.541 1.00 0.00 H new ATOM 761 N ARG A 51 1.830 -4.655 8.771 1.00 0.00 N ATOM 762 CA ARG A 51 2.245 -3.333 9.229 1.00 0.00 C ATOM 763 C ARG A 51 3.647 -3.000 8.727 1.00 0.00 C ATOM 764 O ARG A 51 3.984 -1.833 8.534 1.00 0.00 O ATOM 765 CB ARG A 51 2.207 -3.265 10.756 1.00 0.00 C ATOM 766 CG ARG A 51 1.789 -1.907 11.294 1.00 0.00 C ATOM 767 CD ARG A 51 2.370 -1.652 12.676 1.00 0.00 C ATOM 768 NE ARG A 51 1.338 -1.638 13.710 1.00 0.00 N ATOM 769 CZ ARG A 51 1.602 -1.649 15.012 1.00 0.00 C ATOM 770 NH1 ARG A 51 2.858 -1.672 15.438 1.00 0.00 N ATOM 771 NH2 ARG A 51 0.608 -1.635 15.891 1.00 0.00 N ATOM 0 H ARG A 51 1.767 -5.356 9.509 1.00 0.00 H new ATOM 0 HA ARG A 51 1.549 -2.599 8.823 1.00 0.00 H new ATOM 0 HB2 ARG A 51 1.517 -4.022 11.128 1.00 0.00 H new ATOM 0 HB3 ARG A 51 3.194 -3.513 11.147 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.120 -1.126 10.609 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.701 -1.852 11.340 1.00 0.00 H new ATOM 0 HD2 ARG A 51 3.105 -2.423 12.908 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.897 -0.698 12.677 1.00 0.00 H new ATOM 0 HE ARG A 51 0.361 -1.619 13.416 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.625 -1.681 14.765 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.057 -1.680 16.438 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.359 -1.616 15.567 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.811 -1.643 16.891 1.00 0.00 H new ATOM 785 N GLU A 52 4.456 -4.032 8.519 1.00 0.00 N ATOM 786 CA GLU A 52 5.822 -3.847 8.042 1.00 0.00 C ATOM 787 C GLU A 52 5.838 -3.522 6.552 1.00 0.00 C ATOM 788 O GLU A 52 6.542 -2.612 6.112 1.00 0.00 O ATOM 789 CB GLU A 52 6.654 -5.102 8.310 1.00 0.00 C ATOM 790 CG GLU A 52 8.136 -4.923 8.024 1.00 0.00 C ATOM 791 CD GLU A 52 8.621 -5.797 6.883 1.00 0.00 C ATOM 792 OE1 GLU A 52 9.052 -6.938 7.151 1.00 0.00 O ATOM 793 OE2 GLU A 52 8.567 -5.340 5.722 1.00 0.00 O ATOM 0 H GLU A 52 4.191 -5.005 8.673 1.00 0.00 H new ATOM 0 HA GLU A 52 6.258 -3.008 8.584 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.527 -5.396 9.352 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.271 -5.919 7.699 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.332 -3.878 7.785 1.00 0.00 H new ATOM 0 HG3 GLU A 52 8.706 -5.156 8.923 1.00 0.00 H new ATOM 800 N ILE A 53 5.058 -4.271 5.779 1.00 0.00 N ATOM 801 CA ILE A 53 4.982 -4.063 4.339 1.00 0.00 C ATOM 802 C ILE A 53 4.352 -2.713 4.012 1.00 0.00 C ATOM 803 O ILE A 53 4.768 -2.031 3.074 1.00 0.00 O ATOM 804 CB ILE A 53 4.169 -5.175 3.651 1.00 0.00 C ATOM 805 CG1 ILE A 53 2.770 -5.268 4.264 1.00 0.00 C ATOM 806 CG2 ILE A 53 4.894 -6.508 3.767 1.00 0.00 C ATOM 807 CD1 ILE A 53 1.909 -6.345 3.642 1.00 0.00 C ATOM 0 H ILE A 53 4.469 -5.028 6.127 1.00 0.00 H new ATOM 0 HA ILE A 53 6.005 -4.086 3.963 1.00 0.00 H new ATOM 0 HB ILE A 53 4.066 -4.930 2.594 1.00 0.00 H new ATOM 0 HG12 ILE A 53 2.862 -5.460 5.333 1.00 0.00 H new ATOM 0 HG13 ILE A 53 2.270 -4.306 4.155 1.00 0.00 H new ATOM 0 HG21 ILE A 53 4.308 -7.285 3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 53 5.871 -6.434 3.289 1.00 0.00 H new ATOM 0 HG23 ILE A 53 5.024 -6.761 4.819 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.932 -6.354 4.125 1.00 0.00 H new ATOM 0 HD12 ILE A 53 1.786 -6.143 2.578 1.00 0.00 H new ATOM 0 HD13 ILE A 53 2.388 -7.315 3.774 1.00 0.00 H new ATOM 819 N THR A 54 3.347 -2.330 4.793 1.00 0.00 N ATOM 820 CA THR A 54 2.659 -1.060 4.588 1.00 0.00 C ATOM 821 C THR A 54 3.525 0.112 5.033 1.00 0.00 C ATOM 822 O THR A 54 3.524 1.169 4.403 1.00 0.00 O ATOM 823 CB THR A 54 1.322 -1.016 5.351 1.00 0.00 C ATOM 824 OG1 THR A 54 0.570 0.136 4.954 1.00 0.00 O ATOM 825 CG2 THR A 54 1.558 -0.982 6.853 1.00 0.00 C ATOM 0 H THR A 54 2.991 -2.881 5.574 1.00 0.00 H new ATOM 0 HA THR A 54 2.461 -0.976 3.519 1.00 0.00 H new ATOM 0 HB THR A 54 0.759 -1.918 5.108 1.00 0.00 H new ATOM 0 HG1 THR A 54 -0.279 0.156 5.442 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.600 -0.951 7.371 1.00 0.00 H new ATOM 0 HG22 THR A 54 2.106 -1.875 7.156 1.00 0.00 H new ATOM 0 HG23 THR A 54 2.138 -0.096 7.110 1.00 0.00 H new ATOM 833 N GLU A 55 4.263 -0.083 6.122 1.00 0.00 N ATOM 834 CA GLU A 55 5.134 0.960 6.649 1.00 0.00 C ATOM 835 C GLU A 55 6.285 1.246 5.690 1.00 0.00 C ATOM 836 O GLU A 55 6.576 2.400 5.380 1.00 0.00 O ATOM 837 CB GLU A 55 5.685 0.551 8.018 1.00 0.00 C ATOM 838 CG GLU A 55 4.803 0.974 9.180 1.00 0.00 C ATOM 839 CD GLU A 55 5.490 0.810 10.522 1.00 0.00 C ATOM 840 OE1 GLU A 55 4.972 1.352 11.522 1.00 0.00 O ATOM 841 OE2 GLU A 55 6.543 0.142 10.574 1.00 0.00 O ATOM 0 H GLU A 55 4.275 -0.952 6.655 1.00 0.00 H new ATOM 0 HA GLU A 55 4.543 1.869 6.759 1.00 0.00 H new ATOM 0 HB2 GLU A 55 5.808 -0.532 8.042 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.675 0.988 8.147 1.00 0.00 H new ATOM 0 HG2 GLU A 55 4.512 2.016 9.050 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.887 0.383 9.170 1.00 0.00 H new ATOM 848 N ASN A 56 6.937 0.185 5.225 1.00 0.00 N ATOM 849 CA ASN A 56 8.057 0.321 4.301 1.00 0.00 C ATOM 850 C ASN A 56 7.583 0.823 2.941 1.00 0.00 C ATOM 851 O ASN A 56 8.216 1.685 2.329 1.00 0.00 O ATOM 852 CB ASN A 56 8.779 -1.019 4.140 1.00 0.00 C ATOM 853 CG ASN A 56 9.525 -1.428 5.396 1.00 0.00 C ATOM 854 OD1 ASN A 56 9.521 -0.709 6.395 1.00 0.00 O ATOM 855 ND2 ASN A 56 10.169 -2.587 5.349 1.00 0.00 N ATOM 0 H ASN A 56 6.709 -0.778 5.473 1.00 0.00 H new ATOM 0 HA ASN A 56 8.751 1.052 4.716 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.054 -1.791 3.884 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.481 -0.953 3.309 1.00 0.00 H new ATOM 0 HD21 ASN A 56 10.689 -2.915 6.163 1.00 0.00 H new ATOM 0 HD22 ASN A 56 10.144 -3.150 4.499 1.00 0.00 H new ATOM 862 N LEU A 57 6.466 0.279 2.472 1.00 0.00 N ATOM 863 CA LEU A 57 5.905 0.670 1.184 1.00 0.00 C ATOM 864 C LEU A 57 5.582 2.161 1.161 1.00 0.00 C ATOM 865 O LEU A 57 5.895 2.859 0.197 1.00 0.00 O ATOM 866 CB LEU A 57 4.643 -0.142 0.887 1.00 0.00 C ATOM 867 CG LEU A 57 4.001 0.093 -0.481 1.00 0.00 C ATOM 868 CD1 LEU A 57 5.033 -0.057 -1.588 1.00 0.00 C ATOM 869 CD2 LEU A 57 2.841 -0.868 -0.697 1.00 0.00 C ATOM 0 H LEU A 57 5.930 -0.435 2.965 1.00 0.00 H new ATOM 0 HA LEU A 57 6.649 0.466 0.414 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.887 -1.201 0.975 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.903 0.079 1.656 1.00 0.00 H new ATOM 0 HG LEU A 57 3.614 1.111 -0.509 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.558 0.114 -2.554 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.831 0.671 -1.442 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.451 -1.063 -1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.396 -0.687 -1.675 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.205 -1.894 -0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.090 -0.712 0.078 1.00 0.00 H new ATOM 881 N MET A 58 4.955 2.642 2.230 1.00 0.00 N ATOM 882 CA MET A 58 4.593 4.051 2.335 1.00 0.00 C ATOM 883 C MET A 58 5.832 4.917 2.536 1.00 0.00 C ATOM 884 O MET A 58 5.909 6.035 2.029 1.00 0.00 O ATOM 885 CB MET A 58 3.614 4.264 3.490 1.00 0.00 C ATOM 886 CG MET A 58 2.200 3.802 3.182 1.00 0.00 C ATOM 887 SD MET A 58 1.412 4.787 1.893 1.00 0.00 S ATOM 888 CE MET A 58 1.441 6.412 2.645 1.00 0.00 C ATOM 0 H MET A 58 4.687 2.077 3.036 1.00 0.00 H new ATOM 0 HA MET A 58 4.112 4.347 1.403 1.00 0.00 H new ATOM 0 HB2 MET A 58 3.979 3.730 4.367 1.00 0.00 H new ATOM 0 HB3 MET A 58 3.593 5.323 3.747 1.00 0.00 H new ATOM 0 HG2 MET A 58 2.223 2.757 2.872 1.00 0.00 H new ATOM 0 HG3 MET A 58 1.600 3.852 4.090 1.00 0.00 H new ATOM 0 HE1 MET A 58 0.820 7.093 2.064 1.00 0.00 H new ATOM 0 HE2 MET A 58 1.056 6.349 3.663 1.00 0.00 H new ATOM 0 HE3 MET A 58 2.465 6.784 2.667 1.00 0.00 H new ATOM 898 N ALA A 59 6.801 4.392 3.280 1.00 0.00 N ATOM 899 CA ALA A 59 8.037 5.117 3.547 1.00 0.00 C ATOM 900 C ALA A 59 8.881 5.248 2.284 1.00 0.00 C ATOM 901 O ALA A 59 9.521 6.275 2.054 1.00 0.00 O ATOM 902 CB ALA A 59 8.830 4.423 4.644 1.00 0.00 C ATOM 0 H ALA A 59 6.753 3.467 3.708 1.00 0.00 H new ATOM 0 HA ALA A 59 7.775 6.120 3.883 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.750 4.976 4.833 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.235 4.387 5.556 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.074 3.408 4.330 1.00 0.00 H new ATOM 908 N THR A 60 8.879 4.200 1.465 1.00 0.00 N ATOM 909 CA THR A 60 9.645 4.197 0.225 1.00 0.00 C ATOM 910 C THR A 60 8.760 4.529 -0.970 1.00 0.00 C ATOM 911 O THR A 60 9.198 4.461 -2.117 1.00 0.00 O ATOM 912 CB THR A 60 10.321 2.834 -0.014 1.00 0.00 C ATOM 913 OG1 THR A 60 11.275 2.939 -1.076 1.00 0.00 O ATOM 914 CG2 THR A 60 9.288 1.770 -0.356 1.00 0.00 C ATOM 0 H THR A 60 8.355 3.342 1.639 1.00 0.00 H new ATOM 0 HA THR A 60 10.414 4.963 0.327 1.00 0.00 H new ATOM 0 HB THR A 60 10.831 2.541 0.904 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.897 3.476 -1.804 1.00 0.00 H new ATOM 0 HG21 THR A 60 9.789 0.816 -0.521 1.00 0.00 H new ATOM 0 HG22 THR A 60 8.581 1.671 0.468 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.753 2.060 -1.261 1.00 0.00 H new ATOM 922 N GLY A 61 7.509 4.888 -0.693 1.00 0.00 N ATOM 923 CA GLY A 61 6.582 5.226 -1.757 1.00 0.00 C ATOM 924 C GLY A 61 6.403 6.722 -1.916 1.00 0.00 C ATOM 925 O GLY A 61 6.074 7.203 -3.001 1.00 0.00 O ATOM 0 H GLY A 61 7.122 4.951 0.249 1.00 0.00 H new ATOM 0 HA2 GLY A 61 6.942 4.804 -2.696 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.615 4.767 -1.551 1.00 0.00 H new ATOM 929 N ASP A 62 6.618 7.462 -0.833 1.00 0.00 N ATOM 930 CA ASP A 62 6.478 8.913 -0.858 1.00 0.00 C ATOM 931 C ASP A 62 7.844 9.589 -0.928 1.00 0.00 C ATOM 932 O ASP A 62 8.626 9.533 0.022 1.00 0.00 O ATOM 933 CB ASP A 62 5.720 9.394 0.380 1.00 0.00 C ATOM 934 CG ASP A 62 4.842 10.595 0.090 1.00 0.00 C ATOM 935 OD1 ASP A 62 4.845 11.068 -1.066 1.00 0.00 O ATOM 936 OD2 ASP A 62 4.151 11.063 1.019 1.00 0.00 O ATOM 0 H ASP A 62 6.890 7.080 0.073 1.00 0.00 H new ATOM 0 HA ASP A 62 5.912 9.184 -1.749 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.104 8.581 0.764 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.434 9.650 1.163 1.00 0.00 H new ATOM 941 N LEU A 63 8.125 10.226 -2.060 1.00 0.00 N ATOM 942 CA LEU A 63 9.397 10.913 -2.255 1.00 0.00 C ATOM 943 C LEU A 63 9.428 12.230 -1.488 1.00 0.00 C ATOM 944 O LEU A 63 10.422 12.560 -0.840 1.00 0.00 O ATOM 945 CB LEU A 63 9.637 11.170 -3.744 1.00 0.00 C ATOM 946 CG LEU A 63 10.207 10.000 -4.545 1.00 0.00 C ATOM 947 CD1 LEU A 63 9.121 8.977 -4.841 1.00 0.00 C ATOM 948 CD2 LEU A 63 10.843 10.495 -5.835 1.00 0.00 C ATOM 0 H LEU A 63 7.490 10.281 -2.856 1.00 0.00 H new ATOM 0 HA LEU A 63 10.191 10.272 -1.871 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.692 11.468 -4.197 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.318 12.016 -3.841 1.00 0.00 H new ATOM 0 HG LEU A 63 10.979 9.517 -3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.545 8.151 -5.412 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.713 8.598 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.326 9.447 -5.419 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.243 9.648 -6.392 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.092 11.004 -6.439 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.650 11.189 -5.600 1.00 0.00 H new ATOM 960 N ASP A 64 8.333 12.980 -1.564 1.00 0.00 N ATOM 961 CA ASP A 64 8.233 14.260 -0.874 1.00 0.00 C ATOM 962 C ASP A 64 7.766 14.067 0.566 1.00 0.00 C ATOM 963 O ASP A 64 7.909 14.961 1.399 1.00 0.00 O ATOM 964 CB ASP A 64 7.271 15.190 -1.616 1.00 0.00 C ATOM 965 CG ASP A 64 5.973 14.500 -1.988 1.00 0.00 C ATOM 966 OD1 ASP A 64 5.350 14.911 -2.991 1.00 0.00 O ATOM 967 OD2 ASP A 64 5.580 13.552 -1.278 1.00 0.00 O ATOM 0 H ASP A 64 7.502 12.723 -2.097 1.00 0.00 H new ATOM 0 HA ASP A 64 9.224 14.714 -0.857 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.053 16.056 -0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 64 7.754 15.562 -2.520 1.00 0.00 H new ATOM 972 N GLN A 65 7.206 12.895 0.848 1.00 0.00 N ATOM 973 CA GLN A 65 6.715 12.586 2.187 1.00 0.00 C ATOM 974 C GLN A 65 5.657 13.594 2.624 1.00 0.00 C ATOM 975 O GLN A 65 5.828 14.292 3.624 1.00 0.00 O ATOM 976 CB GLN A 65 7.873 12.576 3.187 1.00 0.00 C ATOM 977 CG GLN A 65 9.058 11.737 2.737 1.00 0.00 C ATOM 978 CD GLN A 65 10.273 11.921 3.624 1.00 0.00 C ATOM 979 OE1 GLN A 65 10.689 10.999 4.326 1.00 0.00 O ATOM 980 NE2 GLN A 65 10.850 13.116 3.597 1.00 0.00 N ATOM 0 H GLN A 65 7.081 12.144 0.169 1.00 0.00 H new ATOM 0 HA GLN A 65 6.258 11.597 2.161 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.206 13.600 3.355 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.513 12.198 4.144 1.00 0.00 H new ATOM 0 HG2 GLN A 65 8.773 10.685 2.732 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.318 12.002 1.712 1.00 0.00 H new ATOM 0 HE21 GLN A 65 10.472 13.852 3.000 1.00 0.00 H new ATOM 0 HE22 GLN A 65 11.672 13.299 4.173 1.00 0.00 H new ATOM 989 N ASP A 66 4.567 13.664 1.870 1.00 0.00 N ATOM 990 CA ASP A 66 3.480 14.587 2.181 1.00 0.00 C ATOM 991 C ASP A 66 2.347 13.867 2.906 1.00 0.00 C ATOM 992 O ASP A 66 1.377 14.490 3.336 1.00 0.00 O ATOM 993 CB ASP A 66 2.952 15.237 0.901 1.00 0.00 C ATOM 994 CG ASP A 66 2.334 14.229 -0.048 1.00 0.00 C ATOM 995 OD1 ASP A 66 1.567 14.646 -0.941 1.00 0.00 O ATOM 996 OD2 ASP A 66 2.617 13.021 0.103 1.00 0.00 O ATOM 0 H ASP A 66 4.411 13.093 1.039 1.00 0.00 H new ATOM 0 HA ASP A 66 3.872 15.363 2.838 1.00 0.00 H new ATOM 0 HB2 ASP A 66 2.209 15.991 1.160 1.00 0.00 H new ATOM 0 HB3 ASP A 66 3.768 15.754 0.396 1.00 0.00 H new ATOM 1001 N GLY A 67 2.476 12.550 3.036 1.00 0.00 N ATOM 1002 CA GLY A 67 1.456 11.767 3.709 1.00 0.00 C ATOM 1003 C GLY A 67 0.619 10.954 2.741 1.00 0.00 C ATOM 1004 O GLY A 67 -0.342 10.297 3.142 1.00 0.00 O ATOM 0 H GLY A 67 3.269 12.011 2.687 1.00 0.00 H new ATOM 0 HA2 GLY A 67 1.930 11.097 4.426 1.00 0.00 H new ATOM 0 HA3 GLY A 67 0.806 12.433 4.276 1.00 0.00 H new ATOM 1008 N ARG A 68 0.982 10.999 1.464 1.00 0.00 N ATOM 1009 CA ARG A 68 0.255 10.264 0.436 1.00 0.00 C ATOM 1010 C ARG A 68 1.159 9.956 -0.754 1.00 0.00 C ATOM 1011 O ARG A 68 2.187 10.606 -0.950 1.00 0.00 O ATOM 1012 CB ARG A 68 -0.963 11.063 -0.028 1.00 0.00 C ATOM 1013 CG ARG A 68 -0.692 12.550 -0.186 1.00 0.00 C ATOM 1014 CD ARG A 68 -1.424 13.366 0.868 1.00 0.00 C ATOM 1015 NE ARG A 68 -2.768 13.741 0.435 1.00 0.00 N ATOM 1016 CZ ARG A 68 -3.557 14.561 1.118 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -3.141 15.090 2.260 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -4.766 14.856 0.658 1.00 0.00 N ATOM 0 H ARG A 68 1.776 11.537 1.116 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.081 9.322 0.868 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.308 10.662 -0.981 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -1.773 10.924 0.689 1.00 0.00 H new ATOM 0 HG2 ARG A 68 0.380 12.735 -0.111 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -1.003 12.874 -1.179 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.488 12.791 1.792 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.851 14.266 1.092 1.00 0.00 H new ATOM 0 HE ARG A 68 -3.119 13.351 -0.440 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -2.212 14.867 2.617 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -3.750 15.720 2.782 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.090 14.452 -0.221 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -5.372 15.486 1.183 1.00 0.00 H new ATOM 1032 N ILE A 69 0.769 8.962 -1.545 1.00 0.00 N ATOM 1033 CA ILE A 69 1.544 8.569 -2.715 1.00 0.00 C ATOM 1034 C ILE A 69 0.789 8.881 -4.004 1.00 0.00 C ATOM 1035 O ILE A 69 -0.410 8.623 -4.111 1.00 0.00 O ATOM 1036 CB ILE A 69 1.887 7.069 -2.686 1.00 0.00 C ATOM 1037 CG1 ILE A 69 2.412 6.670 -1.304 1.00 0.00 C ATOM 1038 CG2 ILE A 69 2.911 6.738 -3.762 1.00 0.00 C ATOM 1039 CD1 ILE A 69 2.775 5.206 -1.195 1.00 0.00 C ATOM 0 H ILE A 69 -0.079 8.414 -1.397 1.00 0.00 H new ATOM 0 HA ILE A 69 2.469 9.145 -2.689 1.00 0.00 H new ATOM 0 HB ILE A 69 0.979 6.500 -2.888 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.290 7.272 -1.070 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.656 6.905 -0.555 1.00 0.00 H new ATOM 0 HG21 ILE A 69 3.143 5.674 -3.728 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.504 6.990 -4.741 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.820 7.313 -3.588 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.139 4.995 -0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.894 4.597 -1.397 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.554 4.969 -1.920 1.00 0.00 H new ATOM 1051 N SER A 70 1.500 9.435 -4.981 1.00 0.00 N ATOM 1052 CA SER A 70 0.897 9.784 -6.261 1.00 0.00 C ATOM 1053 C SER A 70 1.086 8.659 -7.275 1.00 0.00 C ATOM 1054 O SER A 70 1.946 7.794 -7.106 1.00 0.00 O ATOM 1055 CB SER A 70 1.507 11.079 -6.801 1.00 0.00 C ATOM 1056 OG SER A 70 1.138 11.293 -8.152 1.00 0.00 O ATOM 0 H SER A 70 2.494 9.652 -4.910 1.00 0.00 H new ATOM 0 HA SER A 70 -0.171 9.932 -6.102 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.177 11.921 -6.193 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.593 11.034 -6.720 1.00 0.00 H new ATOM 0 HG SER A 70 1.539 12.128 -8.472 1.00 0.00 H new ATOM 1062 N PHE A 71 0.276 8.678 -8.328 1.00 0.00 N ATOM 1063 CA PHE A 71 0.352 7.660 -9.370 1.00 0.00 C ATOM 1064 C PHE A 71 1.794 7.455 -9.825 1.00 0.00 C ATOM 1065 O PHE A 71 2.303 6.334 -9.822 1.00 0.00 O ATOM 1066 CB PHE A 71 -0.521 8.054 -10.562 1.00 0.00 C ATOM 1067 CG PHE A 71 -1.956 7.634 -10.421 1.00 0.00 C ATOM 1068 CD1 PHE A 71 -2.684 7.225 -11.526 1.00 0.00 C ATOM 1069 CD2 PHE A 71 -2.577 7.648 -9.182 1.00 0.00 C ATOM 1070 CE1 PHE A 71 -4.004 6.836 -11.400 1.00 0.00 C ATOM 1071 CE2 PHE A 71 -3.896 7.260 -9.049 1.00 0.00 C ATOM 1072 CZ PHE A 71 -4.612 6.855 -10.159 1.00 0.00 C ATOM 0 H PHE A 71 -0.441 9.387 -8.483 1.00 0.00 H new ATOM 0 HA PHE A 71 -0.016 6.722 -8.955 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -0.479 9.136 -10.691 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -0.108 7.609 -11.467 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.214 7.210 -12.498 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.023 7.966 -8.311 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -4.560 6.518 -12.270 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.368 7.273 -8.077 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.644 6.554 -10.057 1.00 0.00 H new ATOM 1082 N ASP A 72 2.445 8.544 -10.217 1.00 0.00 N ATOM 1083 CA ASP A 72 3.828 8.485 -10.676 1.00 0.00 C ATOM 1084 C ASP A 72 4.720 7.826 -9.628 1.00 0.00 C ATOM 1085 O ASP A 72 5.567 6.995 -9.955 1.00 0.00 O ATOM 1086 CB ASP A 72 4.343 9.890 -10.991 1.00 0.00 C ATOM 1087 CG ASP A 72 3.451 10.629 -11.969 1.00 0.00 C ATOM 1088 OD1 ASP A 72 2.769 9.959 -12.772 1.00 0.00 O ATOM 1089 OD2 ASP A 72 3.432 11.876 -11.929 1.00 0.00 O ATOM 0 H ASP A 72 2.037 9.479 -10.226 1.00 0.00 H new ATOM 0 HA ASP A 72 3.859 7.883 -11.584 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.416 10.463 -10.066 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.350 9.821 -11.403 1.00 0.00 H new ATOM 1094 N GLU A 73 4.523 8.203 -8.368 1.00 0.00 N ATOM 1095 CA GLU A 73 5.312 7.649 -7.274 1.00 0.00 C ATOM 1096 C GLU A 73 5.189 6.128 -7.230 1.00 0.00 C ATOM 1097 O GLU A 73 6.173 5.410 -7.410 1.00 0.00 O ATOM 1098 CB GLU A 73 4.862 8.246 -5.939 1.00 0.00 C ATOM 1099 CG GLU A 73 5.678 9.454 -5.507 1.00 0.00 C ATOM 1100 CD GLU A 73 4.859 10.460 -4.722 1.00 0.00 C ATOM 1101 OE1 GLU A 73 4.495 11.506 -5.297 1.00 0.00 O ATOM 1102 OE2 GLU A 73 4.583 10.202 -3.532 1.00 0.00 O ATOM 0 H GLU A 73 3.825 8.889 -8.080 1.00 0.00 H new ATOM 0 HA GLU A 73 6.357 7.907 -7.446 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.814 8.534 -6.014 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.927 7.479 -5.167 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.519 9.121 -4.898 1.00 0.00 H new ATOM 0 HG3 GLU A 73 6.096 9.940 -6.389 1.00 0.00 H new ATOM 1109 N PHE A 74 3.975 5.646 -6.989 1.00 0.00 N ATOM 1110 CA PHE A 74 3.723 4.211 -6.920 1.00 0.00 C ATOM 1111 C PHE A 74 4.244 3.506 -8.170 1.00 0.00 C ATOM 1112 O PHE A 74 5.081 2.607 -8.084 1.00 0.00 O ATOM 1113 CB PHE A 74 2.226 3.942 -6.756 1.00 0.00 C ATOM 1114 CG PHE A 74 1.876 3.270 -5.460 1.00 0.00 C ATOM 1115 CD1 PHE A 74 0.932 3.822 -4.610 1.00 0.00 C ATOM 1116 CD2 PHE A 74 2.492 2.084 -5.091 1.00 0.00 C ATOM 1117 CE1 PHE A 74 0.607 3.205 -3.417 1.00 0.00 C ATOM 1118 CE2 PHE A 74 2.171 1.464 -3.899 1.00 0.00 C ATOM 1119 CZ PHE A 74 1.229 2.025 -3.060 1.00 0.00 C ATOM 0 H PHE A 74 3.150 6.227 -6.838 1.00 0.00 H new ATOM 0 HA PHE A 74 4.253 3.816 -6.054 1.00 0.00 H new ATOM 0 HB2 PHE A 74 1.686 4.886 -6.824 1.00 0.00 H new ATOM 0 HB3 PHE A 74 1.884 3.319 -7.583 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.444 4.746 -4.883 1.00 0.00 H new ATOM 0 HD2 PHE A 74 3.230 1.640 -5.742 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.133 3.645 -2.765 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.657 0.540 -3.623 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.979 1.542 -2.127 1.00 0.00 H new ATOM 1129 N ILE A 75 3.742 3.922 -9.328 1.00 0.00 N ATOM 1130 CA ILE A 75 4.157 3.331 -10.595 1.00 0.00 C ATOM 1131 C ILE A 75 5.677 3.299 -10.716 1.00 0.00 C ATOM 1132 O ILE A 75 6.258 2.294 -11.121 1.00 0.00 O ATOM 1133 CB ILE A 75 3.573 4.102 -11.793 1.00 0.00 C ATOM 1134 CG1 ILE A 75 2.047 4.145 -11.706 1.00 0.00 C ATOM 1135 CG2 ILE A 75 4.017 3.464 -13.101 1.00 0.00 C ATOM 1136 CD1 ILE A 75 1.421 5.210 -12.579 1.00 0.00 C ATOM 0 H ILE A 75 3.048 4.665 -9.415 1.00 0.00 H new ATOM 0 HA ILE A 75 3.773 2.311 -10.608 1.00 0.00 H new ATOM 0 HB ILE A 75 3.948 5.125 -11.765 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.647 3.172 -11.991 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.755 4.318 -10.670 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.596 4.020 -13.938 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.105 3.482 -13.164 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.668 2.432 -13.139 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.337 5.182 -12.466 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.792 6.190 -12.279 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.682 5.026 -13.621 1.00 0.00 H new ATOM 1148 N LYS A 76 6.316 4.409 -10.358 1.00 0.00 N ATOM 1149 CA LYS A 76 7.769 4.510 -10.423 1.00 0.00 C ATOM 1150 C LYS A 76 8.428 3.398 -9.613 1.00 0.00 C ATOM 1151 O LYS A 76 9.375 2.760 -10.073 1.00 0.00 O ATOM 1152 CB LYS A 76 8.230 5.874 -9.905 1.00 0.00 C ATOM 1153 CG LYS A 76 8.271 6.949 -10.978 1.00 0.00 C ATOM 1154 CD LYS A 76 8.488 8.328 -10.378 1.00 0.00 C ATOM 1155 CE LYS A 76 9.964 8.692 -10.337 1.00 0.00 C ATOM 1156 NZ LYS A 76 10.603 8.273 -9.059 1.00 0.00 N ATOM 0 H LYS A 76 5.850 5.251 -10.020 1.00 0.00 H new ATOM 0 HA LYS A 76 8.069 4.404 -11.465 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.562 6.195 -9.106 1.00 0.00 H new ATOM 0 HB3 LYS A 76 9.223 5.771 -9.468 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.071 6.729 -11.685 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.337 6.939 -11.540 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.945 9.070 -10.963 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.077 8.356 -9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 76 10.478 8.218 -11.173 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.076 9.769 -10.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 11.513 8.764 -8.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.980 8.516 -8.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 10.763 7.245 -9.072 1.00 0.00 H new ATOM 1170 N ILE A 77 7.920 3.171 -8.407 1.00 0.00 N ATOM 1171 CA ILE A 77 8.458 2.134 -7.534 1.00 0.00 C ATOM 1172 C ILE A 77 8.272 0.750 -8.146 1.00 0.00 C ATOM 1173 O ILE A 77 9.130 -0.122 -8.007 1.00 0.00 O ATOM 1174 CB ILE A 77 7.792 2.165 -6.146 1.00 0.00 C ATOM 1175 CG1 ILE A 77 8.510 3.160 -5.233 1.00 0.00 C ATOM 1176 CG2 ILE A 77 7.794 0.774 -5.527 1.00 0.00 C ATOM 1177 CD1 ILE A 77 8.265 4.606 -5.605 1.00 0.00 C ATOM 0 H ILE A 77 7.137 3.691 -8.011 1.00 0.00 H new ATOM 0 HA ILE A 77 9.523 2.338 -7.420 1.00 0.00 H new ATOM 0 HB ILE A 77 6.758 2.489 -6.263 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.185 2.998 -4.205 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.581 2.962 -5.264 1.00 0.00 H new ATOM 0 HG21 ILE A 77 7.320 0.812 -4.546 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.242 0.089 -6.171 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.821 0.425 -5.421 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.804 5.255 -4.916 1.00 0.00 H new ATOM 0 HD12 ILE A 77 8.616 4.785 -6.621 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.198 4.821 -5.546 1.00 0.00 H new ATOM 1189 N PHE A 78 7.146 0.556 -8.824 1.00 0.00 N ATOM 1190 CA PHE A 78 6.847 -0.723 -9.458 1.00 0.00 C ATOM 1191 C PHE A 78 7.717 -0.934 -10.694 1.00 0.00 C ATOM 1192 O PHE A 78 7.975 -2.069 -11.097 1.00 0.00 O ATOM 1193 CB PHE A 78 5.367 -0.791 -9.844 1.00 0.00 C ATOM 1194 CG PHE A 78 4.526 -1.560 -8.865 1.00 0.00 C ATOM 1195 CD1 PHE A 78 4.515 -2.946 -8.881 1.00 0.00 C ATOM 1196 CD2 PHE A 78 3.748 -0.898 -7.930 1.00 0.00 C ATOM 1197 CE1 PHE A 78 3.744 -3.657 -7.982 1.00 0.00 C ATOM 1198 CE2 PHE A 78 2.974 -1.604 -7.027 1.00 0.00 C ATOM 1199 CZ PHE A 78 2.971 -2.985 -7.055 1.00 0.00 C ATOM 0 H PHE A 78 6.426 1.267 -8.949 1.00 0.00 H new ATOM 0 HA PHE A 78 7.066 -1.515 -8.742 1.00 0.00 H new ATOM 0 HB2 PHE A 78 4.975 0.223 -9.929 1.00 0.00 H new ATOM 0 HB3 PHE A 78 5.277 -1.251 -10.828 1.00 0.00 H new ATOM 0 HD1 PHE A 78 5.116 -3.476 -9.605 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.746 0.182 -7.906 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.746 -4.737 -8.004 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.373 -1.076 -6.301 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.365 -3.539 -6.353 1.00 0.00 H new ATOM 1209 N HIS A 79 8.164 0.166 -11.290 1.00 0.00 N ATOM 1210 CA HIS A 79 9.005 0.102 -12.481 1.00 0.00 C ATOM 1211 C HIS A 79 10.480 0.222 -12.110 1.00 0.00 C ATOM 1212 O HIS A 79 11.358 -0.014 -12.938 1.00 0.00 O ATOM 1213 CB HIS A 79 8.621 1.211 -13.462 1.00 0.00 C ATOM 1214 CG HIS A 79 7.927 0.709 -14.690 1.00 0.00 C ATOM 1215 ND1 HIS A 79 8.582 0.466 -15.879 1.00 0.00 N ATOM 1216 CD2 HIS A 79 6.626 0.403 -14.910 1.00 0.00 C ATOM 1217 CE1 HIS A 79 7.715 0.033 -16.777 1.00 0.00 C ATOM 1218 NE2 HIS A 79 6.520 -0.014 -16.214 1.00 0.00 N ATOM 0 H HIS A 79 7.959 1.112 -10.969 1.00 0.00 H new ATOM 0 HA HIS A 79 8.846 -0.865 -12.958 1.00 0.00 H new ATOM 0 HB2 HIS A 79 7.973 1.925 -12.955 1.00 0.00 H new ATOM 0 HB3 HIS A 79 9.521 1.751 -13.758 1.00 0.00 H new ATOM 0 HD1 HIS A 79 9.580 0.600 -16.040 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.821 0.474 -14.193 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.944 -0.237 -17.797 1.00 0.00 H new ATOM 1226 N GLY A 80 10.743 0.590 -10.860 1.00 0.00 N ATOM 1227 CA GLY A 80 12.113 0.736 -10.403 1.00 0.00 C ATOM 1228 C GLY A 80 12.551 -0.409 -9.510 1.00 0.00 C ATOM 1229 O GLY A 80 13.529 -1.096 -9.804 1.00 0.00 O ATOM 0 H GLY A 80 10.033 0.790 -10.156 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.776 0.794 -11.266 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.213 1.676 -9.860 1.00 0.00 H new ATOM 1233 N LEU A 81 11.827 -0.612 -8.415 1.00 0.00 N ATOM 1234 CA LEU A 81 12.146 -1.680 -7.474 1.00 0.00 C ATOM 1235 C LEU A 81 11.760 -3.041 -8.044 1.00 0.00 C ATOM 1236 O LEU A 81 10.621 -3.251 -8.461 1.00 0.00 O ATOM 1237 CB LEU A 81 11.426 -1.448 -6.144 1.00 0.00 C ATOM 1238 CG LEU A 81 11.894 -0.241 -5.329 1.00 0.00 C ATOM 1239 CD1 LEU A 81 11.424 1.054 -5.974 1.00 0.00 C ATOM 1240 CD2 LEU A 81 11.391 -0.339 -3.896 1.00 0.00 C ATOM 0 H LEU A 81 11.015 -0.051 -8.157 1.00 0.00 H new ATOM 0 HA LEU A 81 13.222 -1.670 -7.303 1.00 0.00 H new ATOM 0 HB2 LEU A 81 10.361 -1.334 -6.345 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.541 -2.342 -5.531 1.00 0.00 H new ATOM 0 HG LEU A 81 12.984 -0.239 -5.311 1.00 0.00 H new ATOM 0 HD11 LEU A 81 11.766 1.901 -5.380 1.00 0.00 H new ATOM 0 HD12 LEU A 81 11.833 1.128 -6.982 1.00 0.00 H new ATOM 0 HD13 LEU A 81 10.335 1.062 -6.023 1.00 0.00 H new ATOM 0 HD21 LEU A 81 11.733 0.528 -3.330 1.00 0.00 H new ATOM 0 HD22 LEU A 81 10.301 -0.367 -3.894 1.00 0.00 H new ATOM 0 HD23 LEU A 81 11.778 -1.248 -3.436 1.00 0.00 H new ATOM 1252 N LYS A 82 12.716 -3.965 -8.055 1.00 0.00 N ATOM 1253 CA LYS A 82 12.476 -5.307 -8.569 1.00 0.00 C ATOM 1254 C LYS A 82 11.376 -6.005 -7.777 1.00 0.00 C ATOM 1255 O LYS A 82 10.680 -5.378 -6.978 1.00 0.00 O ATOM 1256 CB LYS A 82 13.763 -6.134 -8.514 1.00 0.00 C ATOM 1257 CG LYS A 82 14.148 -6.567 -7.110 1.00 0.00 C ATOM 1258 CD LYS A 82 15.478 -7.300 -7.098 1.00 0.00 C ATOM 1259 CE LYS A 82 15.309 -8.767 -7.462 1.00 0.00 C ATOM 1260 NZ LYS A 82 14.681 -9.545 -6.358 1.00 0.00 N ATOM 0 H LYS A 82 13.664 -3.808 -7.713 1.00 0.00 H new ATOM 0 HA LYS A 82 12.152 -5.219 -9.606 1.00 0.00 H new ATOM 0 HB2 LYS A 82 13.643 -7.019 -9.138 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.578 -5.551 -8.942 1.00 0.00 H new ATOM 0 HG2 LYS A 82 14.208 -5.693 -6.462 1.00 0.00 H new ATOM 0 HG3 LYS A 82 13.371 -7.214 -6.702 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.162 -6.826 -7.802 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.930 -7.219 -6.110 1.00 0.00 H new ATOM 0 HE2 LYS A 82 14.695 -8.850 -8.359 1.00 0.00 H new ATOM 0 HE3 LYS A 82 16.282 -9.196 -7.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 14.797 -10.562 -6.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 15.139 -9.301 -5.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 13.668 -9.316 -6.305 1.00 0.00 H new ATOM 1274 N SER A 83 11.226 -7.307 -8.002 1.00 0.00 N ATOM 1275 CA SER A 83 10.209 -8.090 -7.309 1.00 0.00 C ATOM 1276 C SER A 83 10.357 -7.958 -5.796 1.00 0.00 C ATOM 1277 O SER A 83 11.197 -8.618 -5.183 1.00 0.00 O ATOM 1278 CB SER A 83 10.303 -9.561 -7.716 1.00 0.00 C ATOM 1279 OG SER A 83 9.112 -10.258 -7.393 1.00 0.00 O ATOM 0 H SER A 83 11.795 -7.841 -8.658 1.00 0.00 H new ATOM 0 HA SER A 83 9.231 -7.703 -7.595 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.491 -9.634 -8.787 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.149 -10.028 -7.211 1.00 0.00 H new ATOM 0 HG SER A 83 9.198 -11.196 -7.665 1.00 0.00 H new ATOM 1285 N THR A 84 9.536 -7.099 -5.201 1.00 0.00 N ATOM 1286 CA THR A 84 9.575 -6.878 -3.760 1.00 0.00 C ATOM 1287 C THR A 84 8.350 -7.476 -3.079 1.00 0.00 C ATOM 1288 O THR A 84 7.410 -7.912 -3.742 1.00 0.00 O ATOM 1289 CB THR A 84 9.654 -5.377 -3.424 1.00 0.00 C ATOM 1290 OG1 THR A 84 10.232 -4.659 -4.520 1.00 0.00 O ATOM 1291 CG2 THR A 84 10.481 -5.146 -2.168 1.00 0.00 C ATOM 0 H THR A 84 8.836 -6.545 -5.694 1.00 0.00 H new ATOM 0 HA THR A 84 10.472 -7.374 -3.388 1.00 0.00 H new ATOM 0 HB THR A 84 8.642 -5.014 -3.246 1.00 0.00 H new ATOM 0 HG1 THR A 84 9.935 -5.057 -5.365 1.00 0.00 H new ATOM 0 HG21 THR A 84 10.522 -4.079 -1.951 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.022 -5.669 -1.329 1.00 0.00 H new ATOM 0 HG23 THR A 84 11.491 -5.524 -2.323 1.00 0.00 H new ATOM 1299 N ASP A 85 8.368 -7.494 -1.750 1.00 0.00 N ATOM 1300 CA ASP A 85 7.258 -8.037 -0.978 1.00 0.00 C ATOM 1301 C ASP A 85 6.072 -7.077 -0.982 1.00 0.00 C ATOM 1302 O ASP A 85 4.928 -7.488 -1.177 1.00 0.00 O ATOM 1303 CB ASP A 85 7.696 -8.318 0.460 1.00 0.00 C ATOM 1304 CG ASP A 85 9.078 -8.941 0.532 1.00 0.00 C ATOM 1305 OD1 ASP A 85 9.203 -10.145 0.227 1.00 0.00 O ATOM 1306 OD2 ASP A 85 10.033 -8.222 0.894 1.00 0.00 O ATOM 0 H ASP A 85 9.140 -7.138 -1.186 1.00 0.00 H new ATOM 0 HA ASP A 85 6.948 -8.972 -1.444 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.690 -7.387 1.027 1.00 0.00 H new ATOM 0 HB3 ASP A 85 6.975 -8.984 0.933 1.00 0.00 H new ATOM 1311 N VAL A 86 6.352 -5.797 -0.763 1.00 0.00 N ATOM 1312 CA VAL A 86 5.310 -4.778 -0.742 1.00 0.00 C ATOM 1313 C VAL A 86 4.670 -4.617 -2.117 1.00 0.00 C ATOM 1314 O VAL A 86 3.462 -4.418 -2.231 1.00 0.00 O ATOM 1315 CB VAL A 86 5.864 -3.417 -0.283 1.00 0.00 C ATOM 1316 CG1 VAL A 86 6.358 -3.498 1.154 1.00 0.00 C ATOM 1317 CG2 VAL A 86 6.976 -2.954 -1.212 1.00 0.00 C ATOM 0 H VAL A 86 7.293 -5.440 -0.597 1.00 0.00 H new ATOM 0 HA VAL A 86 4.555 -5.113 -0.030 1.00 0.00 H new ATOM 0 HB VAL A 86 5.058 -2.684 -0.324 1.00 0.00 H new ATOM 0 HG11 VAL A 86 6.746 -2.527 1.461 1.00 0.00 H new ATOM 0 HG12 VAL A 86 5.533 -3.782 1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.150 -4.244 1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.356 -1.990 -0.873 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.784 -3.686 -1.205 1.00 0.00 H new ATOM 0 HG23 VAL A 86 6.586 -2.854 -2.225 1.00 0.00 H new ATOM 1327 N ALA A 87 5.492 -4.703 -3.158 1.00 0.00 N ATOM 1328 CA ALA A 87 5.007 -4.570 -4.526 1.00 0.00 C ATOM 1329 C ALA A 87 4.082 -5.725 -4.897 1.00 0.00 C ATOM 1330 O ALA A 87 2.928 -5.515 -5.270 1.00 0.00 O ATOM 1331 CB ALA A 87 6.177 -4.496 -5.496 1.00 0.00 C ATOM 0 H ALA A 87 6.496 -4.864 -3.080 1.00 0.00 H new ATOM 0 HA ALA A 87 4.434 -3.645 -4.593 1.00 0.00 H new ATOM 0 HB1 ALA A 87 5.800 -4.397 -6.514 1.00 0.00 H new ATOM 0 HB2 ALA A 87 6.797 -3.633 -5.253 1.00 0.00 H new ATOM 0 HB3 ALA A 87 6.773 -5.405 -5.417 1.00 0.00 H new ATOM 1337 N LYS A 88 4.597 -6.945 -4.792 1.00 0.00 N ATOM 1338 CA LYS A 88 3.817 -8.134 -5.115 1.00 0.00 C ATOM 1339 C LYS A 88 2.539 -8.190 -4.284 1.00 0.00 C ATOM 1340 O LYS A 88 1.455 -8.444 -4.810 1.00 0.00 O ATOM 1341 CB LYS A 88 4.649 -9.396 -4.873 1.00 0.00 C ATOM 1342 CG LYS A 88 3.864 -10.685 -5.037 1.00 0.00 C ATOM 1343 CD LYS A 88 3.431 -11.249 -3.695 1.00 0.00 C ATOM 1344 CE LYS A 88 4.471 -12.204 -3.130 1.00 0.00 C ATOM 1345 NZ LYS A 88 4.357 -13.564 -3.723 1.00 0.00 N ATOM 0 H LYS A 88 5.551 -7.137 -4.486 1.00 0.00 H new ATOM 0 HA LYS A 88 3.543 -8.082 -6.169 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.491 -9.403 -5.565 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.064 -9.359 -3.866 1.00 0.00 H new ATOM 0 HG2 LYS A 88 2.986 -10.501 -5.656 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.475 -11.420 -5.561 1.00 0.00 H new ATOM 0 HD2 LYS A 88 3.266 -10.432 -2.992 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.480 -11.770 -3.808 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.469 -11.808 -3.320 1.00 0.00 H new ATOM 0 HE3 LYS A 88 4.354 -12.269 -2.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 5.083 -14.184 -3.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 3.414 -13.953 -3.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.494 -13.506 -4.752 1.00 0.00 H new ATOM 1359 N THR A 89 2.672 -7.948 -2.984 1.00 0.00 N ATOM 1360 CA THR A 89 1.528 -7.970 -2.082 1.00 0.00 C ATOM 1361 C THR A 89 0.506 -6.906 -2.465 1.00 0.00 C ATOM 1362 O THR A 89 -0.702 -7.139 -2.401 1.00 0.00 O ATOM 1363 CB THR A 89 1.961 -7.747 -0.620 1.00 0.00 C ATOM 1364 OG1 THR A 89 2.884 -8.767 -0.221 1.00 0.00 O ATOM 1365 CG2 THR A 89 0.756 -7.756 0.309 1.00 0.00 C ATOM 0 H THR A 89 3.561 -7.734 -2.532 1.00 0.00 H new ATOM 0 HA THR A 89 1.073 -8.956 -2.172 1.00 0.00 H new ATOM 0 HB THR A 89 2.445 -6.773 -0.553 1.00 0.00 H new ATOM 0 HG1 THR A 89 3.791 -8.509 -0.486 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.087 -7.597 1.335 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.069 -6.960 0.021 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.248 -8.718 0.237 1.00 0.00 H new ATOM 1373 N PHE A 90 0.995 -5.737 -2.864 1.00 0.00 N ATOM 1374 CA PHE A 90 0.123 -4.636 -3.257 1.00 0.00 C ATOM 1375 C PHE A 90 -0.599 -4.955 -4.562 1.00 0.00 C ATOM 1376 O PHE A 90 -1.828 -5.010 -4.608 1.00 0.00 O ATOM 1377 CB PHE A 90 0.931 -3.346 -3.408 1.00 0.00 C ATOM 1378 CG PHE A 90 0.147 -2.215 -4.009 1.00 0.00 C ATOM 1379 CD1 PHE A 90 0.068 -2.062 -5.384 1.00 0.00 C ATOM 1380 CD2 PHE A 90 -0.510 -1.304 -3.199 1.00 0.00 C ATOM 1381 CE1 PHE A 90 -0.653 -1.022 -5.939 1.00 0.00 C ATOM 1382 CE2 PHE A 90 -1.234 -0.263 -3.749 1.00 0.00 C ATOM 1383 CZ PHE A 90 -1.304 -0.120 -5.120 1.00 0.00 C ATOM 0 H PHE A 90 1.991 -5.527 -2.924 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.623 -4.498 -2.474 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.301 -3.041 -2.429 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.804 -3.544 -4.031 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.576 -2.764 -6.029 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.456 -1.408 -2.125 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.707 -0.914 -7.012 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.745 0.438 -3.106 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.866 0.695 -5.551 1.00 0.00 H new ATOM 1393 N ARG A 91 0.175 -5.163 -5.624 1.00 0.00 N ATOM 1394 CA ARG A 91 -0.391 -5.474 -6.931 1.00 0.00 C ATOM 1395 C ARG A 91 -1.380 -6.632 -6.835 1.00 0.00 C ATOM 1396 O ARG A 91 -2.413 -6.636 -7.505 1.00 0.00 O ATOM 1397 CB ARG A 91 0.723 -5.821 -7.922 1.00 0.00 C ATOM 1398 CG ARG A 91 0.557 -5.162 -9.280 1.00 0.00 C ATOM 1399 CD ARG A 91 1.210 -5.982 -10.382 1.00 0.00 C ATOM 1400 NE ARG A 91 0.980 -5.406 -11.704 1.00 0.00 N ATOM 1401 CZ ARG A 91 1.073 -6.099 -12.833 1.00 0.00 C ATOM 1402 NH1 ARG A 91 1.387 -7.386 -12.802 1.00 0.00 N ATOM 1403 NH2 ARG A 91 0.849 -5.503 -13.998 1.00 0.00 N ATOM 0 H ARG A 91 1.194 -5.122 -5.604 1.00 0.00 H new ATOM 0 HA ARG A 91 -0.925 -4.593 -7.287 1.00 0.00 H new ATOM 0 HB2 ARG A 91 1.681 -5.522 -7.497 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.756 -6.902 -8.054 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.504 -5.038 -9.498 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.997 -4.165 -9.258 1.00 0.00 H new ATOM 0 HD2 ARG A 91 2.282 -6.048 -10.197 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.819 -6.999 -10.357 1.00 0.00 H new ATOM 0 HE ARG A 91 0.735 -4.418 -11.763 1.00 0.00 H new ATOM 0 HH11 ARG A 91 1.558 -7.848 -11.909 1.00 0.00 H new ATOM 0 HH12 ARG A 91 1.457 -7.915 -13.671 1.00 0.00 H new ATOM 0 HH21 ARG A 91 0.606 -4.513 -14.026 1.00 0.00 H new ATOM 0 HH22 ARG A 91 0.920 -6.035 -14.865 1.00 0.00 H new ATOM 1417 N LYS A 92 -1.056 -7.611 -5.998 1.00 0.00 N ATOM 1418 CA LYS A 92 -1.915 -8.775 -5.813 1.00 0.00 C ATOM 1419 C LYS A 92 -3.147 -8.416 -4.987 1.00 0.00 C ATOM 1420 O LYS A 92 -4.276 -8.513 -5.464 1.00 0.00 O ATOM 1421 CB LYS A 92 -1.140 -9.903 -5.129 1.00 0.00 C ATOM 1422 CG LYS A 92 -0.229 -10.673 -6.069 1.00 0.00 C ATOM 1423 CD LYS A 92 0.119 -12.042 -5.512 1.00 0.00 C ATOM 1424 CE LYS A 92 1.236 -12.700 -6.306 1.00 0.00 C ATOM 1425 NZ LYS A 92 0.729 -13.334 -7.555 1.00 0.00 N ATOM 0 H LYS A 92 -0.205 -7.622 -5.437 1.00 0.00 H new ATOM 0 HA LYS A 92 -2.244 -9.113 -6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.542 -9.483 -4.320 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.849 -10.596 -4.675 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.716 -10.787 -7.037 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.686 -10.105 -6.237 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.421 -11.945 -4.469 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.765 -12.679 -5.530 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.991 -11.955 -6.557 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.725 -13.454 -5.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 1.521 -13.772 -8.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.027 -14.063 -7.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.285 -12.611 -8.156 1.00 0.00 H new ATOM 1439 N ALA A 93 -2.919 -7.999 -3.746 1.00 0.00 N ATOM 1440 CA ALA A 93 -4.010 -7.621 -2.855 1.00 0.00 C ATOM 1441 C ALA A 93 -4.964 -6.647 -3.538 1.00 0.00 C ATOM 1442 O ALA A 93 -6.174 -6.875 -3.577 1.00 0.00 O ATOM 1443 CB ALA A 93 -3.459 -7.012 -1.575 1.00 0.00 C ATOM 0 H ALA A 93 -1.989 -7.914 -3.335 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.570 -8.522 -2.604 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.284 -6.735 -0.919 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.823 -7.739 -1.070 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.874 -6.125 -1.817 1.00 0.00 H new ATOM 1449 N ILE A 94 -4.414 -5.564 -4.074 1.00 0.00 N ATOM 1450 CA ILE A 94 -5.217 -4.557 -4.756 1.00 0.00 C ATOM 1451 C ILE A 94 -6.025 -5.174 -5.892 1.00 0.00 C ATOM 1452 O ILE A 94 -7.079 -4.663 -6.267 1.00 0.00 O ATOM 1453 CB ILE A 94 -4.340 -3.425 -5.321 1.00 0.00 C ATOM 1454 CG1 ILE A 94 -5.050 -2.077 -5.174 1.00 0.00 C ATOM 1455 CG2 ILE A 94 -4.001 -3.695 -6.780 1.00 0.00 C ATOM 1456 CD1 ILE A 94 -4.282 -1.076 -4.340 1.00 0.00 C ATOM 0 H ILE A 94 -3.415 -5.361 -4.049 1.00 0.00 H new ATOM 0 HA ILE A 94 -5.898 -4.142 -4.013 1.00 0.00 H new ATOM 0 HB ILE A 94 -3.410 -3.388 -4.753 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.222 -1.656 -6.165 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.029 -2.239 -4.722 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.381 -2.886 -7.165 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.459 -4.637 -6.859 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -4.921 -3.756 -7.362 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.845 -0.145 -4.279 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -4.133 -1.476 -3.337 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.313 -0.885 -4.802 1.00 0.00 H new ATOM 1468 N ASN A 95 -5.522 -6.278 -6.436 1.00 0.00 N ATOM 1469 CA ASN A 95 -6.198 -6.968 -7.529 1.00 0.00 C ATOM 1470 C ASN A 95 -7.102 -8.076 -6.998 1.00 0.00 C ATOM 1471 O ASN A 95 -7.459 -9.004 -7.725 1.00 0.00 O ATOM 1472 CB ASN A 95 -5.172 -7.553 -8.502 1.00 0.00 C ATOM 1473 CG ASN A 95 -4.761 -6.562 -9.574 1.00 0.00 C ATOM 1474 OD1 ASN A 95 -5.429 -5.551 -9.789 1.00 0.00 O ATOM 1475 ND2 ASN A 95 -3.657 -6.849 -10.252 1.00 0.00 N ATOM 0 H ASN A 95 -4.649 -6.714 -6.138 1.00 0.00 H new ATOM 0 HA ASN A 95 -6.816 -6.242 -8.056 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -4.289 -7.871 -7.947 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -5.589 -8.443 -8.974 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.331 -6.220 -10.985 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.135 -7.699 -10.040 1.00 0.00 H new ATOM 1482 N LYS A 96 -7.468 -7.974 -5.726 1.00 0.00 N ATOM 1483 CA LYS A 96 -8.332 -8.966 -5.096 1.00 0.00 C ATOM 1484 C LYS A 96 -7.648 -10.329 -5.044 1.00 0.00 C ATOM 1485 O LYS A 96 -8.294 -11.350 -4.809 1.00 0.00 O ATOM 1486 CB LYS A 96 -9.656 -9.076 -5.854 1.00 0.00 C ATOM 1487 CG LYS A 96 -10.821 -8.412 -5.143 1.00 0.00 C ATOM 1488 CD LYS A 96 -12.155 -8.923 -5.661 1.00 0.00 C ATOM 1489 CE LYS A 96 -12.378 -8.529 -7.114 1.00 0.00 C ATOM 1490 NZ LYS A 96 -12.606 -7.065 -7.263 1.00 0.00 N ATOM 0 H LYS A 96 -7.180 -7.214 -5.110 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.532 -8.640 -4.075 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -9.539 -8.626 -6.840 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -9.889 -10.129 -6.010 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.750 -8.600 -4.072 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -10.765 -7.332 -5.282 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.191 -10.008 -5.568 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.962 -8.524 -5.047 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -11.512 -8.824 -7.707 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.236 -9.072 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.920 -6.859 -8.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.337 -6.757 -6.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.721 -6.554 -7.070 1.00 0.00 H new ATOM 1504 N LYS A 97 -6.338 -10.337 -5.266 1.00 0.00 N ATOM 1505 CA LYS A 97 -5.565 -11.573 -5.243 1.00 0.00 C ATOM 1506 C LYS A 97 -6.043 -12.533 -6.328 1.00 0.00 C ATOM 1507 O LYS A 97 -6.070 -13.741 -6.094 1.00 0.00 O ATOM 1508 CB LYS A 97 -5.675 -12.242 -3.871 1.00 0.00 C ATOM 1509 CG LYS A 97 -5.317 -11.323 -2.716 1.00 0.00 C ATOM 1510 CD LYS A 97 -4.295 -11.962 -1.791 1.00 0.00 C ATOM 1511 CE LYS A 97 -2.884 -11.494 -2.111 1.00 0.00 C ATOM 1512 NZ LYS A 97 -2.036 -11.414 -0.890 1.00 0.00 N ATOM 0 H LYS A 97 -5.789 -9.500 -5.464 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.522 -11.324 -5.436 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.694 -12.605 -3.734 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -5.021 -13.113 -3.847 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.920 -10.385 -3.105 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -6.217 -11.079 -2.152 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -4.535 -11.716 -0.757 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.349 -13.047 -1.882 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -2.428 -12.179 -2.826 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -2.926 -10.515 -2.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.164 -10.890 -1.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.558 -10.922 -0.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -1.793 -12.374 -0.573 1.00 0.00 H new TER 1526 LYS A 97 HETATM 1527 CA CA A 101 -7.655 8.298 -1.568 1.00 0.00 CA HETATM 1528 CA CA A 102 3.088 12.796 -2.913 1.00 0.00 CA