USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 960 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 62 ASN : amide:sc= -4.98! C(o=-11!,f=-7.7!) USER MOD Set 1.2: A 68 SER OG : rot -120:sc= -0.0566 USER MOD Set 1.3: A 86 THR OG1 : rot -105:sc= -5.97! USER MOD Single : A 1 GLY N :NH3+ 168:sc= 0.803 (180deg=0.561) USER MOD Single : A 2 SER OG : rot 180:sc= -0.358 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 4 MET CE :methyl -146:sc= -0.16 (180deg=-1.05) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.358 USER MOD Single : A 18 SER OG : rot 180:sc= -0.0375 USER MOD Single : A 19 MET CE :methyl -110:sc= -1.42 (180deg=-5.11!) USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot -66:sc= -1.29! USER MOD Single : A 29 CYS SG : rot 180:sc= 0 USER MOD Single : A 33 HIS : no HE2:sc= -20.6! C(o=-21!,f=-18!) USER MOD Single : A 38 THR OG1 : rot 120:sc= -8.35! USER MOD Single : A 40 SER OG : rot -0:sc= 0.399! USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= -0.193 K(o=-0.19,f=-1.9!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -0.899 K(o=-0.9,f=-0.33) USER MOD Single : A 69 TYR OH : rot -15:sc= -1.21 USER MOD Single : A 79 ASN : amide:sc= -5.26! C(o=-5.3!,f=-6!) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 45:sc= 0.113 USER MOD Single : A 91 LYS NZ :NH3+ 156:sc= -0.364 (180deg=-2.06!) USER MOD Single : A 95 THR OG1 : rot 115:sc= -2.26! USER MOD Single : A 97 TYR OH : rot 47:sc= 0.793 USER MOD Single : A 98 SER OG : rot 75:sc= 0.649 USER MOD Single : A 99 ASN : amide:sc= -13.9! C(o=-14!,f=-9.4!) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.363 USER MOD Single : A 105 LYS NZ :NH3+ -108:sc= -2.88 (180deg=-6.45!) USER MOD Single : A 110 SER OG : rot 180:sc= 0.216 USER MOD Single : A 118 GLN : amide:sc= -4.04! C(o=-4!,f=-3.9!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -174:sc= -0.392 (180deg=-0.532) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.680 17.086 8.321 1.00 0.00 N ATOM 2 CA GLY A 1 11.820 17.982 8.663 1.00 0.00 C ATOM 3 C GLY A 1 11.658 19.314 7.930 1.00 0.00 C ATOM 4 O GLY A 1 12.624 19.956 7.567 1.00 0.00 O ATOM 0 H1 GLY A 1 10.887 16.121 8.649 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.816 17.431 8.785 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.541 17.079 7.290 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.855 18.149 9.740 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.763 17.512 8.382 1.00 0.00 H new ATOM 10 N SER A 2 10.441 19.735 7.709 1.00 0.00 N ATOM 11 CA SER A 2 10.212 21.028 6.998 1.00 0.00 C ATOM 12 C SER A 2 10.634 20.909 5.530 1.00 0.00 C ATOM 13 O SER A 2 9.827 21.038 4.631 1.00 0.00 O ATOM 14 CB SER A 2 11.088 22.047 7.728 1.00 0.00 C ATOM 15 OG SER A 2 11.078 21.763 9.121 1.00 0.00 O ATOM 0 H SER A 2 9.595 19.240 7.990 1.00 0.00 H new ATOM 0 HA SER A 2 9.162 21.319 7.003 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.108 22.008 7.345 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.718 23.057 7.548 1.00 0.00 H new ATOM 0 HG SER A 2 11.640 22.413 9.592 1.00 0.00 H new ATOM 21 N HIS A 3 11.893 20.667 5.281 1.00 0.00 N ATOM 22 CA HIS A 3 12.361 20.544 3.871 1.00 0.00 C ATOM 23 C HIS A 3 12.164 19.113 3.362 1.00 0.00 C ATOM 24 O HIS A 3 12.133 18.870 2.171 1.00 0.00 O ATOM 25 CB HIS A 3 13.847 20.899 3.914 1.00 0.00 C ATOM 26 CG HIS A 3 14.022 22.241 4.571 1.00 0.00 C ATOM 27 ND1 HIS A 3 14.484 22.374 5.871 1.00 0.00 N ATOM 28 CD2 HIS A 3 13.801 23.518 4.119 1.00 0.00 C ATOM 29 CE1 HIS A 3 14.526 23.689 6.154 1.00 0.00 C ATOM 30 NE2 HIS A 3 14.120 24.431 5.121 1.00 0.00 N ATOM 0 H HIS A 3 12.616 20.549 5.991 1.00 0.00 H new ATOM 0 HA HIS A 3 11.804 21.195 3.197 1.00 0.00 H new ATOM 0 HB2 HIS A 3 14.398 20.137 4.465 1.00 0.00 H new ATOM 0 HB3 HIS A 3 14.256 20.920 2.904 1.00 0.00 H new ATOM 0 HD2 HIS A 3 13.435 23.776 3.136 1.00 0.00 H new ATOM 0 HE1 HIS A 3 14.849 24.095 7.101 1.00 0.00 H new ATOM 0 HE2 HIS A 3 14.057 25.448 5.075 1.00 0.00 H new ATOM 38 N MET A 4 12.034 18.163 4.249 1.00 0.00 N ATOM 39 CA MET A 4 11.840 16.752 3.802 1.00 0.00 C ATOM 40 C MET A 4 11.040 15.963 4.842 1.00 0.00 C ATOM 41 O MET A 4 10.910 16.367 5.981 1.00 0.00 O ATOM 42 CB MET A 4 13.252 16.178 3.669 1.00 0.00 C ATOM 43 CG MET A 4 13.493 15.744 2.222 1.00 0.00 C ATOM 44 SD MET A 4 13.098 13.987 2.043 1.00 0.00 S ATOM 45 CE MET A 4 14.501 13.345 2.989 1.00 0.00 C ATOM 0 H MET A 4 12.054 18.301 5.259 1.00 0.00 H new ATOM 0 HA MET A 4 11.284 16.695 2.866 1.00 0.00 H new ATOM 0 HB2 MET A 4 13.989 16.925 3.963 1.00 0.00 H new ATOM 0 HB3 MET A 4 13.375 15.328 4.340 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.876 16.337 1.546 1.00 0.00 H new ATOM 0 HG3 MET A 4 14.532 15.924 1.946 1.00 0.00 H new ATOM 0 HE1 MET A 4 14.828 12.399 2.558 1.00 0.00 H new ATOM 0 HE2 MET A 4 15.321 14.062 2.955 1.00 0.00 H new ATOM 0 HE3 MET A 4 14.200 13.187 4.025 1.00 0.00 H new ATOM 55 N THR A 5 10.511 14.833 4.458 1.00 0.00 N ATOM 56 CA THR A 5 9.728 14.006 5.416 1.00 0.00 C ATOM 57 C THR A 5 10.219 12.560 5.360 1.00 0.00 C ATOM 58 O THR A 5 10.838 12.145 4.401 1.00 0.00 O ATOM 59 CB THR A 5 8.278 14.105 4.938 1.00 0.00 C ATOM 60 OG1 THR A 5 8.176 13.574 3.624 1.00 0.00 O ATOM 61 CG2 THR A 5 7.839 15.569 4.932 1.00 0.00 C ATOM 0 H THR A 5 10.589 14.447 3.517 1.00 0.00 H new ATOM 0 HA THR A 5 9.832 14.344 6.447 1.00 0.00 H new ATOM 0 HB THR A 5 7.635 13.538 5.611 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.247 13.635 3.318 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.806 15.638 4.591 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.916 15.976 5.940 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.481 16.139 4.260 1.00 0.00 H new ATOM 69 N GLU A 6 9.955 11.787 6.374 1.00 0.00 N ATOM 70 CA GLU A 6 10.419 10.373 6.356 1.00 0.00 C ATOM 71 C GLU A 6 9.382 9.462 7.025 1.00 0.00 C ATOM 72 O GLU A 6 9.653 8.316 7.326 1.00 0.00 O ATOM 73 CB GLU A 6 11.737 10.386 7.128 1.00 0.00 C ATOM 74 CG GLU A 6 11.572 11.190 8.419 1.00 0.00 C ATOM 75 CD GLU A 6 11.777 12.676 8.124 1.00 0.00 C ATOM 76 OE1 GLU A 6 12.896 13.049 7.813 1.00 0.00 O ATOM 77 OE2 GLU A 6 10.812 13.417 8.212 1.00 0.00 O ATOM 0 H GLU A 6 9.442 12.070 7.209 1.00 0.00 H new ATOM 0 HA GLU A 6 10.551 9.987 5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 6 12.043 9.366 7.360 1.00 0.00 H new ATOM 0 HB3 GLU A 6 12.525 10.823 6.514 1.00 0.00 H new ATOM 0 HG2 GLU A 6 10.579 11.025 8.838 1.00 0.00 H new ATOM 0 HG3 GLU A 6 12.293 10.853 9.164 1.00 0.00 H new ATOM 84 N ARG A 7 8.190 9.958 7.248 1.00 0.00 N ATOM 85 CA ARG A 7 7.142 9.104 7.885 1.00 0.00 C ATOM 86 C ARG A 7 5.809 9.849 8.022 1.00 0.00 C ATOM 87 O ARG A 7 4.981 9.499 8.839 1.00 0.00 O ATOM 88 CB ARG A 7 7.693 8.774 9.265 1.00 0.00 C ATOM 89 CG ARG A 7 8.081 10.071 9.980 1.00 0.00 C ATOM 90 CD ARG A 7 8.409 9.774 11.444 1.00 0.00 C ATOM 91 NE ARG A 7 9.867 10.046 11.573 1.00 0.00 N ATOM 92 CZ ARG A 7 10.666 9.117 12.020 1.00 0.00 C ATOM 93 NH1 ARG A 7 10.476 7.872 11.680 1.00 0.00 N ATOM 94 NH2 ARG A 7 11.655 9.431 12.807 1.00 0.00 N ATOM 0 H ARG A 7 7.900 10.909 7.019 1.00 0.00 H new ATOM 0 HA ARG A 7 6.938 8.218 7.284 1.00 0.00 H new ATOM 0 HB2 ARG A 7 6.947 8.234 9.847 1.00 0.00 H new ATOM 0 HB3 ARG A 7 8.561 8.121 9.176 1.00 0.00 H new ATOM 0 HG2 ARG A 7 8.942 10.525 9.489 1.00 0.00 H new ATOM 0 HG3 ARG A 7 7.264 10.790 9.919 1.00 0.00 H new ATOM 0 HD2 ARG A 7 7.828 10.407 12.115 1.00 0.00 H new ATOM 0 HD3 ARG A 7 8.176 8.740 11.699 1.00 0.00 H new ATOM 0 HE ARG A 7 10.241 10.958 11.312 1.00 0.00 H new ATOM 0 HH11 ARG A 7 9.702 7.624 11.064 1.00 0.00 H new ATOM 0 HH12 ARG A 7 11.102 7.147 12.030 1.00 0.00 H new ATOM 0 HH21 ARG A 7 11.805 10.404 13.074 1.00 0.00 H new ATOM 0 HH22 ARG A 7 12.279 8.704 13.156 1.00 0.00 H new ATOM 108 N ARG A 8 5.583 10.866 7.238 1.00 0.00 N ATOM 109 CA ARG A 8 4.293 11.604 7.348 1.00 0.00 C ATOM 110 C ARG A 8 3.322 11.142 6.256 1.00 0.00 C ATOM 111 O ARG A 8 2.137 10.995 6.484 1.00 0.00 O ATOM 112 CB ARG A 8 4.659 13.079 7.159 1.00 0.00 C ATOM 113 CG ARG A 8 3.983 13.919 8.247 1.00 0.00 C ATOM 114 CD ARG A 8 3.765 15.345 7.734 1.00 0.00 C ATOM 115 NE ARG A 8 5.082 16.023 7.900 1.00 0.00 N ATOM 116 CZ ARG A 8 5.174 17.318 7.750 1.00 0.00 C ATOM 117 NH1 ARG A 8 4.234 18.096 8.209 1.00 0.00 N ATOM 118 NH2 ARG A 8 6.208 17.833 7.141 1.00 0.00 N ATOM 0 H ARG A 8 6.230 11.216 6.531 1.00 0.00 H new ATOM 0 HA ARG A 8 3.798 11.429 8.303 1.00 0.00 H new ATOM 0 HB2 ARG A 8 5.741 13.205 7.208 1.00 0.00 H new ATOM 0 HB3 ARG A 8 4.342 13.419 6.173 1.00 0.00 H new ATOM 0 HG2 ARG A 8 3.029 13.472 8.525 1.00 0.00 H new ATOM 0 HG3 ARG A 8 4.601 13.935 9.145 1.00 0.00 H new ATOM 0 HD2 ARG A 8 3.451 15.345 6.690 1.00 0.00 H new ATOM 0 HD3 ARG A 8 2.986 15.853 8.302 1.00 0.00 H new ATOM 0 HE ARG A 8 5.912 15.476 8.131 1.00 0.00 H new ATOM 0 HH11 ARG A 8 3.427 17.694 8.685 1.00 0.00 H new ATOM 0 HH12 ARG A 8 4.306 19.107 8.092 1.00 0.00 H new ATOM 0 HH21 ARG A 8 6.944 17.225 6.782 1.00 0.00 H new ATOM 0 HH22 ARG A 8 6.280 18.844 7.024 1.00 0.00 H new ATOM 132 N LEU A 9 3.818 10.917 5.069 1.00 0.00 N ATOM 133 CA LEU A 9 2.935 10.467 3.953 1.00 0.00 C ATOM 134 C LEU A 9 3.664 9.443 3.075 1.00 0.00 C ATOM 135 O LEU A 9 4.394 9.805 2.165 1.00 0.00 O ATOM 136 CB LEU A 9 2.620 11.736 3.157 1.00 0.00 C ATOM 137 CG LEU A 9 1.305 12.340 3.658 1.00 0.00 C ATOM 138 CD1 LEU A 9 1.528 13.799 4.064 1.00 0.00 C ATOM 139 CD2 LEU A 9 0.257 12.274 2.544 1.00 0.00 C ATOM 0 H LEU A 9 4.802 11.026 4.823 1.00 0.00 H new ATOM 0 HA LEU A 9 2.029 9.981 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 9 3.429 12.458 3.268 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.544 11.502 2.095 1.00 0.00 H new ATOM 0 HG LEU A 9 0.955 11.776 4.522 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.590 14.225 4.420 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.272 13.846 4.859 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.881 14.366 3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.680 12.704 2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.609 12.837 1.679 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.094 11.235 2.259 1.00 0.00 H new ATOM 151 N ARG A 10 3.486 8.171 3.339 1.00 0.00 N ATOM 152 CA ARG A 10 4.195 7.143 2.520 1.00 0.00 C ATOM 153 C ARG A 10 3.267 6.004 2.099 1.00 0.00 C ATOM 154 O ARG A 10 2.192 5.813 2.629 1.00 0.00 O ATOM 155 CB ARG A 10 5.280 6.605 3.448 1.00 0.00 C ATOM 156 CG ARG A 10 6.218 7.743 3.831 1.00 0.00 C ATOM 157 CD ARG A 10 6.828 8.348 2.566 1.00 0.00 C ATOM 158 NE ARG A 10 7.722 9.423 3.072 1.00 0.00 N ATOM 159 CZ ARG A 10 7.210 10.508 3.594 1.00 0.00 C ATOM 160 NH1 ARG A 10 6.209 11.112 3.013 1.00 0.00 N ATOM 161 NH2 ARG A 10 7.697 10.985 4.702 1.00 0.00 N ATOM 0 H ARG A 10 2.887 7.805 4.079 1.00 0.00 H new ATOM 0 HA ARG A 10 4.584 7.572 1.596 1.00 0.00 H new ATOM 0 HB2 ARG A 10 4.830 6.172 4.341 1.00 0.00 H new ATOM 0 HB3 ARG A 10 5.837 5.809 2.954 1.00 0.00 H new ATOM 0 HG2 ARG A 10 5.673 8.507 4.386 1.00 0.00 H new ATOM 0 HG3 ARG A 10 7.006 7.374 4.487 1.00 0.00 H new ATOM 0 HD2 ARG A 10 7.383 7.603 1.996 1.00 0.00 H new ATOM 0 HD3 ARG A 10 6.059 8.747 1.905 1.00 0.00 H new ATOM 0 HE ARG A 10 8.734 9.315 3.012 1.00 0.00 H new ATOM 0 HH11 ARG A 10 5.821 10.738 2.147 1.00 0.00 H new ATOM 0 HH12 ARG A 10 5.815 11.957 3.425 1.00 0.00 H new ATOM 0 HH21 ARG A 10 8.476 10.513 5.161 1.00 0.00 H new ATOM 0 HH22 ARG A 10 7.300 11.831 5.111 1.00 0.00 H new ATOM 175 N VAL A 11 3.699 5.232 1.149 1.00 0.00 N ATOM 176 CA VAL A 11 2.876 4.077 0.686 1.00 0.00 C ATOM 177 C VAL A 11 3.794 2.936 0.255 1.00 0.00 C ATOM 178 O VAL A 11 4.258 2.895 -0.868 1.00 0.00 O ATOM 179 CB VAL A 11 2.077 4.594 -0.506 1.00 0.00 C ATOM 180 CG1 VAL A 11 0.982 5.542 -0.017 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.014 5.339 -1.454 1.00 0.00 C ATOM 0 H VAL A 11 4.591 5.348 0.668 1.00 0.00 H new ATOM 0 HA VAL A 11 2.221 3.696 1.470 1.00 0.00 H new ATOM 0 HB VAL A 11 1.618 3.756 -1.030 1.00 0.00 H new ATOM 0 HG11 VAL A 11 0.412 5.910 -0.870 1.00 0.00 H new ATOM 0 HG12 VAL A 11 0.316 5.009 0.662 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.436 6.383 0.507 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.448 5.711 -2.308 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.471 6.178 -0.929 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.793 4.661 -1.803 1.00 0.00 H new ATOM 191 N LEU A 12 4.075 2.015 1.135 1.00 0.00 N ATOM 192 CA LEU A 12 4.976 0.896 0.756 1.00 0.00 C ATOM 193 C LEU A 12 4.206 -0.159 -0.044 1.00 0.00 C ATOM 194 O LEU A 12 3.720 -1.134 0.494 1.00 0.00 O ATOM 195 CB LEU A 12 5.477 0.330 2.085 1.00 0.00 C ATOM 196 CG LEU A 12 6.041 1.471 2.936 1.00 0.00 C ATOM 197 CD1 LEU A 12 6.107 1.043 4.402 1.00 0.00 C ATOM 198 CD2 LEU A 12 7.446 1.820 2.443 1.00 0.00 C ATOM 0 H LEU A 12 3.722 1.990 2.092 1.00 0.00 H new ATOM 0 HA LEU A 12 5.801 1.219 0.121 1.00 0.00 H new ATOM 0 HB2 LEU A 12 4.663 -0.166 2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.246 -0.422 1.907 1.00 0.00 H new ATOM 0 HG LEU A 12 5.392 2.342 2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.509 1.860 5.002 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.106 0.793 4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.753 0.170 4.498 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.852 2.632 3.046 1.00 0.00 H new ATOM 0 HD22 LEU A 12 8.090 0.945 2.531 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.399 2.132 1.400 1.00 0.00 H new ATOM 210 N VAL A 13 4.112 0.027 -1.334 1.00 0.00 N ATOM 211 CA VAL A 13 3.399 -0.963 -2.192 1.00 0.00 C ATOM 212 C VAL A 13 4.369 -2.093 -2.508 1.00 0.00 C ATOM 213 O VAL A 13 5.568 -1.914 -2.451 1.00 0.00 O ATOM 214 CB VAL A 13 2.985 -0.210 -3.462 1.00 0.00 C ATOM 215 CG1 VAL A 13 1.764 -0.896 -4.077 1.00 0.00 C ATOM 216 CG2 VAL A 13 2.625 1.241 -3.118 1.00 0.00 C ATOM 0 H VAL A 13 4.501 0.827 -1.833 1.00 0.00 H new ATOM 0 HA VAL A 13 2.519 -1.392 -1.713 1.00 0.00 H new ATOM 0 HB VAL A 13 3.814 -0.217 -4.169 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.465 -0.365 -4.981 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.014 -1.927 -4.328 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.942 -0.886 -3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.332 1.768 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.797 1.252 -2.409 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.489 1.735 -2.674 1.00 0.00 H new ATOM 226 N VAL A 14 3.895 -3.268 -2.777 1.00 0.00 N ATOM 227 CA VAL A 14 4.865 -4.363 -3.014 1.00 0.00 C ATOM 228 C VAL A 14 4.223 -5.578 -3.713 1.00 0.00 C ATOM 229 O VAL A 14 3.280 -6.173 -3.228 1.00 0.00 O ATOM 230 CB VAL A 14 5.334 -4.663 -1.579 1.00 0.00 C ATOM 231 CG1 VAL A 14 5.436 -6.166 -1.288 1.00 0.00 C ATOM 232 CG2 VAL A 14 6.694 -4.002 -1.334 1.00 0.00 C ATOM 0 H VAL A 14 2.908 -3.516 -2.842 1.00 0.00 H new ATOM 0 HA VAL A 14 5.678 -4.104 -3.692 1.00 0.00 H new ATOM 0 HB VAL A 14 4.582 -4.254 -0.904 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.771 -6.316 -0.262 1.00 0.00 H new ATOM 0 HG12 VAL A 14 4.459 -6.630 -1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.151 -6.622 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL A 14 7.024 -4.215 -0.317 1.00 0.00 H new ATOM 0 HG22 VAL A 14 7.423 -4.396 -2.043 1.00 0.00 H new ATOM 0 HG23 VAL A 14 6.604 -2.924 -1.467 1.00 0.00 H new ATOM 242 N GLU A 15 4.775 -5.951 -4.844 1.00 0.00 N ATOM 243 CA GLU A 15 4.278 -7.136 -5.613 1.00 0.00 C ATOM 244 C GLU A 15 5.479 -7.809 -6.294 1.00 0.00 C ATOM 245 O GLU A 15 6.547 -7.264 -6.346 1.00 0.00 O ATOM 246 CB GLU A 15 3.287 -6.566 -6.633 1.00 0.00 C ATOM 247 CG GLU A 15 3.309 -7.385 -7.933 1.00 0.00 C ATOM 248 CD GLU A 15 2.502 -6.661 -9.013 1.00 0.00 C ATOM 249 OE1 GLU A 15 2.897 -5.571 -9.390 1.00 0.00 O ATOM 250 OE2 GLU A 15 1.505 -7.212 -9.450 1.00 0.00 O ATOM 0 H GLU A 15 5.566 -5.473 -5.275 1.00 0.00 H new ATOM 0 HA GLU A 15 3.792 -7.890 -4.994 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.282 -6.571 -6.212 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.537 -5.527 -6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.337 -7.527 -8.267 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.891 -8.376 -7.757 1.00 0.00 H new ATOM 257 N ASP A 16 5.339 -8.992 -6.793 1.00 0.00 N ATOM 258 CA ASP A 16 6.525 -9.657 -7.414 1.00 0.00 C ATOM 259 C ASP A 16 7.199 -8.813 -8.508 1.00 0.00 C ATOM 260 O ASP A 16 8.363 -8.479 -8.401 1.00 0.00 O ATOM 261 CB ASP A 16 6.017 -10.962 -8.010 1.00 0.00 C ATOM 262 CG ASP A 16 4.641 -10.759 -8.647 1.00 0.00 C ATOM 263 OD1 ASP A 16 4.518 -9.880 -9.483 1.00 0.00 O ATOM 264 OD2 ASP A 16 3.734 -11.489 -8.287 1.00 0.00 O ATOM 0 H ASP A 16 4.473 -9.530 -6.804 1.00 0.00 H new ATOM 0 HA ASP A 16 7.289 -9.808 -6.651 1.00 0.00 H new ATOM 0 HB2 ASP A 16 6.721 -11.325 -8.759 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.956 -11.724 -7.233 1.00 0.00 H new ATOM 269 N GLU A 17 6.521 -8.517 -9.585 1.00 0.00 N ATOM 270 CA GLU A 17 7.196 -7.762 -10.689 1.00 0.00 C ATOM 271 C GLU A 17 7.177 -6.241 -10.493 1.00 0.00 C ATOM 272 O GLU A 17 6.676 -5.722 -9.514 1.00 0.00 O ATOM 273 CB GLU A 17 6.444 -8.159 -11.960 1.00 0.00 C ATOM 274 CG GLU A 17 5.072 -7.487 -11.991 1.00 0.00 C ATOM 275 CD GLU A 17 3.994 -8.516 -11.655 1.00 0.00 C ATOM 276 OE1 GLU A 17 4.227 -9.689 -11.897 1.00 0.00 O ATOM 277 OE2 GLU A 17 2.953 -8.116 -11.160 1.00 0.00 O ATOM 0 H GLU A 17 5.544 -8.759 -9.750 1.00 0.00 H new ATOM 0 HA GLU A 17 8.256 -8.015 -10.726 1.00 0.00 H new ATOM 0 HB2 GLU A 17 7.020 -7.868 -12.838 1.00 0.00 H new ATOM 0 HB3 GLU A 17 6.328 -9.242 -12.000 1.00 0.00 H new ATOM 0 HG2 GLU A 17 5.041 -6.665 -11.275 1.00 0.00 H new ATOM 0 HG3 GLU A 17 4.887 -7.059 -12.976 1.00 0.00 H new ATOM 284 N SER A 18 7.757 -5.536 -11.438 1.00 0.00 N ATOM 285 CA SER A 18 7.837 -4.046 -11.366 1.00 0.00 C ATOM 286 C SER A 18 6.518 -3.391 -11.790 1.00 0.00 C ATOM 287 O SER A 18 6.352 -2.194 -11.666 1.00 0.00 O ATOM 288 CB SER A 18 8.959 -3.678 -12.339 1.00 0.00 C ATOM 289 OG SER A 18 8.813 -2.322 -12.743 1.00 0.00 O ATOM 0 H SER A 18 8.185 -5.942 -12.270 1.00 0.00 H new ATOM 0 HA SER A 18 8.028 -3.698 -10.351 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.929 -3.824 -11.864 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.929 -4.333 -13.210 1.00 0.00 H new ATOM 0 HG SER A 18 9.533 -2.087 -13.365 1.00 0.00 H new ATOM 295 N MET A 19 5.571 -4.153 -12.271 1.00 0.00 N ATOM 296 CA MET A 19 4.272 -3.535 -12.669 1.00 0.00 C ATOM 297 C MET A 19 3.822 -2.590 -11.559 1.00 0.00 C ATOM 298 O MET A 19 3.107 -1.632 -11.778 1.00 0.00 O ATOM 299 CB MET A 19 3.294 -4.702 -12.799 1.00 0.00 C ATOM 300 CG MET A 19 2.624 -4.665 -14.173 1.00 0.00 C ATOM 301 SD MET A 19 1.220 -5.808 -14.187 1.00 0.00 S ATOM 302 CE MET A 19 0.178 -4.899 -13.019 1.00 0.00 C ATOM 0 H MET A 19 5.638 -5.162 -12.404 1.00 0.00 H new ATOM 0 HA MET A 19 4.338 -2.966 -13.596 1.00 0.00 H new ATOM 0 HB2 MET A 19 3.821 -5.647 -12.667 1.00 0.00 H new ATOM 0 HB3 MET A 19 2.539 -4.645 -12.015 1.00 0.00 H new ATOM 0 HG2 MET A 19 2.286 -3.653 -14.398 1.00 0.00 H new ATOM 0 HG3 MET A 19 3.340 -4.941 -14.947 1.00 0.00 H new ATOM 0 HE1 MET A 19 0.112 -5.453 -12.083 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.614 -3.918 -12.830 1.00 0.00 H new ATOM 0 HE3 MET A 19 -0.820 -4.778 -13.440 1.00 0.00 H new ATOM 312 N ILE A 20 4.247 -2.871 -10.361 1.00 0.00 N ATOM 313 CA ILE A 20 3.872 -2.024 -9.199 1.00 0.00 C ATOM 314 C ILE A 20 4.754 -0.774 -9.139 1.00 0.00 C ATOM 315 O ILE A 20 4.351 0.261 -8.647 1.00 0.00 O ATOM 316 CB ILE A 20 4.122 -2.927 -7.989 1.00 0.00 C ATOM 317 CG1 ILE A 20 3.710 -2.195 -6.712 1.00 0.00 C ATOM 318 CG2 ILE A 20 5.606 -3.313 -7.908 1.00 0.00 C ATOM 319 CD1 ILE A 20 2.458 -2.858 -6.139 1.00 0.00 C ATOM 0 H ILE A 20 4.847 -3.664 -10.135 1.00 0.00 H new ATOM 0 HA ILE A 20 2.843 -1.668 -9.249 1.00 0.00 H new ATOM 0 HB ILE A 20 3.529 -3.835 -8.097 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.519 -2.226 -5.983 1.00 0.00 H new ATOM 0 HG13 ILE A 20 3.515 -1.144 -6.927 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.768 -3.955 -7.042 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.893 -3.846 -8.814 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.211 -2.412 -7.810 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.158 -2.341 -5.227 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.651 -2.804 -6.870 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.671 -3.902 -5.911 1.00 0.00 H new ATOM 331 N ALA A 21 5.958 -0.868 -9.629 1.00 0.00 N ATOM 332 CA ALA A 21 6.883 0.305 -9.596 1.00 0.00 C ATOM 333 C ALA A 21 6.254 1.524 -10.280 1.00 0.00 C ATOM 334 O ALA A 21 5.863 2.482 -9.637 1.00 0.00 O ATOM 335 CB ALA A 21 8.117 -0.160 -10.369 1.00 0.00 C ATOM 0 H ALA A 21 6.346 -1.710 -10.054 1.00 0.00 H new ATOM 0 HA ALA A 21 7.115 0.613 -8.577 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.854 0.643 -10.396 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.548 -1.032 -9.876 1.00 0.00 H new ATOM 0 HB3 ALA A 21 7.831 -0.423 -11.387 1.00 0.00 H new ATOM 341 N MET A 22 6.164 1.508 -11.579 1.00 0.00 N ATOM 342 CA MET A 22 5.576 2.680 -12.288 1.00 0.00 C ATOM 343 C MET A 22 4.220 3.041 -11.681 1.00 0.00 C ATOM 344 O MET A 22 3.805 4.183 -11.700 1.00 0.00 O ATOM 345 CB MET A 22 5.427 2.238 -13.743 1.00 0.00 C ATOM 346 CG MET A 22 5.263 3.469 -14.634 1.00 0.00 C ATOM 347 SD MET A 22 5.492 2.994 -16.365 1.00 0.00 S ATOM 348 CE MET A 22 3.791 3.294 -16.903 1.00 0.00 C ATOM 0 H MET A 22 6.469 0.741 -12.178 1.00 0.00 H new ATOM 0 HA MET A 22 6.201 3.569 -12.204 1.00 0.00 H new ATOM 0 HB2 MET A 22 6.302 1.666 -14.052 1.00 0.00 H new ATOM 0 HB3 MET A 22 4.563 1.582 -13.848 1.00 0.00 H new ATOM 0 HG2 MET A 22 4.274 3.904 -14.493 1.00 0.00 H new ATOM 0 HG3 MET A 22 5.990 4.232 -14.356 1.00 0.00 H new ATOM 0 HE1 MET A 22 3.699 3.062 -17.964 1.00 0.00 H new ATOM 0 HE2 MET A 22 3.112 2.661 -16.332 1.00 0.00 H new ATOM 0 HE3 MET A 22 3.536 4.341 -16.737 1.00 0.00 H new ATOM 358 N LEU A 23 3.539 2.081 -11.126 1.00 0.00 N ATOM 359 CA LEU A 23 2.222 2.368 -10.494 1.00 0.00 C ATOM 360 C LEU A 23 2.446 3.140 -9.188 1.00 0.00 C ATOM 361 O LEU A 23 1.515 3.540 -8.517 1.00 0.00 O ATOM 362 CB LEU A 23 1.624 0.977 -10.241 1.00 0.00 C ATOM 363 CG LEU A 23 0.476 1.029 -9.222 1.00 0.00 C ATOM 364 CD1 LEU A 23 1.043 1.139 -7.806 1.00 0.00 C ATOM 365 CD2 LEU A 23 -0.444 2.222 -9.505 1.00 0.00 C ATOM 0 H LEU A 23 3.838 1.107 -11.082 1.00 0.00 H new ATOM 0 HA LEU A 23 1.560 2.982 -11.105 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.258 0.562 -11.180 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.403 0.307 -9.878 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.106 0.112 -9.309 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.224 1.175 -7.088 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.670 0.273 -7.597 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.639 2.048 -7.722 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.251 2.241 -8.772 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.129 3.147 -9.438 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.865 2.127 -10.506 1.00 0.00 H new ATOM 377 N ILE A 24 3.686 3.356 -8.826 1.00 0.00 N ATOM 378 CA ILE A 24 3.986 4.098 -7.570 1.00 0.00 C ATOM 379 C ILE A 24 4.298 5.567 -7.872 1.00 0.00 C ATOM 380 O ILE A 24 3.779 6.466 -7.240 1.00 0.00 O ATOM 381 CB ILE A 24 5.207 3.371 -6.974 1.00 0.00 C ATOM 382 CG1 ILE A 24 5.087 3.370 -5.451 1.00 0.00 C ATOM 383 CG2 ILE A 24 6.522 4.061 -7.367 1.00 0.00 C ATOM 384 CD1 ILE A 24 5.535 2.016 -4.900 1.00 0.00 C ATOM 0 H ILE A 24 4.505 3.048 -9.351 1.00 0.00 H new ATOM 0 HA ILE A 24 3.144 4.110 -6.878 1.00 0.00 H new ATOM 0 HB ILE A 24 5.223 2.354 -7.366 1.00 0.00 H new ATOM 0 HG12 ILE A 24 5.699 4.166 -5.028 1.00 0.00 H new ATOM 0 HG13 ILE A 24 4.056 3.570 -5.158 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.361 3.521 -6.929 1.00 0.00 H new ATOM 0 HG22 ILE A 24 6.620 4.066 -8.453 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.519 5.087 -6.999 1.00 0.00 H new ATOM 0 HD11 ILE A 24 5.448 2.019 -3.813 1.00 0.00 H new ATOM 0 HD12 ILE A 24 4.904 1.229 -5.313 1.00 0.00 H new ATOM 0 HD13 ILE A 24 6.572 1.834 -5.181 1.00 0.00 H new ATOM 396 N GLU A 25 5.153 5.813 -8.826 1.00 0.00 N ATOM 397 CA GLU A 25 5.508 7.223 -9.158 1.00 0.00 C ATOM 398 C GLU A 25 4.268 7.988 -9.630 1.00 0.00 C ATOM 399 O GLU A 25 4.186 9.194 -9.503 1.00 0.00 O ATOM 400 CB GLU A 25 6.546 7.116 -10.275 1.00 0.00 C ATOM 401 CG GLU A 25 7.948 7.018 -9.663 1.00 0.00 C ATOM 402 CD GLU A 25 8.778 8.233 -10.085 1.00 0.00 C ATOM 403 OE1 GLU A 25 8.652 9.264 -9.445 1.00 0.00 O ATOM 404 OE2 GLU A 25 9.529 8.111 -11.040 1.00 0.00 O ATOM 0 H GLU A 25 5.620 5.102 -9.389 1.00 0.00 H new ATOM 0 HA GLU A 25 5.897 7.767 -8.297 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.344 6.239 -10.890 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.483 7.986 -10.929 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.879 6.972 -8.576 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.436 6.100 -9.991 1.00 0.00 H new ATOM 411 N ASP A 26 3.299 7.299 -10.169 1.00 0.00 N ATOM 412 CA ASP A 26 2.069 7.996 -10.642 1.00 0.00 C ATOM 413 C ASP A 26 1.154 8.321 -9.456 1.00 0.00 C ATOM 414 O ASP A 26 0.628 9.412 -9.353 1.00 0.00 O ATOM 415 CB ASP A 26 1.400 7.012 -11.607 1.00 0.00 C ATOM 416 CG ASP A 26 0.632 5.952 -10.817 1.00 0.00 C ATOM 417 OD1 ASP A 26 1.226 5.356 -9.935 1.00 0.00 O ATOM 418 OD2 ASP A 26 -0.536 5.754 -11.108 1.00 0.00 O ATOM 0 H ASP A 26 3.305 6.288 -10.302 1.00 0.00 H new ATOM 0 HA ASP A 26 2.290 8.946 -11.130 1.00 0.00 H new ATOM 0 HB2 ASP A 26 0.721 7.546 -12.272 1.00 0.00 H new ATOM 0 HB3 ASP A 26 2.153 6.536 -12.235 1.00 0.00 H new ATOM 423 N THR A 27 0.963 7.394 -8.554 1.00 0.00 N ATOM 424 CA THR A 27 0.090 7.681 -7.383 1.00 0.00 C ATOM 425 C THR A 27 0.718 8.802 -6.555 1.00 0.00 C ATOM 426 O THR A 27 0.059 9.745 -6.164 1.00 0.00 O ATOM 427 CB THR A 27 0.028 6.384 -6.576 1.00 0.00 C ATOM 428 OG1 THR A 27 0.707 5.351 -7.278 1.00 0.00 O ATOM 429 CG2 THR A 27 -1.434 5.984 -6.356 1.00 0.00 C ATOM 0 H THR A 27 1.371 6.459 -8.578 1.00 0.00 H new ATOM 0 HA THR A 27 -0.909 8.002 -7.678 1.00 0.00 H new ATOM 0 HB THR A 27 0.508 6.537 -5.610 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.225 5.147 -8.106 1.00 0.00 H new ATOM 0 HG21 THR A 27 -1.476 5.059 -5.781 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.949 6.774 -5.810 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.919 5.833 -7.320 1.00 0.00 H new ATOM 437 N LEU A 28 1.996 8.710 -6.301 1.00 0.00 N ATOM 438 CA LEU A 28 2.679 9.775 -5.516 1.00 0.00 C ATOM 439 C LEU A 28 2.502 11.120 -6.235 1.00 0.00 C ATOM 440 O LEU A 28 2.452 12.165 -5.616 1.00 0.00 O ATOM 441 CB LEU A 28 4.156 9.329 -5.454 1.00 0.00 C ATOM 442 CG LEU A 28 5.106 10.514 -5.697 1.00 0.00 C ATOM 443 CD1 LEU A 28 6.401 10.302 -4.910 1.00 0.00 C ATOM 444 CD2 LEU A 28 5.438 10.614 -7.189 1.00 0.00 C ATOM 0 H LEU A 28 2.596 7.942 -6.604 1.00 0.00 H new ATOM 0 HA LEU A 28 2.277 9.910 -4.512 1.00 0.00 H new ATOM 0 HB2 LEU A 28 4.364 8.886 -4.480 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.337 8.556 -6.201 1.00 0.00 H new ATOM 0 HG LEU A 28 4.621 11.433 -5.368 1.00 0.00 H new ATOM 0 HD11 LEU A 28 7.074 11.142 -5.083 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.173 10.232 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 28 6.880 9.380 -5.239 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.111 11.455 -7.356 1.00 0.00 H new ATOM 0 HD22 LEU A 28 5.919 9.693 -7.517 1.00 0.00 H new ATOM 0 HD23 LEU A 28 4.520 10.766 -7.757 1.00 0.00 H new ATOM 456 N CYS A 29 2.394 11.096 -7.537 1.00 0.00 N ATOM 457 CA CYS A 29 2.206 12.368 -8.290 1.00 0.00 C ATOM 458 C CYS A 29 1.037 13.150 -7.687 1.00 0.00 C ATOM 459 O CYS A 29 0.993 14.365 -7.733 1.00 0.00 O ATOM 460 CB CYS A 29 1.882 11.933 -9.720 1.00 0.00 C ATOM 461 SG CYS A 29 2.771 12.987 -10.893 1.00 0.00 S ATOM 0 H CYS A 29 2.428 10.252 -8.109 1.00 0.00 H new ATOM 0 HA CYS A 29 3.083 13.015 -8.253 1.00 0.00 H new ATOM 0 HB2 CYS A 29 2.164 10.890 -9.866 1.00 0.00 H new ATOM 0 HB3 CYS A 29 0.809 12.000 -9.897 1.00 0.00 H new ATOM 0 HG CYS A 29 2.495 12.613 -12.107 1.00 0.00 H new ATOM 467 N GLU A 30 0.087 12.454 -7.123 1.00 0.00 N ATOM 468 CA GLU A 30 -1.085 13.131 -6.513 1.00 0.00 C ATOM 469 C GLU A 30 -0.848 13.361 -5.017 1.00 0.00 C ATOM 470 O GLU A 30 -1.084 14.434 -4.499 1.00 0.00 O ATOM 471 CB GLU A 30 -2.248 12.165 -6.736 1.00 0.00 C ATOM 472 CG GLU A 30 -3.475 12.642 -5.959 1.00 0.00 C ATOM 473 CD GLU A 30 -4.707 12.559 -6.861 1.00 0.00 C ATOM 474 OE1 GLU A 30 -4.799 13.358 -7.779 1.00 0.00 O ATOM 475 OE2 GLU A 30 -5.535 11.697 -6.621 1.00 0.00 O ATOM 0 H GLU A 30 0.076 11.436 -7.060 1.00 0.00 H new ATOM 0 HA GLU A 30 -1.276 14.111 -6.951 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.481 12.102 -7.799 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.968 11.163 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.619 12.028 -5.070 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.328 13.667 -5.618 1.00 0.00 H new ATOM 482 N LEU A 31 -0.381 12.358 -4.323 1.00 0.00 N ATOM 483 CA LEU A 31 -0.123 12.509 -2.859 1.00 0.00 C ATOM 484 C LEU A 31 1.122 13.350 -2.600 1.00 0.00 C ATOM 485 O LEU A 31 1.181 14.114 -1.657 1.00 0.00 O ATOM 486 CB LEU A 31 0.126 11.093 -2.345 1.00 0.00 C ATOM 487 CG LEU A 31 -1.176 10.478 -1.844 1.00 0.00 C ATOM 488 CD1 LEU A 31 -1.321 9.068 -2.411 1.00 0.00 C ATOM 489 CD2 LEU A 31 -1.133 10.405 -0.315 1.00 0.00 C ATOM 0 H LEU A 31 -0.166 11.438 -4.707 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.961 13.004 -2.368 1.00 0.00 H new ATOM 0 HB2 LEU A 31 0.545 10.478 -3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.860 11.115 -1.540 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.021 11.088 -2.164 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.251 8.626 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.335 9.113 -3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -0.480 8.456 -2.084 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -2.060 9.966 0.055 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.290 9.788 -0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.018 11.409 0.094 1.00 0.00 H new ATOM 501 N GLY A 32 2.133 13.186 -3.401 1.00 0.00 N ATOM 502 CA GLY A 32 3.386 13.945 -3.161 1.00 0.00 C ATOM 503 C GLY A 32 4.183 13.192 -2.097 1.00 0.00 C ATOM 504 O GLY A 32 4.974 13.759 -1.371 1.00 0.00 O ATOM 0 H GLY A 32 2.146 12.562 -4.208 1.00 0.00 H new ATOM 0 HA2 GLY A 32 3.963 14.033 -4.081 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.162 14.958 -2.827 1.00 0.00 H new ATOM 508 N HIS A 33 3.958 11.905 -2.002 1.00 0.00 N ATOM 509 CA HIS A 33 4.674 11.075 -0.989 1.00 0.00 C ATOM 510 C HIS A 33 6.163 11.407 -0.987 1.00 0.00 C ATOM 511 O HIS A 33 6.633 12.194 -1.784 1.00 0.00 O ATOM 512 CB HIS A 33 4.460 9.634 -1.447 1.00 0.00 C ATOM 513 CG HIS A 33 3.078 9.180 -1.071 1.00 0.00 C ATOM 514 ND1 HIS A 33 2.277 8.457 -1.940 1.00 0.00 N ATOM 515 CD2 HIS A 33 2.349 9.322 0.082 1.00 0.00 C ATOM 516 CE1 HIS A 33 1.125 8.189 -1.301 1.00 0.00 C ATOM 517 NE2 HIS A 33 1.115 8.695 -0.065 1.00 0.00 N ATOM 0 H HIS A 33 3.302 11.391 -2.590 1.00 0.00 H new ATOM 0 HA HIS A 33 4.306 11.251 0.022 1.00 0.00 H new ATOM 0 HB2 HIS A 33 4.595 9.562 -2.526 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.204 8.983 -0.988 1.00 0.00 H new ATOM 0 HD1 HIS A 33 2.518 8.179 -2.891 1.00 0.00 H new ATOM 0 HD2 HIS A 33 2.682 9.841 0.969 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.307 7.632 -1.734 1.00 0.00 H new ATOM 525 N GLU A 34 6.922 10.811 -0.107 1.00 0.00 N ATOM 526 CA GLU A 34 8.386 11.125 -0.101 1.00 0.00 C ATOM 527 C GLU A 34 9.209 9.909 -0.542 1.00 0.00 C ATOM 528 O GLU A 34 10.296 10.046 -1.067 1.00 0.00 O ATOM 529 CB GLU A 34 8.723 11.516 1.336 1.00 0.00 C ATOM 530 CG GLU A 34 9.817 12.587 1.328 1.00 0.00 C ATOM 531 CD GLU A 34 10.952 12.152 0.401 1.00 0.00 C ATOM 532 OE1 GLU A 34 10.831 12.369 -0.794 1.00 0.00 O ATOM 533 OE2 GLU A 34 11.923 11.610 0.901 1.00 0.00 O ATOM 0 H GLU A 34 6.607 10.138 0.591 1.00 0.00 H new ATOM 0 HA GLU A 34 8.623 11.928 -0.799 1.00 0.00 H new ATOM 0 HB2 GLU A 34 7.833 11.893 1.840 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.059 10.642 1.893 1.00 0.00 H new ATOM 0 HG2 GLU A 34 9.405 13.539 0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.197 12.741 2.338 1.00 0.00 H new ATOM 540 N VAL A 35 8.706 8.724 -0.341 1.00 0.00 N ATOM 541 CA VAL A 35 9.472 7.513 -0.757 1.00 0.00 C ATOM 542 C VAL A 35 8.599 6.265 -0.618 1.00 0.00 C ATOM 543 O VAL A 35 8.505 5.675 0.441 1.00 0.00 O ATOM 544 CB VAL A 35 10.662 7.450 0.203 1.00 0.00 C ATOM 545 CG1 VAL A 35 10.156 7.500 1.644 1.00 0.00 C ATOM 546 CG2 VAL A 35 11.432 6.146 -0.016 1.00 0.00 C ATOM 0 H VAL A 35 7.801 8.540 0.092 1.00 0.00 H new ATOM 0 HA VAL A 35 9.792 7.561 -1.798 1.00 0.00 H new ATOM 0 HB VAL A 35 11.321 8.297 0.015 1.00 0.00 H new ATOM 0 HG11 VAL A 35 11.003 7.455 2.329 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.608 8.428 1.805 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.496 6.652 1.827 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.279 6.104 0.669 1.00 0.00 H new ATOM 0 HG22 VAL A 35 10.772 5.298 0.170 1.00 0.00 H new ATOM 0 HG23 VAL A 35 11.794 6.105 -1.043 1.00 0.00 H new ATOM 556 N ALA A 36 7.956 5.859 -1.680 1.00 0.00 N ATOM 557 CA ALA A 36 7.091 4.657 -1.606 1.00 0.00 C ATOM 558 C ALA A 36 7.905 3.397 -1.899 1.00 0.00 C ATOM 559 O ALA A 36 9.062 3.465 -2.264 1.00 0.00 O ATOM 560 CB ALA A 36 6.030 4.869 -2.685 1.00 0.00 C ATOM 0 H ALA A 36 7.995 6.311 -2.594 1.00 0.00 H new ATOM 0 HA ALA A 36 6.651 4.527 -0.617 1.00 0.00 H new ATOM 0 HB1 ALA A 36 5.347 4.020 -2.696 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.472 5.781 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.513 4.958 -3.658 1.00 0.00 H new ATOM 566 N ALA A 37 7.303 2.248 -1.760 1.00 0.00 N ATOM 567 CA ALA A 37 8.035 0.982 -2.050 1.00 0.00 C ATOM 568 C ALA A 37 7.290 0.206 -3.127 1.00 0.00 C ATOM 569 O ALA A 37 6.078 0.194 -3.169 1.00 0.00 O ATOM 570 CB ALA A 37 8.040 0.181 -0.746 1.00 0.00 C ATOM 0 H ALA A 37 6.336 2.131 -1.458 1.00 0.00 H new ATOM 0 HA ALA A 37 9.049 1.173 -2.402 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.566 -0.761 -0.900 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.544 0.755 0.032 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.014 -0.022 -0.440 1.00 0.00 H new ATOM 576 N THR A 38 7.998 -0.443 -3.998 1.00 0.00 N ATOM 577 CA THR A 38 7.315 -1.215 -5.061 1.00 0.00 C ATOM 578 C THR A 38 8.006 -2.566 -5.273 1.00 0.00 C ATOM 579 O THR A 38 9.202 -2.700 -5.108 1.00 0.00 O ATOM 580 CB THR A 38 7.395 -0.324 -6.306 1.00 0.00 C ATOM 581 OG1 THR A 38 6.233 -0.527 -7.091 1.00 0.00 O ATOM 582 CG2 THR A 38 8.642 -0.660 -7.132 1.00 0.00 C ATOM 0 H THR A 38 9.017 -0.473 -4.020 1.00 0.00 H new ATOM 0 HA THR A 38 6.281 -1.452 -4.812 1.00 0.00 H new ATOM 0 HB THR A 38 7.460 0.719 -5.996 1.00 0.00 H new ATOM 0 HG1 THR A 38 5.747 0.319 -7.182 1.00 0.00 H new ATOM 0 HG21 THR A 38 8.680 -0.017 -8.011 1.00 0.00 H new ATOM 0 HG22 THR A 38 9.534 -0.500 -6.526 1.00 0.00 H new ATOM 0 HG23 THR A 38 8.600 -1.703 -7.447 1.00 0.00 H new ATOM 590 N ALA A 39 7.227 -3.559 -5.601 1.00 0.00 N ATOM 591 CA ALA A 39 7.737 -4.949 -5.809 1.00 0.00 C ATOM 592 C ALA A 39 7.673 -5.667 -4.474 1.00 0.00 C ATOM 593 O ALA A 39 7.449 -5.061 -3.459 1.00 0.00 O ATOM 594 CB ALA A 39 9.175 -4.883 -6.315 1.00 0.00 C ATOM 0 H ALA A 39 6.221 -3.462 -5.739 1.00 0.00 H new ATOM 0 HA ALA A 39 7.138 -5.484 -6.546 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.553 -5.894 -6.469 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.204 -4.337 -7.258 1.00 0.00 H new ATOM 0 HB3 ALA A 39 9.796 -4.371 -5.580 1.00 0.00 H new ATOM 600 N SER A 40 7.811 -6.944 -4.458 1.00 0.00 N ATOM 601 CA SER A 40 7.691 -7.660 -3.165 1.00 0.00 C ATOM 602 C SER A 40 9.053 -7.965 -2.547 1.00 0.00 C ATOM 603 O SER A 40 9.921 -8.557 -3.159 1.00 0.00 O ATOM 604 CB SER A 40 6.906 -8.924 -3.495 1.00 0.00 C ATOM 605 OG SER A 40 7.794 -9.929 -3.969 1.00 0.00 O ATOM 0 H SER A 40 8.000 -7.528 -5.272 1.00 0.00 H new ATOM 0 HA SER A 40 7.185 -7.057 -2.411 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.380 -9.279 -2.609 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.150 -8.708 -4.250 1.00 0.00 H new ATOM 0 HG SER A 40 8.709 -9.578 -3.980 1.00 0.00 H new ATOM 611 N ARG A 41 9.231 -7.549 -1.320 1.00 0.00 N ATOM 612 CA ARG A 41 10.511 -7.782 -0.612 1.00 0.00 C ATOM 613 C ARG A 41 10.236 -8.155 0.848 1.00 0.00 C ATOM 614 O ARG A 41 9.718 -7.361 1.608 1.00 0.00 O ATOM 615 CB ARG A 41 11.246 -6.445 -0.671 1.00 0.00 C ATOM 616 CG ARG A 41 12.752 -6.701 -0.723 1.00 0.00 C ATOM 617 CD ARG A 41 13.285 -6.295 -2.096 1.00 0.00 C ATOM 618 NE ARG A 41 14.401 -5.355 -1.809 1.00 0.00 N ATOM 619 CZ ARG A 41 14.991 -4.722 -2.786 1.00 0.00 C ATOM 620 NH1 ARG A 41 14.337 -3.822 -3.469 1.00 0.00 N ATOM 621 NH2 ARG A 41 16.233 -4.991 -3.080 1.00 0.00 N ATOM 0 H ARG A 41 8.528 -7.050 -0.775 1.00 0.00 H new ATOM 0 HA ARG A 41 11.088 -8.592 -1.060 1.00 0.00 H new ATOM 0 HB2 ARG A 41 10.930 -5.881 -1.549 1.00 0.00 H new ATOM 0 HB3 ARG A 41 10.998 -5.841 0.202 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.256 -6.133 0.058 1.00 0.00 H new ATOM 0 HG3 ARG A 41 12.960 -7.754 -0.536 1.00 0.00 H new ATOM 0 HD2 ARG A 41 13.633 -7.162 -2.657 1.00 0.00 H new ATOM 0 HD3 ARG A 41 12.510 -5.817 -2.696 1.00 0.00 H new ATOM 0 HE ARG A 41 14.706 -5.205 -0.847 1.00 0.00 H new ATOM 0 HH11 ARG A 41 13.365 -3.614 -3.239 1.00 0.00 H new ATOM 0 HH12 ARG A 41 14.798 -3.327 -4.233 1.00 0.00 H new ATOM 0 HH21 ARG A 41 16.742 -5.696 -2.547 1.00 0.00 H new ATOM 0 HH22 ARG A 41 16.695 -4.497 -3.843 1.00 0.00 H new ATOM 635 N MET A 42 10.577 -9.345 1.252 1.00 0.00 N ATOM 636 CA MET A 42 10.329 -9.739 2.666 1.00 0.00 C ATOM 637 C MET A 42 11.054 -8.780 3.615 1.00 0.00 C ATOM 638 O MET A 42 10.590 -8.498 4.702 1.00 0.00 O ATOM 639 CB MET A 42 10.893 -11.153 2.792 1.00 0.00 C ATOM 640 CG MET A 42 9.954 -12.140 2.095 1.00 0.00 C ATOM 641 SD MET A 42 9.747 -13.608 3.132 1.00 0.00 S ATOM 642 CE MET A 42 11.173 -14.530 2.507 1.00 0.00 C ATOM 0 H MET A 42 11.014 -10.059 0.669 1.00 0.00 H new ATOM 0 HA MET A 42 9.271 -9.702 2.926 1.00 0.00 H new ATOM 0 HB2 MET A 42 11.886 -11.201 2.345 1.00 0.00 H new ATOM 0 HB3 MET A 42 11.003 -11.420 3.843 1.00 0.00 H new ATOM 0 HG2 MET A 42 8.987 -11.671 1.912 1.00 0.00 H new ATOM 0 HG3 MET A 42 10.361 -12.422 1.124 1.00 0.00 H new ATOM 0 HE1 MET A 42 11.239 -15.490 3.020 1.00 0.00 H new ATOM 0 HE2 MET A 42 11.057 -14.698 1.436 1.00 0.00 H new ATOM 0 HE3 MET A 42 12.083 -13.959 2.688 1.00 0.00 H new ATOM 652 N GLN A 43 12.189 -8.275 3.211 1.00 0.00 N ATOM 653 CA GLN A 43 12.942 -7.333 4.091 1.00 0.00 C ATOM 654 C GLN A 43 12.223 -5.982 4.161 1.00 0.00 C ATOM 655 O GLN A 43 11.810 -5.544 5.216 1.00 0.00 O ATOM 656 CB GLN A 43 14.313 -7.182 3.428 1.00 0.00 C ATOM 657 CG GLN A 43 15.173 -8.408 3.750 1.00 0.00 C ATOM 658 CD GLN A 43 16.123 -8.692 2.583 1.00 0.00 C ATOM 659 OE1 GLN A 43 15.787 -8.453 1.440 1.00 0.00 O ATOM 660 NE2 GLN A 43 17.303 -9.198 2.825 1.00 0.00 N ATOM 0 H GLN A 43 12.627 -8.473 2.311 1.00 0.00 H new ATOM 0 HA GLN A 43 13.024 -7.699 5.114 1.00 0.00 H new ATOM 0 HB2 GLN A 43 14.198 -7.078 2.349 1.00 0.00 H new ATOM 0 HB3 GLN A 43 14.804 -6.276 3.785 1.00 0.00 H new ATOM 0 HG2 GLN A 43 15.744 -8.235 4.662 1.00 0.00 H new ATOM 0 HG3 GLN A 43 14.536 -9.274 3.932 1.00 0.00 H new ATOM 0 HE21 GLN A 43 17.585 -9.399 3.785 1.00 0.00 H new ATOM 0 HE22 GLN A 43 17.942 -9.392 2.054 1.00 0.00 H new ATOM 669 N GLU A 44 12.066 -5.318 3.047 1.00 0.00 N ATOM 670 CA GLU A 44 11.370 -4.001 3.059 1.00 0.00 C ATOM 671 C GLU A 44 9.912 -4.184 3.493 1.00 0.00 C ATOM 672 O GLU A 44 9.396 -3.439 4.306 1.00 0.00 O ATOM 673 CB GLU A 44 11.444 -3.493 1.618 1.00 0.00 C ATOM 674 CG GLU A 44 12.909 -3.350 1.198 1.00 0.00 C ATOM 675 CD GLU A 44 12.988 -3.108 -0.311 1.00 0.00 C ATOM 676 OE1 GLU A 44 12.482 -3.936 -1.051 1.00 0.00 O ATOM 677 OE2 GLU A 44 13.553 -2.099 -0.701 1.00 0.00 O ATOM 0 H GLU A 44 12.389 -5.631 2.132 1.00 0.00 H new ATOM 0 HA GLU A 44 11.826 -3.299 3.757 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.930 -4.185 0.951 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.936 -2.532 1.534 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.373 -2.522 1.734 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.463 -4.251 1.462 1.00 0.00 H new ATOM 684 N ALA A 45 9.244 -5.176 2.967 1.00 0.00 N ATOM 685 CA ALA A 45 7.827 -5.403 3.368 1.00 0.00 C ATOM 686 C ALA A 45 7.729 -5.339 4.888 1.00 0.00 C ATOM 687 O ALA A 45 6.801 -4.785 5.444 1.00 0.00 O ATOM 688 CB ALA A 45 7.485 -6.804 2.861 1.00 0.00 C ATOM 0 H ALA A 45 9.616 -5.834 2.282 1.00 0.00 H new ATOM 0 HA ALA A 45 7.144 -4.659 2.960 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.453 -7.043 3.120 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.605 -6.838 1.778 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.153 -7.531 3.323 1.00 0.00 H new ATOM 694 N LEU A 46 8.702 -5.885 5.561 1.00 0.00 N ATOM 695 CA LEU A 46 8.700 -5.843 7.045 1.00 0.00 C ATOM 696 C LEU A 46 8.584 -4.392 7.503 1.00 0.00 C ATOM 697 O LEU A 46 7.956 -4.084 8.496 1.00 0.00 O ATOM 698 CB LEU A 46 10.052 -6.428 7.448 1.00 0.00 C ATOM 699 CG LEU A 46 10.053 -6.712 8.945 1.00 0.00 C ATOM 700 CD1 LEU A 46 9.742 -8.190 9.179 1.00 0.00 C ATOM 701 CD2 LEU A 46 11.429 -6.379 9.525 1.00 0.00 C ATOM 0 H LEU A 46 9.502 -6.360 5.143 1.00 0.00 H new ATOM 0 HA LEU A 46 7.872 -6.394 7.490 1.00 0.00 H new ATOM 0 HB2 LEU A 46 10.244 -7.346 6.892 1.00 0.00 H new ATOM 0 HB3 LEU A 46 10.852 -5.731 7.198 1.00 0.00 H new ATOM 0 HG LEU A 46 9.296 -6.099 9.435 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.742 -8.397 10.249 1.00 0.00 H new ATOM 0 HD12 LEU A 46 8.762 -8.426 8.764 1.00 0.00 H new ATOM 0 HD13 LEU A 46 10.500 -8.803 8.691 1.00 0.00 H new ATOM 0 HD21 LEU A 46 11.431 -6.582 10.596 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.187 -6.992 9.038 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.650 -5.325 9.355 1.00 0.00 H new ATOM 713 N ASP A 47 9.189 -3.499 6.771 1.00 0.00 N ATOM 714 CA ASP A 47 9.126 -2.060 7.132 1.00 0.00 C ATOM 715 C ASP A 47 7.689 -1.548 7.001 1.00 0.00 C ATOM 716 O ASP A 47 7.274 -0.647 7.703 1.00 0.00 O ATOM 717 CB ASP A 47 10.042 -1.374 6.120 1.00 0.00 C ATOM 718 CG ASP A 47 11.411 -2.058 6.131 1.00 0.00 C ATOM 719 OD1 ASP A 47 11.634 -2.876 7.008 1.00 0.00 O ATOM 720 OD2 ASP A 47 12.212 -1.754 5.263 1.00 0.00 O ATOM 0 H ASP A 47 9.729 -3.709 5.931 1.00 0.00 H new ATOM 0 HA ASP A 47 9.434 -1.867 8.160 1.00 0.00 H new ATOM 0 HB2 ASP A 47 9.605 -1.426 5.123 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.149 -0.318 6.367 1.00 0.00 H new ATOM 725 N ILE A 48 6.924 -2.119 6.108 1.00 0.00 N ATOM 726 CA ILE A 48 5.515 -1.664 5.937 1.00 0.00 C ATOM 727 C ILE A 48 4.608 -2.377 6.941 1.00 0.00 C ATOM 728 O ILE A 48 3.508 -1.956 7.183 1.00 0.00 O ATOM 729 CB ILE A 48 5.091 -2.014 4.490 1.00 0.00 C ATOM 730 CG1 ILE A 48 4.339 -3.357 4.456 1.00 0.00 C ATOM 731 CG2 ILE A 48 6.310 -2.099 3.578 1.00 0.00 C ATOM 732 CD1 ILE A 48 4.254 -3.872 3.015 1.00 0.00 C ATOM 0 H ILE A 48 7.214 -2.878 5.492 1.00 0.00 H new ATOM 0 HA ILE A 48 5.431 -0.592 6.113 1.00 0.00 H new ATOM 0 HB ILE A 48 4.431 -1.222 4.135 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.852 -4.087 5.082 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.337 -3.233 4.867 1.00 0.00 H new ATOM 0 HG21 ILE A 48 5.990 -2.346 2.566 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.827 -1.139 3.571 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.985 -2.872 3.944 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.721 -4.822 2.999 1.00 0.00 H new ATOM 0 HD12 ILE A 48 3.721 -3.147 2.400 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.260 -4.014 2.619 1.00 0.00 H new ATOM 744 N ALA A 49 5.034 -3.478 7.492 1.00 0.00 N ATOM 745 CA ALA A 49 4.148 -4.199 8.439 1.00 0.00 C ATOM 746 C ALA A 49 4.433 -3.809 9.893 1.00 0.00 C ATOM 747 O ALA A 49 3.617 -3.198 10.555 1.00 0.00 O ATOM 748 CB ALA A 49 4.440 -5.682 8.209 1.00 0.00 C ATOM 0 H ALA A 49 5.946 -3.904 7.329 1.00 0.00 H new ATOM 0 HA ALA A 49 3.100 -3.952 8.267 1.00 0.00 H new ATOM 0 HB1 ALA A 49 3.821 -6.282 8.875 1.00 0.00 H new ATOM 0 HB2 ALA A 49 4.216 -5.941 7.174 1.00 0.00 H new ATOM 0 HB3 ALA A 49 5.492 -5.882 8.413 1.00 0.00 H new ATOM 754 N ARG A 50 5.573 -4.187 10.404 1.00 0.00 N ATOM 755 CA ARG A 50 5.904 -3.874 11.824 1.00 0.00 C ATOM 756 C ARG A 50 5.881 -2.365 12.095 1.00 0.00 C ATOM 757 O ARG A 50 5.677 -1.937 13.214 1.00 0.00 O ATOM 758 CB ARG A 50 7.313 -4.428 12.032 1.00 0.00 C ATOM 759 CG ARG A 50 8.331 -3.522 11.338 1.00 0.00 C ATOM 760 CD ARG A 50 9.548 -4.354 10.930 1.00 0.00 C ATOM 761 NE ARG A 50 10.663 -3.870 11.793 1.00 0.00 N ATOM 762 CZ ARG A 50 10.957 -2.600 11.833 1.00 0.00 C ATOM 763 NH1 ARG A 50 10.647 -1.826 10.830 1.00 0.00 N ATOM 764 NH2 ARG A 50 11.561 -2.103 12.879 1.00 0.00 N ATOM 0 H ARG A 50 6.293 -4.702 9.897 1.00 0.00 H new ATOM 0 HA ARG A 50 5.174 -4.312 12.505 1.00 0.00 H new ATOM 0 HB2 ARG A 50 7.535 -4.492 13.097 1.00 0.00 H new ATOM 0 HB3 ARG A 50 7.379 -5.439 11.631 1.00 0.00 H new ATOM 0 HG2 ARG A 50 7.883 -3.057 10.460 1.00 0.00 H new ATOM 0 HG3 ARG A 50 8.634 -2.716 12.006 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.366 -5.418 11.082 1.00 0.00 H new ATOM 0 HD3 ARG A 50 9.781 -4.219 9.874 1.00 0.00 H new ATOM 0 HE ARG A 50 11.197 -4.534 12.354 1.00 0.00 H new ATOM 0 HH11 ARG A 50 10.174 -2.214 10.014 1.00 0.00 H new ATOM 0 HH12 ARG A 50 10.877 -0.833 10.862 1.00 0.00 H new ATOM 0 HH21 ARG A 50 11.802 -2.708 13.664 1.00 0.00 H new ATOM 0 HH22 ARG A 50 11.791 -1.110 12.911 1.00 0.00 H new ATOM 778 N LYS A 51 6.102 -1.554 11.098 1.00 0.00 N ATOM 779 CA LYS A 51 6.103 -0.082 11.337 1.00 0.00 C ATOM 780 C LYS A 51 4.780 0.369 11.962 1.00 0.00 C ATOM 781 O LYS A 51 4.761 1.111 12.923 1.00 0.00 O ATOM 782 CB LYS A 51 6.276 0.549 9.958 1.00 0.00 C ATOM 783 CG LYS A 51 5.973 2.045 10.053 1.00 0.00 C ATOM 784 CD LYS A 51 7.095 2.837 9.380 1.00 0.00 C ATOM 785 CE LYS A 51 8.083 3.323 10.443 1.00 0.00 C ATOM 786 NZ LYS A 51 9.425 2.929 9.931 1.00 0.00 N ATOM 0 H LYS A 51 6.281 -1.842 10.136 1.00 0.00 H new ATOM 0 HA LYS A 51 6.894 0.212 12.027 1.00 0.00 H new ATOM 0 HB2 LYS A 51 7.293 0.393 9.598 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.607 0.074 9.240 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.020 2.265 9.573 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.880 2.342 11.098 1.00 0.00 H new ATOM 0 HD2 LYS A 51 7.608 2.212 8.649 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.680 3.687 8.838 1.00 0.00 H new ATOM 0 HE2 LYS A 51 8.015 4.402 10.581 1.00 0.00 H new ATOM 0 HE3 LYS A 51 7.879 2.864 11.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 10.156 3.229 10.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.463 1.896 9.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 9.594 3.386 9.012 1.00 0.00 H new ATOM 800 N GLY A 52 3.675 -0.066 11.425 1.00 0.00 N ATOM 801 CA GLY A 52 2.361 0.350 11.994 1.00 0.00 C ATOM 802 C GLY A 52 2.000 1.749 11.481 1.00 0.00 C ATOM 803 O GLY A 52 0.904 1.982 11.010 1.00 0.00 O ATOM 0 H GLY A 52 3.623 -0.690 10.619 1.00 0.00 H new ATOM 0 HA2 GLY A 52 1.588 -0.364 11.710 1.00 0.00 H new ATOM 0 HA3 GLY A 52 2.409 0.352 13.083 1.00 0.00 H new ATOM 807 N GLN A 53 2.913 2.682 11.565 1.00 0.00 N ATOM 808 CA GLN A 53 2.621 4.064 11.078 1.00 0.00 C ATOM 809 C GLN A 53 3.292 4.303 9.722 1.00 0.00 C ATOM 810 O GLN A 53 3.834 5.359 9.461 1.00 0.00 O ATOM 811 CB GLN A 53 3.210 4.994 12.137 1.00 0.00 C ATOM 812 CG GLN A 53 4.730 4.832 12.171 1.00 0.00 C ATOM 813 CD GLN A 53 5.371 6.158 12.582 1.00 0.00 C ATOM 814 OE1 GLN A 53 6.514 6.419 12.263 1.00 0.00 O ATOM 815 NE2 GLN A 53 4.677 7.016 13.278 1.00 0.00 N ATOM 0 H GLN A 53 3.848 2.547 11.950 1.00 0.00 H new ATOM 0 HA GLN A 53 1.553 4.232 10.938 1.00 0.00 H new ATOM 0 HB2 GLN A 53 2.949 6.028 11.913 1.00 0.00 H new ATOM 0 HB3 GLN A 53 2.787 4.763 13.115 1.00 0.00 H new ATOM 0 HG2 GLN A 53 5.008 4.047 12.875 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.097 4.526 11.191 1.00 0.00 H new ATOM 0 HE21 GLN A 53 3.717 6.798 13.546 1.00 0.00 H new ATOM 0 HE22 GLN A 53 5.094 7.905 13.554 1.00 0.00 H new ATOM 824 N PHE A 54 3.249 3.330 8.857 1.00 0.00 N ATOM 825 CA PHE A 54 3.873 3.491 7.511 1.00 0.00 C ATOM 826 C PHE A 54 2.820 4.000 6.517 1.00 0.00 C ATOM 827 O PHE A 54 2.900 3.767 5.328 1.00 0.00 O ATOM 828 CB PHE A 54 4.370 2.093 7.125 1.00 0.00 C ATOM 829 CG PHE A 54 3.221 1.117 7.126 1.00 0.00 C ATOM 830 CD1 PHE A 54 2.454 0.955 5.971 1.00 0.00 C ATOM 831 CD2 PHE A 54 2.926 0.371 8.276 1.00 0.00 C ATOM 832 CE1 PHE A 54 1.394 0.049 5.960 1.00 0.00 C ATOM 833 CE2 PHE A 54 1.862 -0.534 8.266 1.00 0.00 C ATOM 834 CZ PHE A 54 1.096 -0.698 7.106 1.00 0.00 C ATOM 0 H PHE A 54 2.807 2.426 9.023 1.00 0.00 H new ATOM 0 HA PHE A 54 4.690 4.212 7.508 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.832 2.122 6.138 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.137 1.765 7.826 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.681 1.531 5.086 1.00 0.00 H new ATOM 0 HD2 PHE A 54 3.521 0.496 9.169 1.00 0.00 H new ATOM 0 HE1 PHE A 54 0.802 -0.077 5.066 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.631 -1.106 9.152 1.00 0.00 H new ATOM 0 HZ PHE A 54 0.276 -1.400 7.095 1.00 0.00 H new ATOM 844 N ASP A 55 1.837 4.703 7.016 1.00 0.00 N ATOM 845 CA ASP A 55 0.761 5.257 6.145 1.00 0.00 C ATOM 846 C ASP A 55 0.030 4.139 5.395 1.00 0.00 C ATOM 847 O ASP A 55 -1.098 3.818 5.702 1.00 0.00 O ATOM 848 CB ASP A 55 1.481 6.188 5.178 1.00 0.00 C ATOM 849 CG ASP A 55 0.458 6.853 4.253 1.00 0.00 C ATOM 850 OD1 ASP A 55 -0.724 6.634 4.457 1.00 0.00 O ATOM 851 OD2 ASP A 55 0.872 7.577 3.362 1.00 0.00 O ATOM 0 H ASP A 55 1.734 4.920 8.007 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.003 5.779 6.721 1.00 0.00 H new ATOM 0 HB2 ASP A 55 2.035 6.947 5.731 1.00 0.00 H new ATOM 0 HB3 ASP A 55 2.208 5.628 4.590 1.00 0.00 H new ATOM 856 N ILE A 56 0.652 3.552 4.409 1.00 0.00 N ATOM 857 CA ILE A 56 -0.042 2.461 3.644 1.00 0.00 C ATOM 858 C ILE A 56 0.946 1.379 3.187 1.00 0.00 C ATOM 859 O ILE A 56 2.131 1.620 3.069 1.00 0.00 O ATOM 860 CB ILE A 56 -0.647 3.161 2.428 1.00 0.00 C ATOM 861 CG1 ILE A 56 -1.741 4.125 2.890 1.00 0.00 C ATOM 862 CG2 ILE A 56 -1.244 2.116 1.485 1.00 0.00 C ATOM 863 CD1 ILE A 56 -2.462 4.710 1.673 1.00 0.00 C ATOM 0 H ILE A 56 1.598 3.772 4.098 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.788 1.957 4.258 1.00 0.00 H new ATOM 0 HB ILE A 56 0.128 3.719 1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -2.452 3.603 3.530 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.305 4.926 3.486 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.676 2.614 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.461 1.431 1.158 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -2.021 1.557 2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.241 5.396 2.006 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.747 5.247 1.050 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.913 3.903 1.095 1.00 0.00 H new ATOM 875 N ALA A 57 0.465 0.185 2.912 1.00 0.00 N ATOM 876 CA ALA A 57 1.389 -0.895 2.449 1.00 0.00 C ATOM 877 C ALA A 57 0.616 -1.918 1.626 1.00 0.00 C ATOM 878 O ALA A 57 -0.402 -2.421 2.054 1.00 0.00 O ATOM 879 CB ALA A 57 1.932 -1.549 3.713 1.00 0.00 C ATOM 0 H ALA A 57 -0.516 -0.082 2.988 1.00 0.00 H new ATOM 0 HA ALA A 57 2.190 -0.501 1.824 1.00 0.00 H new ATOM 0 HB1 ALA A 57 2.618 -2.352 3.442 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.461 -0.805 4.309 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.106 -1.959 4.294 1.00 0.00 H new ATOM 885 N ILE A 58 1.078 -2.241 0.455 1.00 0.00 N ATOM 886 CA ILE A 58 0.331 -3.234 -0.358 1.00 0.00 C ATOM 887 C ILE A 58 1.220 -4.405 -0.779 1.00 0.00 C ATOM 888 O ILE A 58 1.860 -4.369 -1.811 1.00 0.00 O ATOM 889 CB ILE A 58 -0.138 -2.458 -1.590 1.00 0.00 C ATOM 890 CG1 ILE A 58 -1.254 -1.494 -1.186 1.00 0.00 C ATOM 891 CG2 ILE A 58 -0.666 -3.432 -2.644 1.00 0.00 C ATOM 892 CD1 ILE A 58 -0.650 -0.308 -0.436 1.00 0.00 C ATOM 0 H ILE A 58 1.927 -1.868 0.030 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.493 -3.669 0.207 1.00 0.00 H new ATOM 0 HB ILE A 58 0.700 -1.898 -2.005 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.788 -1.146 -2.071 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.981 -2.005 -0.556 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.999 -2.875 -3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.128 -4.121 -2.932 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -1.504 -3.995 -2.232 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.443 0.381 -0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.136 -0.665 0.456 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.061 0.207 -1.082 1.00 0.00 H new ATOM 904 N ILE A 59 1.218 -5.467 -0.020 1.00 0.00 N ATOM 905 CA ILE A 59 2.013 -6.660 -0.424 1.00 0.00 C ATOM 906 C ILE A 59 1.086 -7.538 -1.250 1.00 0.00 C ATOM 907 O ILE A 59 0.782 -8.661 -0.903 1.00 0.00 O ATOM 908 CB ILE A 59 2.435 -7.365 0.872 1.00 0.00 C ATOM 909 CG1 ILE A 59 3.407 -6.473 1.653 1.00 0.00 C ATOM 910 CG2 ILE A 59 3.122 -8.682 0.525 1.00 0.00 C ATOM 911 CD1 ILE A 59 3.243 -6.734 3.153 1.00 0.00 C ATOM 0 H ILE A 59 0.704 -5.560 0.856 1.00 0.00 H new ATOM 0 HA ILE A 59 2.900 -6.419 -1.009 1.00 0.00 H new ATOM 0 HB ILE A 59 1.554 -7.559 1.484 1.00 0.00 H new ATOM 0 HG12 ILE A 59 4.433 -6.679 1.347 1.00 0.00 H new ATOM 0 HG13 ILE A 59 3.213 -5.424 1.432 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.424 -9.187 1.442 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.431 -9.318 -0.029 1.00 0.00 H new ATOM 0 HG23 ILE A 59 4.002 -8.483 -0.087 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.933 -6.101 3.710 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.220 -6.506 3.452 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.459 -7.781 3.366 1.00 0.00 H new ATOM 923 N ASP A 60 0.595 -6.994 -2.324 1.00 0.00 N ATOM 924 CA ASP A 60 -0.364 -7.741 -3.173 1.00 0.00 C ATOM 925 C ASP A 60 0.309 -8.904 -3.889 1.00 0.00 C ATOM 926 O ASP A 60 1.501 -9.114 -3.792 1.00 0.00 O ATOM 927 CB ASP A 60 -0.918 -6.688 -4.157 1.00 0.00 C ATOM 928 CG ASP A 60 -0.773 -7.150 -5.616 1.00 0.00 C ATOM 929 OD1 ASP A 60 0.352 -7.278 -6.065 1.00 0.00 O ATOM 930 OD2 ASP A 60 -1.790 -7.363 -6.257 1.00 0.00 O ATOM 0 H ASP A 60 0.820 -6.055 -2.652 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.161 -8.202 -2.589 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.969 -6.500 -3.937 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -0.389 -5.745 -4.018 1.00 0.00 H new ATOM 935 N VAL A 61 -0.486 -9.648 -4.608 1.00 0.00 N ATOM 936 CA VAL A 61 0.004 -10.822 -5.376 1.00 0.00 C ATOM 937 C VAL A 61 0.053 -12.074 -4.476 1.00 0.00 C ATOM 938 O VAL A 61 1.086 -12.529 -4.032 1.00 0.00 O ATOM 939 CB VAL A 61 1.370 -10.402 -5.966 1.00 0.00 C ATOM 940 CG1 VAL A 61 2.547 -11.033 -5.214 1.00 0.00 C ATOM 941 CG2 VAL A 61 1.423 -10.830 -7.432 1.00 0.00 C ATOM 0 H VAL A 61 -1.489 -9.482 -4.696 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.661 -11.106 -6.192 1.00 0.00 H new ATOM 0 HB VAL A 61 1.461 -9.320 -5.868 1.00 0.00 H new ATOM 0 HG11 VAL A 61 3.484 -10.708 -5.666 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.521 -10.722 -4.170 1.00 0.00 H new ATOM 0 HG13 VAL A 61 2.475 -12.119 -5.271 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.382 -10.540 -7.861 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.308 -11.912 -7.500 1.00 0.00 H new ATOM 0 HG23 VAL A 61 0.617 -10.344 -7.982 1.00 0.00 H new ATOM 951 N ASN A 62 -1.088 -12.649 -4.217 1.00 0.00 N ATOM 952 CA ASN A 62 -1.133 -13.874 -3.371 1.00 0.00 C ATOM 953 C ASN A 62 -1.439 -15.075 -4.261 1.00 0.00 C ATOM 954 O ASN A 62 -2.290 -15.888 -3.960 1.00 0.00 O ATOM 955 CB ASN A 62 -2.271 -13.639 -2.378 1.00 0.00 C ATOM 956 CG ASN A 62 -1.790 -12.715 -1.259 1.00 0.00 C ATOM 957 OD1 ASN A 62 -1.875 -13.054 -0.096 1.00 0.00 O ATOM 958 ND2 ASN A 62 -1.282 -11.552 -1.563 1.00 0.00 N ATOM 0 H ASN A 62 -1.993 -12.323 -4.555 1.00 0.00 H new ATOM 0 HA ASN A 62 -0.193 -14.068 -2.855 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -3.126 -13.196 -2.888 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.606 -14.589 -1.961 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -0.957 -10.929 -0.824 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -1.210 -11.266 -2.540 1.00 0.00 H new ATOM 965 N LEU A 63 -0.761 -15.179 -5.369 1.00 0.00 N ATOM 966 CA LEU A 63 -1.017 -16.309 -6.299 1.00 0.00 C ATOM 967 C LEU A 63 0.306 -16.869 -6.816 1.00 0.00 C ATOM 968 O LEU A 63 1.366 -16.354 -6.521 1.00 0.00 O ATOM 969 CB LEU A 63 -1.816 -15.687 -7.445 1.00 0.00 C ATOM 970 CG LEU A 63 -3.096 -16.490 -7.679 1.00 0.00 C ATOM 971 CD1 LEU A 63 -4.295 -15.718 -7.122 1.00 0.00 C ATOM 972 CD2 LEU A 63 -3.286 -16.709 -9.181 1.00 0.00 C ATOM 0 H LEU A 63 -0.038 -14.526 -5.670 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.549 -17.133 -5.823 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.063 -14.652 -7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.214 -15.671 -8.354 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.020 -17.453 -7.174 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.207 -16.292 -7.290 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.159 -15.557 -6.053 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.374 -14.755 -7.627 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.198 -17.281 -9.353 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.363 -15.744 -9.682 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.433 -17.258 -9.579 1.00 0.00 H new ATOM 984 N ASP A 64 0.254 -17.917 -7.587 1.00 0.00 N ATOM 985 CA ASP A 64 1.513 -18.502 -8.121 1.00 0.00 C ATOM 986 C ASP A 64 2.543 -18.638 -6.997 1.00 0.00 C ATOM 987 O ASP A 64 3.734 -18.645 -7.233 1.00 0.00 O ATOM 988 CB ASP A 64 1.993 -17.500 -9.173 1.00 0.00 C ATOM 989 CG ASP A 64 2.150 -18.206 -10.520 1.00 0.00 C ATOM 990 OD1 ASP A 64 1.140 -18.587 -11.087 1.00 0.00 O ATOM 991 OD2 ASP A 64 3.277 -18.355 -10.960 1.00 0.00 O ATOM 0 H ASP A 64 -0.603 -18.393 -7.870 1.00 0.00 H new ATOM 0 HA ASP A 64 1.368 -19.497 -8.542 1.00 0.00 H new ATOM 0 HB2 ASP A 64 1.280 -16.681 -9.261 1.00 0.00 H new ATOM 0 HB3 ASP A 64 2.944 -17.063 -8.867 1.00 0.00 H new ATOM 996 N GLY A 65 2.095 -18.753 -5.775 1.00 0.00 N ATOM 997 CA GLY A 65 3.060 -18.895 -4.646 1.00 0.00 C ATOM 998 C GLY A 65 2.603 -18.078 -3.434 1.00 0.00 C ATOM 999 O GLY A 65 3.259 -18.072 -2.413 1.00 0.00 O ATOM 0 H GLY A 65 1.110 -18.755 -5.511 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.151 -19.945 -4.369 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.049 -18.562 -4.963 1.00 0.00 H new ATOM 1003 N GLU A 66 1.494 -17.390 -3.546 1.00 0.00 N ATOM 1004 CA GLU A 66 0.978 -16.558 -2.412 1.00 0.00 C ATOM 1005 C GLU A 66 2.129 -16.007 -1.555 1.00 0.00 C ATOM 1006 O GLU A 66 2.174 -16.216 -0.359 1.00 0.00 O ATOM 1007 CB GLU A 66 0.065 -17.492 -1.602 1.00 0.00 C ATOM 1008 CG GLU A 66 0.893 -18.408 -0.694 1.00 0.00 C ATOM 1009 CD GLU A 66 0.542 -18.125 0.768 1.00 0.00 C ATOM 1010 OE1 GLU A 66 0.148 -17.007 1.056 1.00 0.00 O ATOM 1011 OE2 GLU A 66 0.675 -19.031 1.574 1.00 0.00 O ATOM 0 H GLU A 66 0.916 -17.369 -4.386 1.00 0.00 H new ATOM 0 HA GLU A 66 0.435 -15.683 -2.768 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.624 -16.901 -0.999 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.540 -18.094 -2.280 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.692 -19.453 -0.932 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.957 -18.241 -0.863 1.00 0.00 H new ATOM 1018 N PRO A 67 3.027 -15.321 -2.211 1.00 0.00 N ATOM 1019 CA PRO A 67 4.205 -14.736 -1.518 1.00 0.00 C ATOM 1020 C PRO A 67 3.817 -13.499 -0.698 1.00 0.00 C ATOM 1021 O PRO A 67 4.252 -12.401 -0.978 1.00 0.00 O ATOM 1022 CB PRO A 67 5.132 -14.345 -2.665 1.00 0.00 C ATOM 1023 CG PRO A 67 4.234 -14.144 -3.844 1.00 0.00 C ATOM 1024 CD PRO A 67 3.031 -15.031 -3.648 1.00 0.00 C ATOM 0 HA PRO A 67 4.659 -15.429 -0.810 1.00 0.00 H new ATOM 0 HB2 PRO A 67 5.685 -13.435 -2.432 1.00 0.00 H new ATOM 0 HB3 PRO A 67 5.868 -15.125 -2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 67 3.932 -13.100 -3.924 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.752 -14.398 -4.769 1.00 0.00 H new ATOM 0 HD2 PRO A 67 2.113 -14.530 -3.956 1.00 0.00 H new ATOM 0 HD3 PRO A 67 3.109 -15.944 -4.238 1.00 0.00 H new ATOM 1032 N SER A 68 3.019 -13.666 0.322 1.00 0.00 N ATOM 1033 CA SER A 68 2.628 -12.495 1.162 1.00 0.00 C ATOM 1034 C SER A 68 3.205 -12.650 2.576 1.00 0.00 C ATOM 1035 O SER A 68 2.910 -11.874 3.464 1.00 0.00 O ATOM 1036 CB SER A 68 1.101 -12.521 1.198 1.00 0.00 C ATOM 1037 OG SER A 68 0.594 -11.472 0.383 1.00 0.00 O ATOM 0 H SER A 68 2.621 -14.560 0.610 1.00 0.00 H new ATOM 0 HA SER A 68 3.006 -11.553 0.763 1.00 0.00 H new ATOM 0 HB2 SER A 68 0.734 -13.484 0.842 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.748 -12.404 2.223 1.00 0.00 H new ATOM 0 HG SER A 68 0.051 -10.866 0.930 1.00 0.00 H new ATOM 1043 N TYR A 69 4.024 -13.656 2.772 1.00 0.00 N ATOM 1044 CA TYR A 69 4.652 -13.919 4.103 1.00 0.00 C ATOM 1045 C TYR A 69 3.629 -13.824 5.233 1.00 0.00 C ATOM 1046 O TYR A 69 2.502 -13.404 5.044 1.00 0.00 O ATOM 1047 CB TYR A 69 5.765 -12.876 4.313 1.00 0.00 C ATOM 1048 CG TYR A 69 5.836 -11.873 3.180 1.00 0.00 C ATOM 1049 CD1 TYR A 69 6.646 -12.131 2.070 1.00 0.00 C ATOM 1050 CD2 TYR A 69 5.110 -10.676 3.251 1.00 0.00 C ATOM 1051 CE1 TYR A 69 6.732 -11.192 1.037 1.00 0.00 C ATOM 1052 CE2 TYR A 69 5.193 -9.743 2.217 1.00 0.00 C ATOM 1053 CZ TYR A 69 6.008 -10.000 1.108 1.00 0.00 C ATOM 1054 OH TYR A 69 6.105 -9.078 0.086 1.00 0.00 O ATOM 0 H TYR A 69 4.289 -14.321 2.045 1.00 0.00 H new ATOM 0 HA TYR A 69 5.058 -14.931 4.118 1.00 0.00 H new ATOM 0 HB2 TYR A 69 5.593 -12.349 5.251 1.00 0.00 H new ATOM 0 HB3 TYR A 69 6.724 -13.385 4.405 1.00 0.00 H new ATOM 0 HD1 TYR A 69 7.204 -13.054 2.010 1.00 0.00 H new ATOM 0 HD2 TYR A 69 4.485 -10.475 4.108 1.00 0.00 H new ATOM 0 HE1 TYR A 69 7.361 -11.390 0.181 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.629 -8.824 2.272 1.00 0.00 H new ATOM 0 HH TYR A 69 6.881 -9.291 -0.474 1.00 0.00 H new ATOM 1064 N PRO A 70 4.072 -14.225 6.388 1.00 0.00 N ATOM 1065 CA PRO A 70 3.210 -14.188 7.582 1.00 0.00 C ATOM 1066 C PRO A 70 3.084 -12.750 8.083 1.00 0.00 C ATOM 1067 O PRO A 70 2.346 -12.470 8.999 1.00 0.00 O ATOM 1068 CB PRO A 70 3.954 -15.054 8.592 1.00 0.00 C ATOM 1069 CG PRO A 70 5.388 -15.007 8.168 1.00 0.00 C ATOM 1070 CD PRO A 70 5.409 -14.753 6.682 1.00 0.00 C ATOM 0 HA PRO A 70 2.196 -14.544 7.398 1.00 0.00 H new ATOM 0 HB2 PRO A 70 3.830 -14.672 9.605 1.00 0.00 H new ATOM 0 HB3 PRO A 70 3.576 -16.076 8.589 1.00 0.00 H new ATOM 0 HG2 PRO A 70 5.920 -14.218 8.700 1.00 0.00 H new ATOM 0 HG3 PRO A 70 5.889 -15.946 8.404 1.00 0.00 H new ATOM 0 HD2 PRO A 70 6.187 -14.040 6.411 1.00 0.00 H new ATOM 0 HD3 PRO A 70 5.607 -15.668 6.124 1.00 0.00 H new ATOM 1078 N VAL A 71 3.791 -11.828 7.487 1.00 0.00 N ATOM 1079 CA VAL A 71 3.680 -10.420 7.957 1.00 0.00 C ATOM 1080 C VAL A 71 2.512 -9.726 7.249 1.00 0.00 C ATOM 1081 O VAL A 71 1.658 -9.143 7.887 1.00 0.00 O ATOM 1082 CB VAL A 71 5.026 -9.756 7.647 1.00 0.00 C ATOM 1083 CG1 VAL A 71 6.151 -10.598 8.249 1.00 0.00 C ATOM 1084 CG2 VAL A 71 5.232 -9.657 6.141 1.00 0.00 C ATOM 0 H VAL A 71 4.430 -11.986 6.708 1.00 0.00 H new ATOM 0 HA VAL A 71 3.472 -10.355 9.025 1.00 0.00 H new ATOM 0 HB VAL A 71 5.034 -8.754 8.075 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.111 -10.131 8.032 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.017 -10.666 9.329 1.00 0.00 H new ATOM 0 HG13 VAL A 71 6.128 -11.598 7.817 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.192 -9.183 5.935 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.220 -10.656 5.706 1.00 0.00 H new ATOM 0 HG23 VAL A 71 4.432 -9.060 5.703 1.00 0.00 H new ATOM 1094 N ALA A 72 2.440 -9.801 5.946 1.00 0.00 N ATOM 1095 CA ALA A 72 1.302 -9.169 5.235 1.00 0.00 C ATOM 1096 C ALA A 72 0.001 -9.792 5.727 1.00 0.00 C ATOM 1097 O ALA A 72 -0.929 -9.109 6.106 1.00 0.00 O ATOM 1098 CB ALA A 72 1.528 -9.521 3.775 1.00 0.00 C ATOM 0 H ALA A 72 3.120 -10.272 5.349 1.00 0.00 H new ATOM 0 HA ALA A 72 1.239 -8.093 5.396 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.729 -9.093 3.170 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.487 -9.119 3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.530 -10.605 3.658 1.00 0.00 H new ATOM 1104 N ASP A 73 -0.060 -11.096 5.733 1.00 0.00 N ATOM 1105 CA ASP A 73 -1.290 -11.775 6.212 1.00 0.00 C ATOM 1106 C ASP A 73 -1.692 -11.212 7.571 1.00 0.00 C ATOM 1107 O ASP A 73 -2.795 -10.740 7.761 1.00 0.00 O ATOM 1108 CB ASP A 73 -0.906 -13.241 6.334 1.00 0.00 C ATOM 1109 CG ASP A 73 -1.220 -13.962 5.024 1.00 0.00 C ATOM 1110 OD1 ASP A 73 -1.845 -13.351 4.173 1.00 0.00 O ATOM 1111 OD2 ASP A 73 -0.833 -15.111 4.895 1.00 0.00 O ATOM 0 H ASP A 73 0.689 -11.717 5.427 1.00 0.00 H new ATOM 0 HA ASP A 73 -2.137 -11.633 5.540 1.00 0.00 H new ATOM 0 HB2 ASP A 73 0.155 -13.332 6.566 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -1.452 -13.704 7.156 1.00 0.00 H new ATOM 1116 N ILE A 74 -0.794 -11.240 8.515 1.00 0.00 N ATOM 1117 CA ILE A 74 -1.127 -10.681 9.854 1.00 0.00 C ATOM 1118 C ILE A 74 -1.522 -9.224 9.665 1.00 0.00 C ATOM 1119 O ILE A 74 -2.510 -8.752 10.193 1.00 0.00 O ATOM 1120 CB ILE A 74 0.154 -10.808 10.695 1.00 0.00 C ATOM 1121 CG1 ILE A 74 0.081 -12.098 11.520 1.00 0.00 C ATOM 1122 CG2 ILE A 74 0.284 -9.617 11.654 1.00 0.00 C ATOM 1123 CD1 ILE A 74 1.294 -12.980 11.230 1.00 0.00 C ATOM 0 H ILE A 74 0.147 -11.622 8.420 1.00 0.00 H new ATOM 0 HA ILE A 74 -1.951 -11.197 10.347 1.00 0.00 H new ATOM 0 HB ILE A 74 1.016 -10.827 10.028 1.00 0.00 H new ATOM 0 HG12 ILE A 74 0.043 -11.857 12.582 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -0.835 -12.638 11.283 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.196 -9.721 12.242 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.326 -8.691 11.081 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.578 -9.591 12.321 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.230 -13.893 11.822 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.313 -13.235 10.171 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.206 -12.442 11.490 1.00 0.00 H new ATOM 1135 N LEU A 75 -0.752 -8.519 8.890 1.00 0.00 N ATOM 1136 CA LEU A 75 -1.059 -7.098 8.623 1.00 0.00 C ATOM 1137 C LEU A 75 -2.544 -6.960 8.281 1.00 0.00 C ATOM 1138 O LEU A 75 -3.140 -5.919 8.458 1.00 0.00 O ATOM 1139 CB LEU A 75 -0.167 -6.747 7.429 1.00 0.00 C ATOM 1140 CG LEU A 75 0.150 -5.255 7.433 1.00 0.00 C ATOM 1141 CD1 LEU A 75 0.673 -4.851 8.813 1.00 0.00 C ATOM 1142 CD2 LEU A 75 1.222 -4.975 6.380 1.00 0.00 C ATOM 0 H LEU A 75 0.085 -8.874 8.427 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.873 -6.437 9.470 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.757 -7.323 7.474 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -0.667 -7.018 6.499 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.750 -4.683 7.206 1.00 0.00 H new ATOM 0 HD11 LEU A 75 0.900 -3.785 8.818 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.086 -5.064 9.566 1.00 0.00 H new ATOM 0 HD13 LEU A 75 1.577 -5.416 9.039 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.457 -3.911 6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.121 -5.544 6.616 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.853 -5.271 5.398 1.00 0.00 H new ATOM 1154 N ALA A 76 -3.147 -8.015 7.804 1.00 0.00 N ATOM 1155 CA ALA A 76 -4.589 -7.963 7.463 1.00 0.00 C ATOM 1156 C ALA A 76 -5.431 -8.423 8.663 1.00 0.00 C ATOM 1157 O ALA A 76 -6.582 -8.060 8.803 1.00 0.00 O ATOM 1158 CB ALA A 76 -4.751 -8.923 6.282 1.00 0.00 C ATOM 0 H ALA A 76 -2.696 -8.914 7.636 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.923 -6.956 7.212 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.795 -8.942 5.969 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.129 -8.587 5.452 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.445 -9.925 6.583 1.00 0.00 H new ATOM 1164 N GLU A 77 -4.859 -9.221 9.531 1.00 0.00 N ATOM 1165 CA GLU A 77 -5.616 -9.708 10.725 1.00 0.00 C ATOM 1166 C GLU A 77 -6.058 -8.527 11.597 1.00 0.00 C ATOM 1167 O GLU A 77 -7.149 -8.511 12.133 1.00 0.00 O ATOM 1168 CB GLU A 77 -4.628 -10.593 11.490 1.00 0.00 C ATOM 1169 CG GLU A 77 -4.493 -11.941 10.778 1.00 0.00 C ATOM 1170 CD GLU A 77 -3.387 -12.767 11.443 1.00 0.00 C ATOM 1171 OE1 GLU A 77 -2.946 -12.379 12.512 1.00 0.00 O ATOM 1172 OE2 GLU A 77 -3.002 -13.773 10.870 1.00 0.00 O ATOM 0 H GLU A 77 -3.898 -9.557 9.463 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.519 -10.250 10.443 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.656 -10.103 11.551 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -4.974 -10.743 12.513 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -5.439 -12.481 10.819 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -4.261 -11.785 9.725 1.00 0.00 H new ATOM 1179 N ARG A 78 -5.218 -7.539 11.738 1.00 0.00 N ATOM 1180 CA ARG A 78 -5.581 -6.357 12.564 1.00 0.00 C ATOM 1181 C ARG A 78 -5.370 -5.074 11.753 1.00 0.00 C ATOM 1182 O ARG A 78 -5.327 -3.989 12.295 1.00 0.00 O ATOM 1183 CB ARG A 78 -4.644 -6.405 13.776 1.00 0.00 C ATOM 1184 CG ARG A 78 -3.225 -6.763 13.325 1.00 0.00 C ATOM 1185 CD ARG A 78 -2.332 -6.953 14.553 1.00 0.00 C ATOM 1186 NE ARG A 78 -2.409 -5.661 15.289 1.00 0.00 N ATOM 1187 CZ ARG A 78 -2.676 -5.652 16.567 1.00 0.00 C ATOM 1188 NH1 ARG A 78 -3.846 -6.042 16.991 1.00 0.00 N ATOM 1189 NH2 ARG A 78 -1.771 -5.255 17.419 1.00 0.00 N ATOM 0 H ARG A 78 -4.291 -7.501 11.314 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.626 -6.369 12.873 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.641 -5.440 14.283 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.003 -7.141 14.495 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.241 -7.675 12.729 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.824 -5.974 12.689 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -2.681 -7.780 15.171 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -1.306 -7.182 14.264 1.00 0.00 H new ATOM 0 HE ARG A 78 -2.253 -4.783 14.795 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -4.552 -6.354 16.324 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -4.055 -6.035 17.989 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -0.856 -4.952 17.086 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -1.979 -5.248 18.418 1.00 0.00 H new ATOM 1203 N ASN A 79 -5.247 -5.222 10.454 1.00 0.00 N ATOM 1204 CA ASN A 79 -5.043 -4.064 9.515 1.00 0.00 C ATOM 1205 C ASN A 79 -5.115 -2.696 10.206 1.00 0.00 C ATOM 1206 O ASN A 79 -6.176 -2.186 10.505 1.00 0.00 O ATOM 1207 CB ASN A 79 -6.167 -4.189 8.479 1.00 0.00 C ATOM 1208 CG ASN A 79 -7.433 -4.749 9.134 1.00 0.00 C ATOM 1209 OD1 ASN A 79 -8.016 -4.118 9.992 1.00 0.00 O ATOM 1210 ND2 ASN A 79 -7.882 -5.918 8.767 1.00 0.00 N ATOM 0 H ASN A 79 -5.281 -6.129 9.988 1.00 0.00 H new ATOM 0 HA ASN A 79 -4.045 -4.108 9.080 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -6.377 -3.213 8.041 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -5.850 -4.842 7.666 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -8.722 -6.301 9.201 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -7.393 -6.449 8.046 1.00 0.00 H new ATOM 1217 N VAL A 80 -3.979 -2.094 10.420 1.00 0.00 N ATOM 1218 CA VAL A 80 -3.924 -0.741 11.048 1.00 0.00 C ATOM 1219 C VAL A 80 -4.232 0.294 9.941 1.00 0.00 C ATOM 1220 O VAL A 80 -4.612 -0.107 8.860 1.00 0.00 O ATOM 1221 CB VAL A 80 -2.474 -0.695 11.583 1.00 0.00 C ATOM 1222 CG1 VAL A 80 -1.543 0.148 10.691 1.00 0.00 C ATOM 1223 CG2 VAL A 80 -2.470 -0.153 13.015 1.00 0.00 C ATOM 0 H VAL A 80 -3.069 -2.488 10.182 1.00 0.00 H new ATOM 0 HA VAL A 80 -4.634 -0.531 11.848 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.087 -1.714 11.571 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.537 0.147 11.112 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -1.517 -0.277 9.688 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.915 1.171 10.642 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.447 -0.122 13.389 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.891 0.852 13.025 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -3.070 -0.803 13.652 1.00 0.00 H new ATOM 1233 N PRO A 81 -4.054 1.579 10.185 1.00 0.00 N ATOM 1234 CA PRO A 81 -4.328 2.559 9.102 1.00 0.00 C ATOM 1235 C PRO A 81 -3.429 2.214 7.920 1.00 0.00 C ATOM 1236 O PRO A 81 -2.227 2.110 8.056 1.00 0.00 O ATOM 1237 CB PRO A 81 -3.999 3.908 9.739 1.00 0.00 C ATOM 1238 CG PRO A 81 -3.082 3.566 10.863 1.00 0.00 C ATOM 1239 CD PRO A 81 -3.590 2.253 11.403 1.00 0.00 C ATOM 0 HA PRO A 81 -5.349 2.562 8.720 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.522 4.580 9.026 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.898 4.410 10.097 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -2.052 3.478 10.518 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -3.095 4.339 11.631 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -2.806 1.689 11.907 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -4.396 2.393 12.124 1.00 0.00 H new ATOM 1247 N PHE A 82 -4.013 1.976 6.776 1.00 0.00 N ATOM 1248 CA PHE A 82 -3.206 1.555 5.598 1.00 0.00 C ATOM 1249 C PHE A 82 -4.100 1.247 4.394 1.00 0.00 C ATOM 1250 O PHE A 82 -5.153 1.819 4.206 1.00 0.00 O ATOM 1251 CB PHE A 82 -2.537 0.248 6.059 1.00 0.00 C ATOM 1252 CG PHE A 82 -3.541 -0.904 6.011 1.00 0.00 C ATOM 1253 CD1 PHE A 82 -4.885 -0.704 6.384 1.00 0.00 C ATOM 1254 CD2 PHE A 82 -3.122 -2.176 5.600 1.00 0.00 C ATOM 1255 CE1 PHE A 82 -5.795 -1.768 6.344 1.00 0.00 C ATOM 1256 CE2 PHE A 82 -4.038 -3.240 5.565 1.00 0.00 C ATOM 1257 CZ PHE A 82 -5.371 -3.035 5.937 1.00 0.00 C ATOM 0 H PHE A 82 -5.016 2.056 6.608 1.00 0.00 H new ATOM 0 HA PHE A 82 -2.506 2.332 5.290 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -1.683 0.023 5.420 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -2.154 0.365 7.073 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -5.215 0.274 6.702 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -2.094 -2.338 5.310 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.825 -1.609 6.628 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.712 -4.220 5.250 1.00 0.00 H new ATOM 0 HZ PHE A 82 -6.072 -3.856 5.909 1.00 0.00 H new ATOM 1267 N ILE A 83 -3.662 0.304 3.603 1.00 0.00 N ATOM 1268 CA ILE A 83 -4.416 -0.143 2.403 1.00 0.00 C ATOM 1269 C ILE A 83 -3.733 -1.410 1.902 1.00 0.00 C ATOM 1270 O ILE A 83 -2.540 -1.586 2.106 1.00 0.00 O ATOM 1271 CB ILE A 83 -4.291 1.001 1.400 1.00 0.00 C ATOM 1272 CG1 ILE A 83 -5.587 1.818 1.372 1.00 0.00 C ATOM 1273 CG2 ILE A 83 -4.002 0.474 -0.014 1.00 0.00 C ATOM 1274 CD1 ILE A 83 -6.784 0.880 1.208 1.00 0.00 C ATOM 0 H ILE A 83 -2.781 -0.190 3.748 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.468 -0.365 2.584 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.459 1.630 1.717 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.686 2.392 2.293 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -5.559 2.535 0.551 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -3.919 1.313 -0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -3.067 -0.087 -0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -4.815 -0.179 -0.332 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.704 1.464 1.188 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.686 0.325 0.275 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -6.816 0.181 2.044 1.00 0.00 H new ATOM 1286 N PHE A 84 -4.463 -2.294 1.278 1.00 0.00 N ATOM 1287 CA PHE A 84 -3.838 -3.556 0.802 1.00 0.00 C ATOM 1288 C PHE A 84 -4.508 -4.077 -0.475 1.00 0.00 C ATOM 1289 O PHE A 84 -5.542 -3.589 -0.928 1.00 0.00 O ATOM 1290 CB PHE A 84 -4.050 -4.525 1.953 1.00 0.00 C ATOM 1291 CG PHE A 84 -2.978 -5.592 1.939 1.00 0.00 C ATOM 1292 CD1 PHE A 84 -1.749 -5.360 2.571 1.00 0.00 C ATOM 1293 CD2 PHE A 84 -3.215 -6.818 1.300 1.00 0.00 C ATOM 1294 CE1 PHE A 84 -0.758 -6.351 2.564 1.00 0.00 C ATOM 1295 CE2 PHE A 84 -2.223 -7.808 1.294 1.00 0.00 C ATOM 1296 CZ PHE A 84 -0.996 -7.574 1.925 1.00 0.00 C ATOM 0 H PHE A 84 -5.459 -2.196 1.079 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.788 -3.421 0.544 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -4.026 -3.987 2.901 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -5.034 -4.986 1.873 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.565 -4.417 3.064 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.162 -6.999 0.813 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.189 -6.171 3.051 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.406 -8.752 0.802 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.232 -8.337 1.919 1.00 0.00 H new ATOM 1306 N ALA A 85 -3.913 -5.063 -1.074 1.00 0.00 N ATOM 1307 CA ALA A 85 -4.487 -5.603 -2.323 1.00 0.00 C ATOM 1308 C ALA A 85 -3.907 -6.980 -2.638 1.00 0.00 C ATOM 1309 O ALA A 85 -2.837 -7.315 -2.199 1.00 0.00 O ATOM 1310 CB ALA A 85 -4.060 -4.589 -3.383 1.00 0.00 C ATOM 0 H ALA A 85 -3.057 -5.515 -0.752 1.00 0.00 H new ATOM 0 HA ALA A 85 -5.568 -5.735 -2.267 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.439 -4.899 -4.357 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -4.464 -3.608 -3.132 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.972 -4.535 -3.417 1.00 0.00 H new ATOM 1316 N THR A 86 -4.621 -7.769 -3.400 1.00 0.00 N ATOM 1317 CA THR A 86 -4.140 -9.139 -3.785 1.00 0.00 C ATOM 1318 C THR A 86 -5.328 -9.986 -4.259 1.00 0.00 C ATOM 1319 O THR A 86 -6.352 -9.459 -4.646 1.00 0.00 O ATOM 1320 CB THR A 86 -3.493 -9.749 -2.530 1.00 0.00 C ATOM 1321 OG1 THR A 86 -3.448 -11.163 -2.651 1.00 0.00 O ATOM 1322 CG2 THR A 86 -4.294 -9.367 -1.282 1.00 0.00 C ATOM 0 H THR A 86 -5.534 -7.520 -3.780 1.00 0.00 H new ATOM 0 HA THR A 86 -3.419 -9.100 -4.602 1.00 0.00 H new ATOM 0 HB THR A 86 -2.479 -9.360 -2.434 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.135 -11.562 -2.077 1.00 0.00 H new ATOM 0 HG21 THR A 86 -3.825 -9.805 -0.401 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.314 -8.282 -1.181 1.00 0.00 H new ATOM 0 HG23 THR A 86 -5.313 -9.742 -1.375 1.00 0.00 H new ATOM 1330 N GLY A 87 -5.191 -11.287 -4.241 1.00 0.00 N ATOM 1331 CA GLY A 87 -6.297 -12.185 -4.697 1.00 0.00 C ATOM 1332 C GLY A 87 -7.661 -11.586 -4.341 1.00 0.00 C ATOM 1333 O GLY A 87 -8.420 -11.195 -5.206 1.00 0.00 O ATOM 0 H GLY A 87 -4.351 -11.772 -3.926 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.230 -12.335 -5.775 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.192 -13.165 -4.232 1.00 0.00 H new ATOM 1337 N TYR A 88 -7.984 -11.516 -3.078 1.00 0.00 N ATOM 1338 CA TYR A 88 -9.305 -10.947 -2.679 1.00 0.00 C ATOM 1339 C TYR A 88 -9.171 -9.460 -2.334 1.00 0.00 C ATOM 1340 O TYR A 88 -10.106 -8.835 -1.877 1.00 0.00 O ATOM 1341 CB TYR A 88 -9.731 -11.753 -1.449 1.00 0.00 C ATOM 1342 CG TYR A 88 -8.663 -11.671 -0.386 1.00 0.00 C ATOM 1343 CD1 TYR A 88 -8.615 -10.567 0.473 1.00 0.00 C ATOM 1344 CD2 TYR A 88 -7.724 -12.701 -0.256 1.00 0.00 C ATOM 1345 CE1 TYR A 88 -7.627 -10.493 1.462 1.00 0.00 C ATOM 1346 CE2 TYR A 88 -6.735 -12.626 0.733 1.00 0.00 C ATOM 1347 CZ TYR A 88 -6.687 -11.522 1.592 1.00 0.00 C ATOM 1348 OH TYR A 88 -5.713 -11.446 2.566 1.00 0.00 O ATOM 0 H TYR A 88 -7.393 -11.827 -2.307 1.00 0.00 H new ATOM 0 HA TYR A 88 -10.038 -11.013 -3.483 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -10.674 -11.368 -1.060 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.901 -12.793 -1.726 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.340 -9.773 0.373 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -7.762 -13.553 -0.918 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.590 -9.641 2.125 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -6.010 -13.420 0.833 1.00 0.00 H new ATOM 0 HH TYR A 88 -5.143 -12.242 2.521 1.00 0.00 H new ATOM 1358 N GLY A 89 -8.017 -8.887 -2.551 1.00 0.00 N ATOM 1359 CA GLY A 89 -7.834 -7.442 -2.236 1.00 0.00 C ATOM 1360 C GLY A 89 -7.706 -7.264 -0.727 1.00 0.00 C ATOM 1361 O GLY A 89 -6.685 -6.841 -0.221 1.00 0.00 O ATOM 0 H GLY A 89 -7.196 -9.357 -2.932 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.944 -7.060 -2.735 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -8.681 -6.867 -2.610 1.00 0.00 H new ATOM 1365 N SER A 90 -8.738 -7.590 -0.003 1.00 0.00 N ATOM 1366 CA SER A 90 -8.688 -7.451 1.476 1.00 0.00 C ATOM 1367 C SER A 90 -9.888 -8.174 2.101 1.00 0.00 C ATOM 1368 O SER A 90 -10.977 -8.156 1.561 1.00 0.00 O ATOM 1369 CB SER A 90 -8.774 -5.950 1.746 1.00 0.00 C ATOM 1370 OG SER A 90 -7.473 -5.447 2.012 1.00 0.00 O ATOM 0 H SER A 90 -9.618 -7.948 -0.374 1.00 0.00 H new ATOM 0 HA SER A 90 -7.783 -7.884 1.902 1.00 0.00 H new ATOM 0 HB2 SER A 90 -9.206 -5.438 0.886 1.00 0.00 H new ATOM 0 HB3 SER A 90 -9.431 -5.758 2.594 1.00 0.00 H new ATOM 0 HG SER A 90 -6.840 -5.818 1.362 1.00 0.00 H new ATOM 1376 N LYS A 91 -9.716 -8.794 3.238 1.00 0.00 N ATOM 1377 CA LYS A 91 -10.877 -9.486 3.872 1.00 0.00 C ATOM 1378 C LYS A 91 -11.739 -8.436 4.567 1.00 0.00 C ATOM 1379 O LYS A 91 -11.664 -8.256 5.766 1.00 0.00 O ATOM 1380 CB LYS A 91 -10.333 -10.491 4.912 1.00 0.00 C ATOM 1381 CG LYS A 91 -8.843 -10.790 4.701 1.00 0.00 C ATOM 1382 CD LYS A 91 -8.010 -9.885 5.615 1.00 0.00 C ATOM 1383 CE LYS A 91 -8.321 -10.212 7.079 1.00 0.00 C ATOM 1384 NZ LYS A 91 -8.233 -11.695 7.166 1.00 0.00 N ATOM 0 H LYS A 91 -8.835 -8.852 3.750 1.00 0.00 H new ATOM 0 HA LYS A 91 -11.473 -10.015 3.129 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.484 -10.091 5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -10.901 -11.419 4.850 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.636 -11.837 4.921 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.571 -10.623 3.659 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -6.948 -10.029 5.417 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -8.234 -8.838 5.410 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -7.608 -9.734 7.751 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.312 -9.858 7.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.027 -11.974 8.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.137 -12.114 6.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -7.473 -12.035 6.543 1.00 0.00 H new ATOM 1398 N GLY A 92 -12.537 -7.713 3.829 1.00 0.00 N ATOM 1399 CA GLY A 92 -13.358 -6.657 4.478 1.00 0.00 C ATOM 1400 C GLY A 92 -12.423 -5.830 5.356 1.00 0.00 C ATOM 1401 O GLY A 92 -12.818 -5.273 6.361 1.00 0.00 O ATOM 0 H GLY A 92 -12.654 -7.807 2.820 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -13.837 -6.028 3.728 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -14.153 -7.102 5.076 1.00 0.00 H new ATOM 1405 N LEU A 93 -11.171 -5.777 4.976 1.00 0.00 N ATOM 1406 CA LEU A 93 -10.157 -5.020 5.766 1.00 0.00 C ATOM 1407 C LEU A 93 -10.757 -3.776 6.435 1.00 0.00 C ATOM 1408 O LEU A 93 -11.518 -3.027 5.858 1.00 0.00 O ATOM 1409 CB LEU A 93 -9.023 -4.670 4.778 1.00 0.00 C ATOM 1410 CG LEU A 93 -9.441 -3.649 3.695 1.00 0.00 C ATOM 1411 CD1 LEU A 93 -10.890 -3.853 3.234 1.00 0.00 C ATOM 1412 CD2 LEU A 93 -9.259 -2.229 4.231 1.00 0.00 C ATOM 0 H LEU A 93 -10.805 -6.233 4.140 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.777 -5.618 6.594 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.177 -4.270 5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.681 -5.584 4.292 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.800 -3.806 2.828 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -11.137 -3.113 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -11.001 -4.854 2.816 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -11.562 -3.738 4.084 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.554 -1.511 3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.880 -2.092 5.116 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.213 -2.070 4.493 1.00 0.00 H new ATOM 1424 N ASP A 94 -10.411 -3.565 7.671 1.00 0.00 N ATOM 1425 CA ASP A 94 -10.934 -2.384 8.412 1.00 0.00 C ATOM 1426 C ASP A 94 -9.791 -1.406 8.660 1.00 0.00 C ATOM 1427 O ASP A 94 -8.640 -1.792 8.709 1.00 0.00 O ATOM 1428 CB ASP A 94 -11.489 -2.933 9.729 1.00 0.00 C ATOM 1429 CG ASP A 94 -10.337 -3.286 10.671 1.00 0.00 C ATOM 1430 OD1 ASP A 94 -9.636 -2.377 11.083 1.00 0.00 O ATOM 1431 OD2 ASP A 94 -10.175 -4.459 10.964 1.00 0.00 O ATOM 0 H ASP A 94 -9.783 -4.165 8.206 1.00 0.00 H new ATOM 0 HA ASP A 94 -11.708 -1.849 7.861 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -12.139 -2.193 10.196 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -12.098 -3.817 9.537 1.00 0.00 H new ATOM 1436 N THR A 95 -10.082 -0.149 8.807 1.00 0.00 N ATOM 1437 CA THR A 95 -8.985 0.825 9.039 1.00 0.00 C ATOM 1438 C THR A 95 -9.545 2.216 9.302 1.00 0.00 C ATOM 1439 O THR A 95 -10.694 2.383 9.656 1.00 0.00 O ATOM 1440 CB THR A 95 -8.197 0.825 7.735 1.00 0.00 C ATOM 1441 OG1 THR A 95 -7.190 1.817 7.792 1.00 0.00 O ATOM 1442 CG2 THR A 95 -9.138 1.119 6.568 1.00 0.00 C ATOM 0 H THR A 95 -11.022 0.245 8.777 1.00 0.00 H new ATOM 0 HA THR A 95 -8.378 0.559 9.904 1.00 0.00 H new ATOM 0 HB THR A 95 -7.736 -0.152 7.590 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.308 1.390 7.769 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.573 1.119 5.636 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.912 0.353 6.523 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.601 2.095 6.711 1.00 0.00 H new ATOM 1450 N ARG A 96 -8.736 3.216 9.110 1.00 0.00 N ATOM 1451 CA ARG A 96 -9.206 4.607 9.325 1.00 0.00 C ATOM 1452 C ARG A 96 -9.516 5.250 7.977 1.00 0.00 C ATOM 1453 O ARG A 96 -9.982 6.370 7.903 1.00 0.00 O ATOM 1454 CB ARG A 96 -8.039 5.325 10.000 1.00 0.00 C ATOM 1455 CG ARG A 96 -7.488 4.461 11.137 1.00 0.00 C ATOM 1456 CD ARG A 96 -8.491 4.432 12.291 1.00 0.00 C ATOM 1457 NE ARG A 96 -8.615 5.850 12.727 1.00 0.00 N ATOM 1458 CZ ARG A 96 -9.522 6.182 13.605 1.00 0.00 C ATOM 1459 NH1 ARG A 96 -10.091 5.259 14.331 1.00 0.00 N ATOM 1460 NH2 ARG A 96 -9.864 7.432 13.752 1.00 0.00 N ATOM 0 H ARG A 96 -7.764 3.128 8.812 1.00 0.00 H new ATOM 0 HA ARG A 96 -10.111 4.654 9.930 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.254 5.528 9.271 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -8.369 6.288 10.390 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -7.300 3.449 10.780 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -6.534 4.860 11.481 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -9.453 4.032 11.969 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -8.139 3.798 13.105 1.00 0.00 H new ATOM 0 HE ARG A 96 -7.993 6.560 12.341 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -9.827 4.281 14.212 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -10.800 5.515 15.018 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -9.422 8.152 13.180 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -10.573 7.689 14.439 1.00 0.00 H new ATOM 1474 N TYR A 97 -9.258 4.549 6.904 1.00 0.00 N ATOM 1475 CA TYR A 97 -9.542 5.133 5.565 1.00 0.00 C ATOM 1476 C TYR A 97 -11.040 5.041 5.263 1.00 0.00 C ATOM 1477 O TYR A 97 -11.719 6.044 5.160 1.00 0.00 O ATOM 1478 CB TYR A 97 -8.737 4.289 4.575 1.00 0.00 C ATOM 1479 CG TYR A 97 -7.264 4.604 4.719 1.00 0.00 C ATOM 1480 CD1 TYR A 97 -6.552 4.170 5.847 1.00 0.00 C ATOM 1481 CD2 TYR A 97 -6.610 5.337 3.722 1.00 0.00 C ATOM 1482 CE1 TYR A 97 -5.189 4.470 5.974 1.00 0.00 C ATOM 1483 CE2 TYR A 97 -5.249 5.637 3.850 1.00 0.00 C ATOM 1484 CZ TYR A 97 -4.539 5.204 4.975 1.00 0.00 C ATOM 1485 OH TYR A 97 -3.197 5.502 5.100 1.00 0.00 O ATOM 0 H TYR A 97 -8.867 3.607 6.898 1.00 0.00 H new ATOM 0 HA TYR A 97 -9.268 6.186 5.507 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -8.912 3.229 4.759 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -9.065 4.494 3.556 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -7.054 3.604 6.618 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -7.156 5.672 2.853 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -4.641 4.135 6.842 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -4.746 6.203 3.080 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.707 4.697 5.369 1.00 0.00 H new ATOM 1495 N SER A 98 -11.557 3.840 5.138 1.00 0.00 N ATOM 1496 CA SER A 98 -13.022 3.656 4.851 1.00 0.00 C ATOM 1497 C SER A 98 -13.321 2.251 4.292 1.00 0.00 C ATOM 1498 O SER A 98 -14.463 1.911 4.055 1.00 0.00 O ATOM 1499 CB SER A 98 -13.377 4.711 3.800 1.00 0.00 C ATOM 1500 OG SER A 98 -14.189 5.713 4.397 1.00 0.00 O ATOM 0 H SER A 98 -11.026 2.973 5.223 1.00 0.00 H new ATOM 0 HA SER A 98 -13.606 3.763 5.765 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.469 5.157 3.394 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.905 4.248 2.967 1.00 0.00 H new ATOM 0 HG SER A 98 -13.633 6.294 4.957 1.00 0.00 H new ATOM 1506 N ASN A 99 -12.321 1.430 4.073 1.00 0.00 N ATOM 1507 CA ASN A 99 -12.585 0.064 3.530 1.00 0.00 C ATOM 1508 C ASN A 99 -13.303 0.154 2.184 1.00 0.00 C ATOM 1509 O ASN A 99 -14.454 -0.215 2.054 1.00 0.00 O ATOM 1510 CB ASN A 99 -13.468 -0.610 4.578 1.00 0.00 C ATOM 1511 CG ASN A 99 -12.765 -0.544 5.935 1.00 0.00 C ATOM 1512 OD1 ASN A 99 -13.384 -0.733 6.963 1.00 0.00 O ATOM 1513 ND2 ASN A 99 -11.486 -0.285 5.981 1.00 0.00 N ATOM 0 H ASN A 99 -11.340 1.647 4.246 1.00 0.00 H new ATOM 0 HA ASN A 99 -11.667 -0.497 3.352 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -14.437 -0.113 4.631 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -13.657 -1.647 4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -11.007 -0.241 6.880 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -10.966 -0.126 5.118 1.00 0.00 H new ATOM 1520 N ILE A 100 -12.625 0.642 1.179 1.00 0.00 N ATOM 1521 CA ILE A 100 -13.264 0.754 -0.168 1.00 0.00 C ATOM 1522 C ILE A 100 -12.268 0.382 -1.286 1.00 0.00 C ATOM 1523 O ILE A 100 -12.486 -0.583 -1.991 1.00 0.00 O ATOM 1524 CB ILE A 100 -13.763 2.211 -0.348 1.00 0.00 C ATOM 1525 CG1 ILE A 100 -13.725 3.026 0.963 1.00 0.00 C ATOM 1526 CG2 ILE A 100 -15.209 2.174 -0.841 1.00 0.00 C ATOM 1527 CD1 ILE A 100 -12.607 4.069 0.897 1.00 0.00 C ATOM 0 H ILE A 100 -11.660 0.967 1.231 1.00 0.00 H new ATOM 0 HA ILE A 100 -14.101 0.059 -0.235 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.097 2.695 -1.062 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -14.684 3.518 1.123 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.563 2.360 1.811 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -15.575 3.192 -0.973 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.255 1.646 -1.793 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.830 1.657 -0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.587 4.640 1.825 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -11.649 3.567 0.758 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -12.788 4.744 0.060 1.00 0.00 H new ATOM 1539 N PRO A 101 -11.214 1.157 -1.437 1.00 0.00 N ATOM 1540 CA PRO A 101 -10.212 0.877 -2.507 1.00 0.00 C ATOM 1541 C PRO A 101 -9.382 -0.380 -2.214 1.00 0.00 C ATOM 1542 O PRO A 101 -8.170 -0.361 -2.301 1.00 0.00 O ATOM 1543 CB PRO A 101 -9.317 2.110 -2.489 1.00 0.00 C ATOM 1544 CG PRO A 101 -9.451 2.653 -1.106 1.00 0.00 C ATOM 1545 CD PRO A 101 -10.849 2.350 -0.660 1.00 0.00 C ATOM 0 HA PRO A 101 -10.690 0.691 -3.469 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.282 1.852 -2.715 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -9.633 2.840 -3.234 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -8.723 2.194 -0.437 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -9.264 3.727 -1.092 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -10.894 2.158 0.412 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -11.523 3.182 -0.864 1.00 0.00 H new ATOM 1553 N LEU A 102 -10.009 -1.473 -1.887 1.00 0.00 N ATOM 1554 CA LEU A 102 -9.218 -2.716 -1.620 1.00 0.00 C ATOM 1555 C LEU A 102 -9.363 -3.689 -2.784 1.00 0.00 C ATOM 1556 O LEU A 102 -10.450 -3.923 -3.268 1.00 0.00 O ATOM 1557 CB LEU A 102 -9.745 -3.273 -0.277 1.00 0.00 C ATOM 1558 CG LEU A 102 -10.868 -4.328 -0.443 1.00 0.00 C ATOM 1559 CD1 LEU A 102 -12.037 -3.772 -1.262 1.00 0.00 C ATOM 1560 CD2 LEU A 102 -10.328 -5.597 -1.111 1.00 0.00 C ATOM 0 H LEU A 102 -11.020 -1.565 -1.793 1.00 0.00 H new ATOM 0 HA LEU A 102 -8.147 -2.529 -1.538 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -8.916 -3.720 0.272 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.120 -2.447 0.328 1.00 0.00 H new ATOM 0 HG LEU A 102 -11.231 -4.577 0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.808 -4.536 -1.361 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -12.453 -2.900 -0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.683 -3.484 -2.252 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -11.134 -6.323 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -9.931 -5.349 -2.095 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.535 -6.022 -0.496 1.00 0.00 H new ATOM 1572 N LEU A 103 -8.273 -4.241 -3.274 1.00 0.00 N ATOM 1573 CA LEU A 103 -8.420 -5.156 -4.451 1.00 0.00 C ATOM 1574 C LEU A 103 -7.082 -5.709 -4.950 1.00 0.00 C ATOM 1575 O LEU A 103 -6.044 -5.172 -4.669 1.00 0.00 O ATOM 1576 CB LEU A 103 -8.990 -4.236 -5.519 1.00 0.00 C ATOM 1577 CG LEU A 103 -9.392 -5.045 -6.731 1.00 0.00 C ATOM 1578 CD1 LEU A 103 -10.803 -4.664 -7.120 1.00 0.00 C ATOM 1579 CD2 LEU A 103 -8.455 -4.719 -7.880 1.00 0.00 C ATOM 0 H LEU A 103 -7.324 -4.104 -2.925 1.00 0.00 H new ATOM 0 HA LEU A 103 -9.028 -6.026 -4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.853 -3.699 -5.126 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -8.249 -3.487 -5.800 1.00 0.00 H new ATOM 0 HG LEU A 103 -9.339 -6.110 -6.505 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.108 -5.240 -7.994 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.479 -4.877 -6.292 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.841 -3.600 -7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.740 -5.299 -8.758 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.519 -3.656 -8.112 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -7.432 -4.967 -7.597 1.00 0.00 H new ATOM 1591 N THR A 104 -7.111 -6.762 -5.733 1.00 0.00 N ATOM 1592 CA THR A 104 -5.840 -7.319 -6.289 1.00 0.00 C ATOM 1593 C THR A 104 -5.068 -6.198 -7.001 1.00 0.00 C ATOM 1594 O THR A 104 -4.486 -5.345 -6.362 1.00 0.00 O ATOM 1595 CB THR A 104 -6.276 -8.411 -7.272 1.00 0.00 C ATOM 1596 OG1 THR A 104 -5.185 -8.748 -8.116 1.00 0.00 O ATOM 1597 CG2 THR A 104 -7.446 -7.915 -8.122 1.00 0.00 C ATOM 0 H THR A 104 -7.959 -7.257 -6.009 1.00 0.00 H new ATOM 0 HA THR A 104 -5.180 -7.726 -5.523 1.00 0.00 H new ATOM 0 HB THR A 104 -6.592 -9.291 -6.712 1.00 0.00 H new ATOM 0 HG1 THR A 104 -5.461 -9.447 -8.744 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.748 -8.698 -8.817 1.00 0.00 H new ATOM 0 HG22 THR A 104 -8.285 -7.661 -7.474 1.00 0.00 H new ATOM 0 HG23 THR A 104 -7.140 -7.031 -8.682 1.00 0.00 H new ATOM 1605 N LYS A 105 -5.053 -6.170 -8.311 1.00 0.00 N ATOM 1606 CA LYS A 105 -4.314 -5.067 -8.995 1.00 0.00 C ATOM 1607 C LYS A 105 -4.500 -5.090 -10.521 1.00 0.00 C ATOM 1608 O LYS A 105 -3.533 -5.080 -11.256 1.00 0.00 O ATOM 1609 CB LYS A 105 -2.849 -5.302 -8.629 1.00 0.00 C ATOM 1610 CG LYS A 105 -2.245 -4.011 -8.072 1.00 0.00 C ATOM 1611 CD LYS A 105 -1.656 -4.281 -6.686 1.00 0.00 C ATOM 1612 CE LYS A 105 -0.130 -4.212 -6.764 1.00 0.00 C ATOM 1613 NZ LYS A 105 0.260 -5.311 -7.694 1.00 0.00 N ATOM 0 H LYS A 105 -5.509 -6.846 -8.923 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.683 -4.092 -8.678 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -2.772 -6.100 -7.890 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -2.292 -5.626 -9.508 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.470 -3.641 -8.743 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -3.009 -3.236 -8.010 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -2.029 -3.548 -5.971 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -1.970 -5.262 -6.330 1.00 0.00 H new ATOM 0 HE2 LYS A 105 0.203 -3.243 -7.137 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.322 -4.348 -5.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 0.706 -6.080 -7.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.586 -5.673 -8.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 0.933 -4.947 -8.399 1.00 0.00 H new ATOM 1627 N PRO A 106 -5.736 -5.068 -10.954 1.00 0.00 N ATOM 1628 CA PRO A 106 -6.040 -5.027 -12.393 1.00 0.00 C ATOM 1629 C PRO A 106 -6.203 -3.561 -12.810 1.00 0.00 C ATOM 1630 O PRO A 106 -6.469 -3.252 -13.953 1.00 0.00 O ATOM 1631 CB PRO A 106 -7.370 -5.763 -12.486 1.00 0.00 C ATOM 1632 CG PRO A 106 -8.007 -5.615 -11.133 1.00 0.00 C ATOM 1633 CD PRO A 106 -6.966 -5.081 -10.173 1.00 0.00 C ATOM 0 HA PRO A 106 -5.275 -5.468 -13.032 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -8.001 -5.336 -13.266 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -7.221 -6.813 -12.737 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -8.858 -4.936 -11.186 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -8.387 -6.576 -10.785 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.224 -4.083 -9.820 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -6.872 -5.717 -9.292 1.00 0.00 H new ATOM 1641 N PHE A 107 -6.050 -2.662 -11.863 1.00 0.00 N ATOM 1642 CA PHE A 107 -6.190 -1.207 -12.146 1.00 0.00 C ATOM 1643 C PHE A 107 -7.618 -0.875 -12.584 1.00 0.00 C ATOM 1644 O PHE A 107 -7.953 -0.883 -13.751 1.00 0.00 O ATOM 1645 CB PHE A 107 -5.156 -0.911 -13.230 1.00 0.00 C ATOM 1646 CG PHE A 107 -3.786 -1.113 -12.627 1.00 0.00 C ATOM 1647 CD1 PHE A 107 -3.466 -0.491 -11.414 1.00 0.00 C ATOM 1648 CD2 PHE A 107 -2.843 -1.927 -13.266 1.00 0.00 C ATOM 1649 CE1 PHE A 107 -2.205 -0.680 -10.840 1.00 0.00 C ATOM 1650 CE2 PHE A 107 -1.579 -2.115 -12.691 1.00 0.00 C ATOM 1651 CZ PHE A 107 -1.260 -1.491 -11.478 1.00 0.00 C ATOM 0 H PHE A 107 -5.831 -2.886 -10.892 1.00 0.00 H new ATOM 0 HA PHE A 107 -6.013 -0.589 -11.266 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -5.299 -1.572 -14.085 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -5.266 0.110 -13.595 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -4.194 0.136 -10.921 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -3.089 -2.409 -14.200 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -1.960 -0.200 -9.904 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -0.850 -2.742 -13.183 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.285 -1.636 -11.036 1.00 0.00 H new ATOM 1661 N LEU A 108 -8.454 -0.583 -11.624 1.00 0.00 N ATOM 1662 CA LEU A 108 -9.876 -0.238 -11.907 1.00 0.00 C ATOM 1663 C LEU A 108 -10.515 0.271 -10.609 1.00 0.00 C ATOM 1664 O LEU A 108 -11.154 1.303 -10.577 1.00 0.00 O ATOM 1665 CB LEU A 108 -10.517 -1.555 -12.376 1.00 0.00 C ATOM 1666 CG LEU A 108 -12.002 -1.606 -11.991 1.00 0.00 C ATOM 1667 CD1 LEU A 108 -12.829 -2.071 -13.191 1.00 0.00 C ATOM 1668 CD2 LEU A 108 -12.187 -2.590 -10.833 1.00 0.00 C ATOM 0 H LEU A 108 -8.205 -0.569 -10.635 1.00 0.00 H new ATOM 0 HA LEU A 108 -10.000 0.540 -12.660 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.413 -1.650 -13.457 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.992 -2.399 -11.930 1.00 0.00 H new ATOM 0 HG LEU A 108 -12.335 -0.613 -11.688 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -13.883 -2.106 -12.915 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.694 -1.374 -14.018 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -12.500 -3.064 -13.496 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -13.240 -2.631 -10.555 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -11.855 -3.581 -11.141 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -11.598 -2.260 -9.977 1.00 0.00 H new ATOM 1680 N ASP A 109 -10.326 -0.450 -9.536 1.00 0.00 N ATOM 1681 CA ASP A 109 -10.894 -0.025 -8.224 1.00 0.00 C ATOM 1682 C ASP A 109 -9.858 -0.251 -7.118 1.00 0.00 C ATOM 1683 O ASP A 109 -10.144 -0.116 -5.945 1.00 0.00 O ATOM 1684 CB ASP A 109 -12.113 -0.922 -8.007 1.00 0.00 C ATOM 1685 CG ASP A 109 -12.943 -0.382 -6.840 1.00 0.00 C ATOM 1686 OD1 ASP A 109 -13.800 0.452 -7.083 1.00 0.00 O ATOM 1687 OD2 ASP A 109 -12.708 -0.813 -5.723 1.00 0.00 O ATOM 0 H ASP A 109 -9.798 -1.322 -9.513 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.163 1.031 -8.208 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -12.719 -0.956 -8.913 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -11.794 -1.943 -7.798 1.00 0.00 H new ATOM 1692 N SER A 110 -8.656 -0.600 -7.490 1.00 0.00 N ATOM 1693 CA SER A 110 -7.592 -0.842 -6.476 1.00 0.00 C ATOM 1694 C SER A 110 -6.956 0.490 -6.056 1.00 0.00 C ATOM 1695 O SER A 110 -7.645 1.431 -5.715 1.00 0.00 O ATOM 1696 CB SER A 110 -6.578 -1.732 -7.192 1.00 0.00 C ATOM 1697 OG SER A 110 -5.477 -1.985 -6.329 1.00 0.00 O ATOM 0 H SER A 110 -8.365 -0.728 -8.459 1.00 0.00 H new ATOM 0 HA SER A 110 -7.970 -1.307 -5.566 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.046 -2.671 -7.486 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.234 -1.247 -8.106 1.00 0.00 H new ATOM 0 HG SER A 110 -4.827 -2.557 -6.787 1.00 0.00 H new ATOM 1703 N GLU A 111 -5.650 0.584 -6.082 1.00 0.00 N ATOM 1704 CA GLU A 111 -4.986 1.861 -5.687 1.00 0.00 C ATOM 1705 C GLU A 111 -5.741 3.051 -6.277 1.00 0.00 C ATOM 1706 O GLU A 111 -5.950 4.053 -5.627 1.00 0.00 O ATOM 1707 CB GLU A 111 -3.583 1.778 -6.288 1.00 0.00 C ATOM 1708 CG GLU A 111 -2.569 1.472 -5.186 1.00 0.00 C ATOM 1709 CD GLU A 111 -1.895 2.770 -4.740 1.00 0.00 C ATOM 1710 OE1 GLU A 111 -2.611 3.699 -4.401 1.00 0.00 O ATOM 1711 OE2 GLU A 111 -0.676 2.815 -4.747 1.00 0.00 O ATOM 0 H GLU A 111 -5.018 -0.167 -6.359 1.00 0.00 H new ATOM 0 HA GLU A 111 -4.964 1.997 -4.606 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -3.549 1.002 -7.052 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -3.330 2.718 -6.778 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.067 0.999 -4.340 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -1.821 0.768 -5.550 1.00 0.00 H new ATOM 1718 N LEU A 112 -6.159 2.940 -7.502 1.00 0.00 N ATOM 1719 CA LEU A 112 -6.910 4.063 -8.135 1.00 0.00 C ATOM 1720 C LEU A 112 -7.987 4.539 -7.172 1.00 0.00 C ATOM 1721 O LEU A 112 -7.935 5.636 -6.653 1.00 0.00 O ATOM 1722 CB LEU A 112 -7.537 3.470 -9.394 1.00 0.00 C ATOM 1723 CG LEU A 112 -6.436 2.896 -10.281 1.00 0.00 C ATOM 1724 CD1 LEU A 112 -7.059 2.009 -11.361 1.00 0.00 C ATOM 1725 CD2 LEU A 112 -5.664 4.042 -10.940 1.00 0.00 C ATOM 0 H LEU A 112 -6.016 2.123 -8.095 1.00 0.00 H new ATOM 0 HA LEU A 112 -6.276 4.917 -8.375 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.249 2.689 -9.127 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.092 4.237 -9.934 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.754 2.300 -9.675 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.272 1.599 -11.994 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.607 1.193 -10.890 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.742 2.602 -11.969 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -4.877 3.633 -11.574 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.346 4.638 -11.547 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -5.219 4.671 -10.169 1.00 0.00 H new ATOM 1737 N GLU A 113 -8.955 3.710 -6.910 1.00 0.00 N ATOM 1738 CA GLU A 113 -10.020 4.105 -5.957 1.00 0.00 C ATOM 1739 C GLU A 113 -9.371 4.590 -4.671 1.00 0.00 C ATOM 1740 O GLU A 113 -9.934 5.361 -3.922 1.00 0.00 O ATOM 1741 CB GLU A 113 -10.808 2.825 -5.695 1.00 0.00 C ATOM 1742 CG GLU A 113 -12.147 2.914 -6.414 1.00 0.00 C ATOM 1743 CD GLU A 113 -13.282 2.586 -5.440 1.00 0.00 C ATOM 1744 OE1 GLU A 113 -13.074 1.744 -4.581 1.00 0.00 O ATOM 1745 OE2 GLU A 113 -14.339 3.181 -5.570 1.00 0.00 O ATOM 0 H GLU A 113 -9.053 2.779 -7.314 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.658 4.903 -6.338 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.248 1.959 -6.047 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -10.963 2.690 -4.625 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -12.285 3.915 -6.823 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.165 2.221 -7.255 1.00 0.00 H new ATOM 1752 N ALA A 114 -8.182 4.128 -4.413 1.00 0.00 N ATOM 1753 CA ALA A 114 -7.478 4.544 -3.166 1.00 0.00 C ATOM 1754 C ALA A 114 -7.123 6.025 -3.233 1.00 0.00 C ATOM 1755 O ALA A 114 -6.938 6.677 -2.224 1.00 0.00 O ATOM 1756 CB ALA A 114 -6.213 3.690 -3.114 1.00 0.00 C ATOM 0 H ALA A 114 -7.666 3.481 -5.009 1.00 0.00 H new ATOM 0 HA ALA A 114 -8.096 4.404 -2.279 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.641 3.941 -2.220 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.487 2.635 -3.086 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.607 3.884 -3.999 1.00 0.00 H new ATOM 1762 N VAL A 115 -7.036 6.565 -4.413 1.00 0.00 N ATOM 1763 CA VAL A 115 -6.704 8.011 -4.542 1.00 0.00 C ATOM 1764 C VAL A 115 -7.968 8.780 -4.932 1.00 0.00 C ATOM 1765 O VAL A 115 -8.091 9.964 -4.688 1.00 0.00 O ATOM 1766 CB VAL A 115 -5.638 8.096 -5.639 1.00 0.00 C ATOM 1767 CG1 VAL A 115 -4.856 9.402 -5.491 1.00 0.00 C ATOM 1768 CG2 VAL A 115 -4.666 6.919 -5.509 1.00 0.00 C ATOM 0 H VAL A 115 -7.180 6.070 -5.293 1.00 0.00 H new ATOM 0 HA VAL A 115 -6.333 8.445 -3.613 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.126 8.063 -6.613 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.098 9.462 -6.272 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.538 10.247 -5.582 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -4.374 9.429 -4.514 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.910 6.984 -6.291 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -4.182 6.953 -4.533 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.214 5.982 -5.610 1.00 0.00 H new ATOM 1778 N LEU A 116 -8.917 8.100 -5.523 1.00 0.00 N ATOM 1779 CA LEU A 116 -10.191 8.769 -5.918 1.00 0.00 C ATOM 1780 C LEU A 116 -11.094 8.907 -4.690 1.00 0.00 C ATOM 1781 O LEU A 116 -11.681 9.943 -4.447 1.00 0.00 O ATOM 1782 CB LEU A 116 -10.830 7.834 -6.948 1.00 0.00 C ATOM 1783 CG LEU A 116 -9.961 7.774 -8.205 1.00 0.00 C ATOM 1784 CD1 LEU A 116 -10.092 6.391 -8.850 1.00 0.00 C ATOM 1785 CD2 LEU A 116 -10.427 8.844 -9.195 1.00 0.00 C ATOM 0 H LEU A 116 -8.863 7.107 -5.749 1.00 0.00 H new ATOM 0 HA LEU A 116 -10.033 9.768 -6.324 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.943 6.836 -6.525 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -11.829 8.187 -7.202 1.00 0.00 H new ATOM 0 HG LEU A 116 -8.920 7.953 -7.938 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -9.473 6.347 -9.746 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -9.763 5.628 -8.144 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -11.133 6.212 -9.119 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.809 8.803 -10.092 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -11.468 8.663 -9.463 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -10.336 9.829 -8.736 1.00 0.00 H new ATOM 1797 N VAL A 117 -11.200 7.868 -3.907 1.00 0.00 N ATOM 1798 CA VAL A 117 -12.052 7.937 -2.686 1.00 0.00 C ATOM 1799 C VAL A 117 -11.532 9.036 -1.765 1.00 0.00 C ATOM 1800 O VAL A 117 -12.264 9.601 -0.976 1.00 0.00 O ATOM 1801 CB VAL A 117 -11.898 6.572 -2.017 1.00 0.00 C ATOM 1802 CG1 VAL A 117 -12.320 5.478 -2.993 1.00 0.00 C ATOM 1803 CG2 VAL A 117 -10.437 6.363 -1.615 1.00 0.00 C ATOM 0 H VAL A 117 -10.733 6.974 -4.060 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.094 8.162 -2.915 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.528 6.529 -1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -12.211 4.504 -2.517 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.361 5.627 -3.279 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.690 5.520 -3.882 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.327 5.389 -1.138 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.806 6.406 -2.503 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.136 7.145 -0.918 1.00 0.00 H new ATOM 1813 N GLN A 118 -10.268 9.337 -1.859 1.00 0.00 N ATOM 1814 CA GLN A 118 -9.689 10.394 -0.989 1.00 0.00 C ATOM 1815 C GLN A 118 -9.130 11.538 -1.841 1.00 0.00 C ATOM 1816 O GLN A 118 -8.084 12.082 -1.543 1.00 0.00 O ATOM 1817 CB GLN A 118 -8.557 9.702 -0.226 1.00 0.00 C ATOM 1818 CG GLN A 118 -9.129 8.603 0.673 1.00 0.00 C ATOM 1819 CD GLN A 118 -8.269 7.343 0.548 1.00 0.00 C ATOM 1820 OE1 GLN A 118 -8.762 6.240 0.678 1.00 0.00 O ATOM 1821 NE2 GLN A 118 -6.993 7.461 0.300 1.00 0.00 N ATOM 0 H GLN A 118 -9.611 8.895 -2.502 1.00 0.00 H new ATOM 0 HA GLN A 118 -10.433 10.827 -0.320 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -7.842 9.274 -0.929 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -8.014 10.431 0.376 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -9.150 8.940 1.709 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -10.158 8.384 0.388 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -6.578 8.386 0.191 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -6.411 6.628 0.215 1.00 0.00 H new ATOM 1830 N ILE A 119 -9.810 11.907 -2.897 1.00 0.00 N ATOM 1831 CA ILE A 119 -9.301 13.017 -3.755 1.00 0.00 C ATOM 1832 C ILE A 119 -8.735 14.140 -2.882 1.00 0.00 C ATOM 1833 O ILE A 119 -7.846 14.865 -3.283 1.00 0.00 O ATOM 1834 CB ILE A 119 -10.511 13.514 -4.549 1.00 0.00 C ATOM 1835 CG1 ILE A 119 -11.503 14.201 -3.601 1.00 0.00 C ATOM 1836 CG2 ILE A 119 -11.187 12.337 -5.259 1.00 0.00 C ATOM 1837 CD1 ILE A 119 -12.199 13.164 -2.714 1.00 0.00 C ATOM 0 H ILE A 119 -10.690 11.490 -3.200 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.499 12.686 -4.414 1.00 0.00 H new ATOM 0 HB ILE A 119 -10.180 14.233 -5.299 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -10.979 14.927 -2.980 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -12.245 14.752 -4.178 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -12.048 12.698 -5.822 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -10.478 11.867 -5.941 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -11.517 11.607 -4.520 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -12.899 13.667 -2.047 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -12.740 12.454 -3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -11.454 12.632 -2.123 1.00 0.00 H new ATOM 1849 N SER A 120 -9.240 14.286 -1.686 1.00 0.00 N ATOM 1850 CA SER A 120 -8.729 15.358 -0.785 1.00 0.00 C ATOM 1851 C SER A 120 -8.591 14.832 0.647 1.00 0.00 C ATOM 1852 O SER A 120 -7.500 14.676 1.159 1.00 0.00 O ATOM 1853 CB SER A 120 -9.783 16.460 -0.845 1.00 0.00 C ATOM 1854 OG SER A 120 -9.339 17.490 -1.718 1.00 0.00 O ATOM 0 H SER A 120 -9.984 13.709 -1.295 1.00 0.00 H new ATOM 0 HA SER A 120 -7.744 15.713 -1.089 1.00 0.00 H new ATOM 0 HB2 SER A 120 -10.731 16.053 -1.197 1.00 0.00 H new ATOM 0 HB3 SER A 120 -9.960 16.864 0.152 1.00 0.00 H new ATOM 0 HG SER A 120 -10.015 18.198 -1.759 1.00 0.00 H new ATOM 1860 N LYS A 121 -9.692 14.572 1.299 1.00 0.00 N ATOM 1861 CA LYS A 121 -9.635 14.068 2.705 1.00 0.00 C ATOM 1862 C LYS A 121 -8.924 15.093 3.589 1.00 0.00 C ATOM 1863 O LYS A 121 -8.105 14.757 4.420 1.00 0.00 O ATOM 1864 CB LYS A 121 -8.840 12.763 2.643 1.00 0.00 C ATOM 1865 CG LYS A 121 -8.746 12.164 4.046 1.00 0.00 C ATOM 1866 CD LYS A 121 -8.816 10.635 3.959 1.00 0.00 C ATOM 1867 CE LYS A 121 -7.420 10.046 4.183 1.00 0.00 C ATOM 1868 NZ LYS A 121 -6.662 10.380 2.946 1.00 0.00 N ATOM 0 H LYS A 121 -10.632 14.687 0.919 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.627 13.906 3.127 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -9.325 12.060 1.966 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -7.842 12.950 2.247 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -7.813 12.469 4.521 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -9.558 12.540 4.668 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -9.509 10.249 4.706 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -9.198 10.333 2.984 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -6.946 10.476 5.065 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -7.466 8.968 4.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -5.728 9.924 2.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -7.186 10.039 2.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.542 11.411 2.880 1.00 0.00 H new ATOM 1882 N GLU A 122 -9.243 16.345 3.403 1.00 0.00 N ATOM 1883 CA GLU A 122 -8.610 17.435 4.205 1.00 0.00 C ATOM 1884 C GLU A 122 -8.856 18.765 3.512 1.00 0.00 C ATOM 1885 O GLU A 122 -8.854 19.816 4.122 1.00 0.00 O ATOM 1886 CB GLU A 122 -7.111 17.120 4.243 1.00 0.00 C ATOM 1887 CG GLU A 122 -6.655 16.622 2.869 1.00 0.00 C ATOM 1888 CD GLU A 122 -5.276 17.201 2.545 1.00 0.00 C ATOM 1889 OE1 GLU A 122 -4.427 17.185 3.422 1.00 0.00 O ATOM 1890 OE2 GLU A 122 -5.092 17.649 1.426 1.00 0.00 O ATOM 0 H GLU A 122 -9.927 16.665 2.718 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.019 17.498 5.213 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -6.549 18.011 4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -6.907 16.364 5.001 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -6.614 15.533 2.861 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -7.374 16.920 2.106 1.00 0.00 H new ATOM 1897 N VAL A 123 -9.079 18.714 2.237 1.00 0.00 N ATOM 1898 CA VAL A 123 -9.343 19.951 1.470 1.00 0.00 C ATOM 1899 C VAL A 123 -8.111 20.861 1.462 1.00 0.00 C ATOM 1900 O VAL A 123 -7.129 20.501 2.090 1.00 0.00 O ATOM 1901 CB VAL A 123 -10.508 20.630 2.179 1.00 0.00 C ATOM 1902 CG1 VAL A 123 -11.116 21.693 1.259 1.00 0.00 C ATOM 1903 CG2 VAL A 123 -11.574 19.589 2.532 1.00 0.00 C ATOM 0 H VAL A 123 -9.090 17.856 1.686 1.00 0.00 H new ATOM 0 HA VAL A 123 -9.575 19.734 0.427 1.00 0.00 H new ATOM 0 HB VAL A 123 -10.149 21.102 3.093 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -11.950 22.179 1.766 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -10.358 22.437 1.012 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -11.473 21.221 0.344 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -12.406 20.078 3.039 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -11.934 19.113 1.620 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -11.142 18.834 3.189 1.00 0.00 H new TER 1913 VAL A 123 HETATM 1914 CA CA A 201 2.413 -9.000 -9.393 1.00 0.00 CA HETATM 1915 BE BEF A 202 -0.270 -7.889 -7.850 1.00 0.00 BE HETATM 1916 F1 BEF A 202 -0.524 -7.208 -9.145 1.00 0.00 F HETATM 1917 F2 BEF A 202 0.080 -8.949 -9.258 1.00 0.00 F HETATM 1918 F3 BEF A 202 1.048 -8.302 -7.752 1.00 0.00 F