USER MOD reduce.3.24.130724 H: found=0, std=0, add=937, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 939 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot -62:sc= 0.775 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.677 K(o=1.5,f=0.37) USER MOD Set 1.4: A 113 MET CE :methyl 150:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 94 THR OG1 : rot 26:sc= 0.0978 USER MOD Set 3.2: A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 81 THR OG1 : rot -97:sc= 1.28 USER MOD Set 4.2: A 93 THR OG1 : rot 100:sc= 1.03 USER MOD Set 5.1: A 61 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Set 5.2: A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 6.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 49 LYS NZ :NH3+ -173:sc= 0.017 (180deg=0) USER MOD Set 7.2: A 51 THR OG1 : rot -170:sc= 0.0171 USER MOD Set 7.3: A 60 GLN : amide:sc= 0 X(o=0.034,f=0.00016) USER MOD Single : A 4 SER OG : rot 180:sc=-0.00246 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -171:sc= 0.283 USER MOD Single : A 8 GLN : amide:sc= -0.67 X(o=-0.67,f=-0.21) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0675 X(o=-0.067,f=-0.03) USER MOD Single : A 14 ASN : amide:sc=-0.00965 K(o=-0.0096,f=-2.5!) USER MOD Single : A 19 MET CE :methyl -166:sc= 0 (180deg=-0.101) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 141:sc= 0 (180deg=-0.0588) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot -73:sc= 0.724 USER MOD Single : A 69 CYS SG : rot 56:sc= 0.97 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.0259 X(o=-0.026,f=-0.15) USER MOD Single : A 89 ASN : amide:sc= -0.0558 X(o=-0.056,f=-0.0095) USER MOD Single : A 90 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.198) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot -110:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N PHE A 3 9.544 -9.504 -1.632 1.00 0.00 N ATOM 13 CA PHE A 3 8.315 -8.786 -1.179 1.00 0.00 C ATOM 14 C PHE A 3 8.137 -8.529 0.354 1.00 0.00 C ATOM 15 O PHE A 3 7.316 -7.675 0.696 1.00 0.00 O ATOM 16 CB PHE A 3 7.053 -9.476 -1.766 1.00 0.00 C ATOM 17 CG PHE A 3 6.754 -9.189 -3.246 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.174 -7.970 -3.624 1.00 0.00 C ATOM 19 CD2 PHE A 3 7.014 -10.157 -4.224 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.869 -7.723 -4.960 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.697 -9.911 -5.557 1.00 0.00 C ATOM 22 CZ PHE A 3 6.120 -8.698 -5.920 1.00 0.00 C ATOM 0 HA PHE A 3 8.452 -7.779 -1.574 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.161 -10.553 -1.640 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.189 -9.171 -1.176 1.00 0.00 H new ATOM 0 HD1 PHE A 3 5.963 -7.220 -2.876 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.462 -11.098 -3.943 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.438 -6.776 -5.250 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.899 -10.660 -6.308 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.866 -8.512 -6.953 1.00 0.00 H new ATOM 32 N SER A 4 8.895 -9.177 1.267 1.00 0.00 N ATOM 33 CA SER A 4 8.938 -8.779 2.700 1.00 0.00 C ATOM 34 C SER A 4 9.755 -7.466 2.874 1.00 0.00 C ATOM 35 O SER A 4 10.958 -7.435 2.589 1.00 0.00 O ATOM 36 CB SER A 4 9.555 -9.898 3.570 1.00 0.00 C ATOM 37 OG SER A 4 8.722 -11.050 3.608 1.00 0.00 O ATOM 0 H SER A 4 9.486 -9.977 1.041 1.00 0.00 H new ATOM 0 HA SER A 4 7.913 -8.610 3.030 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.534 -10.169 3.175 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.711 -9.528 4.583 1.00 0.00 H new ATOM 0 HG SER A 4 9.142 -11.739 4.165 1.00 0.00 H new ATOM 43 N GLY A 5 9.087 -6.392 3.330 1.00 0.00 N ATOM 44 CA GLY A 5 9.753 -5.091 3.538 1.00 0.00 C ATOM 45 C GLY A 5 8.829 -3.977 4.068 1.00 0.00 C ATOM 46 O GLY A 5 7.608 -3.990 3.887 1.00 0.00 O ATOM 0 H GLY A 5 8.093 -6.397 3.561 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.576 -5.227 4.239 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.189 -4.765 2.594 1.00 0.00 H new ATOM 50 N LYS A 6 9.478 -2.971 4.675 1.00 0.00 N ATOM 51 CA LYS A 6 8.844 -1.666 5.009 1.00 0.00 C ATOM 52 C LYS A 6 9.251 -0.676 3.891 1.00 0.00 C ATOM 53 O LYS A 6 10.440 -0.396 3.703 1.00 0.00 O ATOM 54 CB LYS A 6 9.304 -1.149 6.397 1.00 0.00 C ATOM 55 CG LYS A 6 8.526 -1.677 7.621 1.00 0.00 C ATOM 56 CD LYS A 6 8.635 -3.188 7.913 1.00 0.00 C ATOM 57 CE LYS A 6 7.933 -3.589 9.224 1.00 0.00 C ATOM 58 NZ LYS A 6 7.993 -5.045 9.447 1.00 0.00 N ATOM 0 H LYS A 6 10.458 -3.030 4.952 1.00 0.00 H new ATOM 0 HA LYS A 6 7.761 -1.772 5.066 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.356 -1.405 6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.239 -0.061 6.395 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.869 -1.135 8.502 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.473 -1.432 7.486 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.198 -3.747 7.085 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.687 -3.469 7.967 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.402 -3.072 10.061 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.892 -3.267 9.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.511 -5.280 10.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.524 -5.536 8.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.987 -5.347 9.501 1.00 0.00 H new ATOM 72 N TYR A 7 8.261 -0.175 3.135 1.00 0.00 N ATOM 73 CA TYR A 7 8.525 0.583 1.882 1.00 0.00 C ATOM 74 C TYR A 7 8.197 2.076 2.148 1.00 0.00 C ATOM 75 O TYR A 7 7.030 2.479 2.171 1.00 0.00 O ATOM 76 CB TYR A 7 7.735 -0.005 0.678 1.00 0.00 C ATOM 77 CG TYR A 7 8.027 -1.478 0.313 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.029 -1.796 -0.608 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.275 -2.512 0.889 1.00 0.00 C ATOM 80 CE1 TYR A 7 9.261 -3.123 -0.964 1.00 0.00 C ATOM 81 CE2 TYR A 7 7.530 -3.839 0.551 1.00 0.00 C ATOM 82 CZ TYR A 7 8.521 -4.143 -0.373 1.00 0.00 C ATOM 83 OH TYR A 7 8.779 -5.446 -0.697 1.00 0.00 O ATOM 0 H TYR A 7 7.271 -0.276 3.361 1.00 0.00 H new ATOM 0 HA TYR A 7 9.575 0.495 1.602 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.670 0.089 0.891 1.00 0.00 H new ATOM 0 HB3 TYR A 7 7.941 0.610 -0.198 1.00 0.00 H new ATOM 0 HD1 TYR A 7 9.626 -1.010 -1.046 1.00 0.00 H new ATOM 0 HD2 TYR A 7 6.495 -2.278 1.598 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.016 -3.360 -1.699 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.957 -4.632 1.008 1.00 0.00 H new ATOM 0 HH TYR A 7 8.087 -6.022 -0.311 1.00 0.00 H new ATOM 93 N GLN A 8 9.257 2.878 2.360 1.00 0.00 N ATOM 94 CA GLN A 8 9.145 4.302 2.766 1.00 0.00 C ATOM 95 C GLN A 8 9.054 5.202 1.505 1.00 0.00 C ATOM 96 O GLN A 8 9.970 5.218 0.676 1.00 0.00 O ATOM 97 CB GLN A 8 10.378 4.632 3.656 1.00 0.00 C ATOM 98 CG GLN A 8 10.353 5.958 4.452 1.00 0.00 C ATOM 99 CD GLN A 8 10.488 7.243 3.615 1.00 0.00 C ATOM 100 OE1 GLN A 8 11.452 7.437 2.873 1.00 0.00 O ATOM 101 NE2 GLN A 8 9.514 8.134 3.704 1.00 0.00 N ATOM 0 H GLN A 8 10.221 2.561 2.256 1.00 0.00 H new ATOM 0 HA GLN A 8 8.239 4.489 3.342 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.507 3.816 4.367 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.261 4.641 3.017 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.418 6.007 5.011 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.161 5.936 5.183 1.00 0.00 H new ATOM 0 HE21 GLN A 8 8.721 7.962 4.322 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.556 8.992 3.155 1.00 0.00 H new ATOM 110 N LEU A 9 7.964 5.982 1.403 1.00 0.00 N ATOM 111 CA LEU A 9 7.649 6.812 0.209 1.00 0.00 C ATOM 112 C LEU A 9 8.713 7.906 -0.109 1.00 0.00 C ATOM 113 O LEU A 9 8.950 8.818 0.689 1.00 0.00 O ATOM 114 CB LEU A 9 6.239 7.428 0.425 1.00 0.00 C ATOM 115 CG LEU A 9 5.614 8.220 -0.758 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.285 7.327 -1.967 1.00 0.00 C ATOM 117 CD2 LEU A 9 4.356 8.966 -0.271 1.00 0.00 C ATOM 0 H LEU A 9 7.269 6.060 2.145 1.00 0.00 H new ATOM 0 HA LEU A 9 7.665 6.168 -0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.556 6.621 0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.291 8.094 1.286 1.00 0.00 H new ATOM 0 HG LEU A 9 6.358 8.938 -1.103 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.852 7.935 -2.761 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.198 6.854 -2.329 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.572 6.558 -1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.918 9.521 -1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.630 8.246 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.629 9.659 0.525 1.00 0.00 H new ATOM 129 N GLN A 10 9.306 7.800 -1.310 1.00 0.00 N ATOM 130 CA GLN A 10 10.234 8.822 -1.863 1.00 0.00 C ATOM 131 C GLN A 10 9.452 9.845 -2.744 1.00 0.00 C ATOM 132 O GLN A 10 9.360 11.017 -2.367 1.00 0.00 O ATOM 133 CB GLN A 10 11.418 8.178 -2.643 1.00 0.00 C ATOM 134 CG GLN A 10 12.309 7.182 -1.867 1.00 0.00 C ATOM 135 CD GLN A 10 13.597 6.844 -2.638 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.627 5.935 -3.467 1.00 0.00 O ATOM 137 NE2 GLN A 10 14.675 7.577 -2.398 1.00 0.00 N ATOM 0 H GLN A 10 9.160 7.005 -1.932 1.00 0.00 H new ATOM 0 HA GLN A 10 10.675 9.360 -1.024 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.010 7.662 -3.512 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.053 8.980 -3.018 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.567 7.606 -0.897 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.749 6.266 -1.676 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.638 8.328 -1.709 1.00 0.00 H new ATOM 0 HE22 GLN A 10 15.541 7.390 -2.903 1.00 0.00 H new ATOM 146 N SER A 11 8.911 9.400 -3.898 1.00 0.00 N ATOM 147 CA SER A 11 8.199 10.266 -4.876 1.00 0.00 C ATOM 148 C SER A 11 6.758 9.730 -5.095 1.00 0.00 C ATOM 149 O SER A 11 6.529 8.515 -5.102 1.00 0.00 O ATOM 150 CB SER A 11 8.976 10.285 -6.214 1.00 0.00 C ATOM 151 OG SER A 11 10.264 10.870 -6.057 1.00 0.00 O ATOM 0 H SER A 11 8.954 8.422 -4.184 1.00 0.00 H new ATOM 0 HA SER A 11 8.140 11.283 -4.489 1.00 0.00 H new ATOM 0 HB2 SER A 11 9.080 9.267 -6.591 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.409 10.844 -6.958 1.00 0.00 H new ATOM 0 HG SER A 11 10.732 10.867 -6.918 1.00 0.00 H new ATOM 157 N GLN A 12 5.789 10.647 -5.288 1.00 0.00 N ATOM 158 CA GLN A 12 4.357 10.278 -5.468 1.00 0.00 C ATOM 159 C GLN A 12 3.774 11.080 -6.663 1.00 0.00 C ATOM 160 O GLN A 12 3.466 12.273 -6.552 1.00 0.00 O ATOM 161 CB GLN A 12 3.597 10.494 -4.131 1.00 0.00 C ATOM 162 CG GLN A 12 2.220 9.797 -4.061 1.00 0.00 C ATOM 163 CD GLN A 12 1.587 9.839 -2.658 1.00 0.00 C ATOM 164 OE1 GLN A 12 1.560 10.872 -1.989 1.00 0.00 O ATOM 165 NE2 GLN A 12 1.061 8.723 -2.175 1.00 0.00 N ATOM 0 H GLN A 12 5.965 11.651 -5.324 1.00 0.00 H new ATOM 0 HA GLN A 12 4.244 9.223 -5.716 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.217 10.130 -3.312 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.458 11.564 -3.975 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.544 10.272 -4.772 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.330 8.758 -4.371 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.083 7.867 -2.729 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.634 8.720 -1.249 1.00 0.00 H new ATOM 174 N GLU A 13 3.624 10.387 -7.804 1.00 0.00 N ATOM 175 CA GLU A 13 3.069 10.956 -9.062 1.00 0.00 C ATOM 176 C GLU A 13 1.516 10.872 -9.054 1.00 0.00 C ATOM 177 O GLU A 13 0.942 9.842 -8.687 1.00 0.00 O ATOM 178 CB GLU A 13 3.671 10.144 -10.243 1.00 0.00 C ATOM 179 CG GLU A 13 3.375 10.689 -11.657 1.00 0.00 C ATOM 180 CD GLU A 13 3.840 9.741 -12.765 1.00 0.00 C ATOM 181 OE1 GLU A 13 3.081 8.813 -13.123 1.00 0.00 O ATOM 182 OE2 GLU A 13 4.965 9.917 -13.282 1.00 0.00 O ATOM 0 H GLU A 13 3.885 9.405 -7.889 1.00 0.00 H new ATOM 0 HA GLU A 13 3.331 12.009 -9.162 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.752 10.097 -10.112 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.298 9.122 -10.183 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.304 10.862 -11.758 1.00 0.00 H new ATOM 0 HG3 GLU A 13 3.867 11.654 -11.780 1.00 0.00 H new ATOM 189 N ASN A 14 0.851 11.957 -9.506 1.00 0.00 N ATOM 190 CA ASN A 14 -0.640 12.018 -9.667 1.00 0.00 C ATOM 191 C ASN A 14 -1.468 11.793 -8.354 1.00 0.00 C ATOM 192 O ASN A 14 -2.457 11.055 -8.346 1.00 0.00 O ATOM 193 CB ASN A 14 -1.100 11.144 -10.883 1.00 0.00 C ATOM 194 CG ASN A 14 -0.935 11.788 -12.272 1.00 0.00 C ATOM 195 OD1 ASN A 14 0.144 11.771 -12.863 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.996 12.352 -12.830 1.00 0.00 N ATOM 0 H ASN A 14 1.322 12.822 -9.773 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.880 13.055 -9.902 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.539 10.210 -10.868 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.150 10.887 -10.745 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.921 12.775 -13.755 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.888 12.363 -12.335 1.00 0.00 H new ATOM 203 N PHE A 15 -1.082 12.467 -7.251 1.00 0.00 N ATOM 204 CA PHE A 15 -1.724 12.287 -5.919 1.00 0.00 C ATOM 205 C PHE A 15 -3.110 12.986 -5.776 1.00 0.00 C ATOM 206 O PHE A 15 -4.061 12.323 -5.353 1.00 0.00 O ATOM 207 CB PHE A 15 -0.704 12.673 -4.807 1.00 0.00 C ATOM 208 CG PHE A 15 -1.083 12.371 -3.338 1.00 0.00 C ATOM 209 CD1 PHE A 15 -1.692 11.162 -2.973 1.00 0.00 C ATOM 210 CD2 PHE A 15 -0.747 13.289 -2.335 1.00 0.00 C ATOM 211 CE1 PHE A 15 -1.984 10.893 -1.639 1.00 0.00 C ATOM 212 CE2 PHE A 15 -1.028 13.006 -0.999 1.00 0.00 C ATOM 213 CZ PHE A 15 -1.653 11.813 -0.655 1.00 0.00 C ATOM 0 H PHE A 15 -0.323 13.148 -7.251 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.978 11.233 -5.805 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.234 12.161 -5.022 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -0.510 13.742 -4.889 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -1.936 10.434 -3.733 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -0.268 14.221 -2.598 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.469 9.966 -1.370 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.760 13.715 -0.230 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.881 11.602 0.379 1.00 0.00 H new ATOM 223 N GLU A 16 -3.241 14.281 -6.139 1.00 0.00 N ATOM 224 CA GLU A 16 -4.563 14.974 -6.206 1.00 0.00 C ATOM 225 C GLU A 16 -5.544 14.411 -7.279 1.00 0.00 C ATOM 226 O GLU A 16 -6.722 14.219 -6.962 1.00 0.00 O ATOM 227 CB GLU A 16 -4.392 16.510 -6.377 1.00 0.00 C ATOM 228 CG GLU A 16 -3.815 17.250 -5.151 1.00 0.00 C ATOM 229 CD GLU A 16 -3.786 18.769 -5.331 1.00 0.00 C ATOM 230 OE1 GLU A 16 -2.779 19.301 -5.849 1.00 0.00 O ATOM 231 OE2 GLU A 16 -4.772 19.441 -4.950 1.00 0.00 O ATOM 0 H GLU A 16 -2.451 14.875 -6.392 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.030 14.766 -5.243 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.740 16.694 -7.231 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.363 16.943 -6.618 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.411 17.005 -4.272 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.803 16.893 -4.960 1.00 0.00 H new ATOM 238 N ALA A 17 -5.074 14.124 -8.512 1.00 0.00 N ATOM 239 CA ALA A 17 -5.891 13.461 -9.563 1.00 0.00 C ATOM 240 C ALA A 17 -6.462 12.053 -9.209 1.00 0.00 C ATOM 241 O ALA A 17 -7.649 11.823 -9.447 1.00 0.00 O ATOM 242 CB ALA A 17 -5.052 13.404 -10.855 1.00 0.00 C ATOM 0 H ALA A 17 -4.123 14.342 -8.810 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.788 14.069 -9.681 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.630 12.921 -11.643 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.791 14.416 -11.164 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.141 12.834 -10.672 1.00 0.00 H new ATOM 248 N PHE A 18 -5.647 11.135 -8.643 1.00 0.00 N ATOM 249 CA PHE A 18 -6.097 9.760 -8.285 1.00 0.00 C ATOM 250 C PHE A 18 -7.051 9.728 -7.054 1.00 0.00 C ATOM 251 O PHE A 18 -8.148 9.181 -7.180 1.00 0.00 O ATOM 252 CB PHE A 18 -4.860 8.824 -8.141 1.00 0.00 C ATOM 253 CG PHE A 18 -5.178 7.328 -7.926 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.419 6.483 -9.014 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.247 6.809 -6.628 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.739 5.141 -8.804 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.569 5.471 -6.420 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.819 4.640 -7.508 1.00 0.00 C ATOM 0 H PHE A 18 -4.668 11.318 -8.421 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.711 9.378 -9.101 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.246 8.922 -9.037 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.258 9.173 -7.302 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.357 6.870 -10.020 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.049 7.451 -5.782 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.924 4.492 -9.647 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.625 5.078 -5.416 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.076 3.604 -7.346 1.00 0.00 H new ATOM 268 N MET A 19 -6.639 10.284 -5.895 1.00 0.00 N ATOM 269 CA MET A 19 -7.438 10.266 -4.640 1.00 0.00 C ATOM 270 C MET A 19 -8.822 10.977 -4.721 1.00 0.00 C ATOM 271 O MET A 19 -9.813 10.376 -4.301 1.00 0.00 O ATOM 272 CB MET A 19 -6.579 10.809 -3.470 1.00 0.00 C ATOM 273 CG MET A 19 -5.578 9.813 -2.866 1.00 0.00 C ATOM 274 SD MET A 19 -4.329 9.293 -4.058 1.00 0.00 S ATOM 275 CE MET A 19 -3.605 7.897 -3.173 1.00 0.00 C ATOM 0 H MET A 19 -5.742 10.760 -5.798 1.00 0.00 H new ATOM 0 HA MET A 19 -7.697 9.222 -4.461 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.029 11.682 -3.821 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.247 11.150 -2.679 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.089 10.269 -2.006 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.115 8.938 -2.500 1.00 0.00 H new ATOM 0 HE1 MET A 19 -2.664 7.615 -3.646 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.420 8.180 -2.137 1.00 0.00 H new ATOM 0 HE3 MET A 19 -4.293 7.052 -3.201 1.00 0.00 H new ATOM 285 N LYS A 20 -8.909 12.198 -5.291 1.00 0.00 N ATOM 286 CA LYS A 20 -10.214 12.861 -5.590 1.00 0.00 C ATOM 287 C LYS A 20 -11.150 12.078 -6.571 1.00 0.00 C ATOM 288 O LYS A 20 -12.358 12.029 -6.323 1.00 0.00 O ATOM 289 CB LYS A 20 -10.003 14.317 -6.096 1.00 0.00 C ATOM 290 CG LYS A 20 -9.351 15.285 -5.079 1.00 0.00 C ATOM 291 CD LYS A 20 -9.266 16.756 -5.542 1.00 0.00 C ATOM 292 CE LYS A 20 -10.583 17.560 -5.486 1.00 0.00 C ATOM 293 NZ LYS A 20 -10.980 17.925 -4.112 1.00 0.00 N ATOM 0 H LYS A 20 -8.095 12.752 -5.557 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.737 12.871 -4.634 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.383 14.286 -6.992 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.970 14.725 -6.392 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -9.916 15.245 -4.148 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.344 14.931 -4.857 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.525 17.267 -4.928 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.896 16.773 -6.567 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.473 18.468 -6.079 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -11.379 16.974 -5.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -11.870 18.462 -4.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.114 17.061 -3.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.236 18.509 -3.679 1.00 0.00 H new ATOM 307 N ALA A 21 -10.606 11.457 -7.642 1.00 0.00 N ATOM 308 CA ALA A 21 -11.391 10.588 -8.561 1.00 0.00 C ATOM 309 C ALA A 21 -11.900 9.221 -7.998 1.00 0.00 C ATOM 310 O ALA A 21 -12.944 8.758 -8.467 1.00 0.00 O ATOM 311 CB ALA A 21 -10.565 10.376 -9.840 1.00 0.00 C ATOM 0 H ALA A 21 -9.622 11.540 -7.896 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.321 11.127 -8.744 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.120 9.741 -10.531 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.369 11.340 -10.311 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.619 9.897 -9.587 1.00 0.00 H new ATOM 317 N ILE A 22 -11.212 8.586 -7.020 1.00 0.00 N ATOM 318 CA ILE A 22 -11.721 7.358 -6.328 1.00 0.00 C ATOM 319 C ILE A 22 -12.751 7.684 -5.194 1.00 0.00 C ATOM 320 O ILE A 22 -13.814 7.057 -5.164 1.00 0.00 O ATOM 321 CB ILE A 22 -10.591 6.350 -5.901 1.00 0.00 C ATOM 322 CG1 ILE A 22 -9.545 6.877 -4.876 1.00 0.00 C ATOM 323 CG2 ILE A 22 -9.882 5.749 -7.141 1.00 0.00 C ATOM 324 CD1 ILE A 22 -8.771 5.793 -4.106 1.00 0.00 C ATOM 0 H ILE A 22 -10.300 8.898 -6.685 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.287 6.811 -7.082 1.00 0.00 H new ATOM 0 HB ILE A 22 -11.131 5.574 -5.359 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.828 7.505 -5.405 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.057 7.515 -4.156 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.106 5.056 -6.816 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.610 5.217 -7.754 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.431 6.550 -7.726 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.069 6.266 -3.419 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.471 5.177 -3.542 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.223 5.167 -4.811 1.00 0.00 H new ATOM 336 N GLY A 23 -12.455 8.644 -4.295 1.00 0.00 N ATOM 337 CA GLY A 23 -13.411 9.133 -3.276 1.00 0.00 C ATOM 338 C GLY A 23 -12.738 9.469 -1.933 1.00 0.00 C ATOM 339 O GLY A 23 -13.021 8.805 -0.933 1.00 0.00 O ATOM 0 H GLY A 23 -11.546 9.104 -4.253 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.916 10.021 -3.656 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.178 8.376 -3.112 1.00 0.00 H new ATOM 343 N LEU A 24 -11.881 10.510 -1.914 1.00 0.00 N ATOM 344 CA LEU A 24 -11.173 10.968 -0.692 1.00 0.00 C ATOM 345 C LEU A 24 -11.312 12.515 -0.484 1.00 0.00 C ATOM 346 O LEU A 24 -11.473 13.249 -1.468 1.00 0.00 O ATOM 347 CB LEU A 24 -9.672 10.561 -0.767 1.00 0.00 C ATOM 348 CG LEU A 24 -9.340 9.167 -0.165 1.00 0.00 C ATOM 349 CD1 LEU A 24 -9.274 8.070 -1.243 1.00 0.00 C ATOM 350 CD2 LEU A 24 -8.053 9.196 0.680 1.00 0.00 C ATOM 0 H LEU A 24 -11.657 11.060 -2.744 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.636 10.483 0.167 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.359 10.573 -1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.080 11.315 -0.248 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.164 8.915 0.503 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.039 7.114 -0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.236 8.000 -1.750 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -8.499 8.319 -1.968 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.859 8.201 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.215 9.506 0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.173 9.902 1.502 1.00 0.00 H new ATOM 362 N PRO A 25 -11.201 13.061 0.768 1.00 0.00 N ATOM 363 CA PRO A 25 -11.234 14.524 1.020 1.00 0.00 C ATOM 364 C PRO A 25 -9.898 15.241 0.671 1.00 0.00 C ATOM 365 O PRO A 25 -8.816 14.651 0.746 1.00 0.00 O ATOM 366 CB PRO A 25 -11.524 14.573 2.534 1.00 0.00 C ATOM 367 CG PRO A 25 -10.912 13.303 3.125 1.00 0.00 C ATOM 368 CD PRO A 25 -10.954 12.272 1.997 1.00 0.00 C ATOM 0 HA PRO A 25 -11.965 15.044 0.400 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.086 15.463 2.986 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.597 14.614 2.724 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -9.890 13.478 3.460 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.477 12.961 3.992 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.016 11.721 1.931 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.744 11.539 2.161 1.00 0.00 H new ATOM 376 N GLU A 26 -9.990 16.552 0.389 1.00 0.00 N ATOM 377 CA GLU A 26 -8.795 17.447 0.343 1.00 0.00 C ATOM 378 C GLU A 26 -8.020 17.618 1.700 1.00 0.00 C ATOM 379 O GLU A 26 -6.819 17.888 1.661 1.00 0.00 O ATOM 380 CB GLU A 26 -9.216 18.800 -0.294 1.00 0.00 C ATOM 381 CG GLU A 26 -8.043 19.691 -0.758 1.00 0.00 C ATOM 382 CD GLU A 26 -8.498 20.955 -1.490 1.00 0.00 C ATOM 383 OE1 GLU A 26 -8.700 20.900 -2.725 1.00 0.00 O ATOM 384 OE2 GLU A 26 -8.654 22.011 -0.837 1.00 0.00 O ATOM 0 H GLU A 26 -10.871 17.025 0.188 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.049 16.956 -0.282 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.860 18.598 -1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.812 19.356 0.430 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.447 19.976 0.109 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.394 19.112 -1.415 1.00 0.00 H new ATOM 391 N GLU A 27 -8.660 17.412 2.875 1.00 0.00 N ATOM 392 CA GLU A 27 -7.965 17.298 4.188 1.00 0.00 C ATOM 393 C GLU A 27 -6.930 16.128 4.268 1.00 0.00 C ATOM 394 O GLU A 27 -5.776 16.402 4.604 1.00 0.00 O ATOM 395 CB GLU A 27 -9.038 17.237 5.312 1.00 0.00 C ATOM 396 CG GLU A 27 -8.484 17.383 6.747 1.00 0.00 C ATOM 397 CD GLU A 27 -9.578 17.324 7.815 1.00 0.00 C ATOM 398 OE1 GLU A 27 -10.187 18.375 8.118 1.00 0.00 O ATOM 399 OE2 GLU A 27 -9.835 16.227 8.359 1.00 0.00 O ATOM 0 H GLU A 27 -9.673 17.319 2.944 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.347 18.186 4.322 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.770 18.025 5.139 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.568 16.288 5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.758 16.592 6.933 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.951 18.330 6.831 1.00 0.00 H new ATOM 406 N LEU A 28 -7.303 14.866 3.954 1.00 0.00 N ATOM 407 CA LEU A 28 -6.333 13.723 3.926 1.00 0.00 C ATOM 408 C LEU A 28 -5.267 13.722 2.782 1.00 0.00 C ATOM 409 O LEU A 28 -4.204 13.125 2.968 1.00 0.00 O ATOM 410 CB LEU A 28 -7.081 12.356 3.947 1.00 0.00 C ATOM 411 CG LEU A 28 -7.874 11.988 5.235 1.00 0.00 C ATOM 412 CD1 LEU A 28 -8.698 10.703 5.015 1.00 0.00 C ATOM 413 CD2 LEU A 28 -6.968 11.813 6.473 1.00 0.00 C ATOM 0 H LEU A 28 -8.260 14.604 3.716 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.753 13.873 4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.777 12.341 3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.348 11.569 3.767 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.539 12.828 5.434 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.246 10.461 5.926 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.403 10.858 4.198 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.029 9.880 4.765 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.580 11.557 7.338 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.249 11.015 6.288 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.435 12.743 6.668 1.00 0.00 H new ATOM 425 N ILE A 29 -5.521 14.374 1.633 1.00 0.00 N ATOM 426 CA ILE A 29 -4.525 14.548 0.534 1.00 0.00 C ATOM 427 C ILE A 29 -3.473 15.644 0.916 1.00 0.00 C ATOM 428 O ILE A 29 -2.271 15.375 0.867 1.00 0.00 O ATOM 429 CB ILE A 29 -5.250 14.812 -0.838 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.306 13.726 -1.213 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.239 14.953 -2.007 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.314 14.134 -2.298 1.00 0.00 C ATOM 0 H ILE A 29 -6.425 14.801 1.429 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.963 13.623 0.401 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.780 15.753 -0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -5.780 12.832 -1.548 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.857 13.453 -0.313 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.780 15.134 -2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.568 15.789 -1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.658 14.035 -2.099 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.002 13.309 -2.484 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.875 15.007 -1.964 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.781 14.376 -3.218 1.00 0.00 H new ATOM 444 N GLN A 30 -3.918 16.861 1.291 1.00 0.00 N ATOM 445 CA GLN A 30 -3.015 17.978 1.694 1.00 0.00 C ATOM 446 C GLN A 30 -2.299 17.832 3.078 1.00 0.00 C ATOM 447 O GLN A 30 -1.247 18.451 3.265 1.00 0.00 O ATOM 448 CB GLN A 30 -3.782 19.332 1.628 1.00 0.00 C ATOM 449 CG GLN A 30 -4.372 19.757 0.260 1.00 0.00 C ATOM 450 CD GLN A 30 -3.343 20.035 -0.848 1.00 0.00 C ATOM 451 OE1 GLN A 30 -2.760 21.116 -0.922 1.00 0.00 O ATOM 452 NE2 GLN A 30 -3.104 19.077 -1.732 1.00 0.00 N ATOM 0 H GLN A 30 -4.908 17.104 1.326 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.202 17.943 0.968 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.599 19.290 2.348 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -3.104 20.118 1.960 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -5.047 18.973 -0.084 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -4.973 20.654 0.406 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -3.593 18.185 -1.662 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -2.431 19.232 -2.483 1.00 0.00 H new ATOM 461 N LYS A 31 -2.826 17.026 4.022 1.00 0.00 N ATOM 462 CA LYS A 31 -2.086 16.611 5.247 1.00 0.00 C ATOM 463 C LYS A 31 -1.171 15.366 5.007 1.00 0.00 C ATOM 464 O LYS A 31 -0.013 15.386 5.431 1.00 0.00 O ATOM 465 CB LYS A 31 -3.093 16.420 6.414 1.00 0.00 C ATOM 466 CG LYS A 31 -2.513 16.205 7.833 1.00 0.00 C ATOM 467 CD LYS A 31 -1.808 17.418 8.495 1.00 0.00 C ATOM 468 CE LYS A 31 -0.290 17.584 8.250 1.00 0.00 C ATOM 469 NZ LYS A 31 0.523 16.524 8.875 1.00 0.00 N ATOM 0 H LYS A 31 -3.770 16.643 3.964 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.393 17.405 5.525 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.741 17.296 6.445 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.725 15.564 6.176 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.325 15.887 8.487 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.800 15.382 7.787 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.305 18.325 8.151 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -1.970 17.355 9.571 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.101 17.591 7.176 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.029 18.552 8.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.302 16.262 8.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.914 16.871 9.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.072 15.690 9.055 1.00 0.00 H new ATOM 483 N GLY A 32 -1.673 14.312 4.326 1.00 0.00 N ATOM 484 CA GLY A 32 -0.864 13.135 3.921 1.00 0.00 C ATOM 485 C GLY A 32 0.356 13.322 2.978 1.00 0.00 C ATOM 486 O GLY A 32 1.228 12.448 2.984 1.00 0.00 O ATOM 0 H GLY A 32 -2.650 14.251 4.040 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.500 12.662 4.833 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.539 12.426 3.442 1.00 0.00 H new ATOM 490 N LYS A 33 0.454 14.427 2.206 1.00 0.00 N ATOM 491 CA LYS A 33 1.699 14.797 1.468 1.00 0.00 C ATOM 492 C LYS A 33 2.925 15.140 2.380 1.00 0.00 C ATOM 493 O LYS A 33 4.028 14.652 2.120 1.00 0.00 O ATOM 494 CB LYS A 33 1.390 15.880 0.397 1.00 0.00 C ATOM 495 CG LYS A 33 1.056 17.302 0.897 1.00 0.00 C ATOM 496 CD LYS A 33 0.576 18.231 -0.231 1.00 0.00 C ATOM 497 CE LYS A 33 0.348 19.694 0.193 1.00 0.00 C ATOM 498 NZ LYS A 33 1.591 20.428 0.493 1.00 0.00 N ATOM 0 H LYS A 33 -0.313 15.085 2.073 1.00 0.00 H new ATOM 0 HA LYS A 33 2.034 13.900 0.948 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.251 15.951 -0.268 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.551 15.529 -0.204 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.285 17.241 1.665 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.939 17.734 1.367 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.310 18.211 -1.037 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.355 17.836 -0.637 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.187 20.214 -0.602 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.294 19.711 1.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 1.360 21.403 0.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 2.093 19.956 1.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.198 20.443 -0.352 1.00 0.00 H new ATOM 512 N ASP A 34 2.716 15.922 3.463 1.00 0.00 N ATOM 513 CA ASP A 34 3.709 16.105 4.560 1.00 0.00 C ATOM 514 C ASP A 34 4.059 14.805 5.363 1.00 0.00 C ATOM 515 O ASP A 34 5.230 14.620 5.709 1.00 0.00 O ATOM 516 CB ASP A 34 3.182 17.246 5.477 1.00 0.00 C ATOM 517 CG ASP A 34 4.179 17.756 6.528 1.00 0.00 C ATOM 518 OD1 ASP A 34 5.071 18.561 6.176 1.00 0.00 O ATOM 519 OD2 ASP A 34 4.077 17.348 7.706 1.00 0.00 O ATOM 0 H ASP A 34 1.854 16.448 3.607 1.00 0.00 H new ATOM 0 HA ASP A 34 4.666 16.373 4.112 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.880 18.084 4.849 1.00 0.00 H new ATOM 0 HB3 ASP A 34 2.287 16.894 5.990 1.00 0.00 H new ATOM 524 N ILE A 35 3.075 13.922 5.648 1.00 0.00 N ATOM 525 CA ILE A 35 3.289 12.649 6.396 1.00 0.00 C ATOM 526 C ILE A 35 4.036 11.639 5.464 1.00 0.00 C ATOM 527 O ILE A 35 3.606 11.365 4.338 1.00 0.00 O ATOM 528 CB ILE A 35 1.928 12.083 6.950 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.221 13.064 7.938 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.079 10.696 7.634 1.00 0.00 C ATOM 531 CD1 ILE A 35 -0.264 12.778 8.217 1.00 0.00 C ATOM 0 H ILE A 35 2.105 14.067 5.368 1.00 0.00 H new ATOM 0 HA ILE A 35 3.912 12.828 7.272 1.00 0.00 H new ATOM 0 HB ILE A 35 1.303 11.966 6.064 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.759 13.046 8.886 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.308 14.075 7.541 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.107 10.360 7.995 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.468 9.976 6.914 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.769 10.778 8.474 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.652 13.520 8.915 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.826 12.828 7.284 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.368 11.783 8.650 1.00 0.00 H new ATOM 543 N LYS A 36 5.137 11.071 5.986 1.00 0.00 N ATOM 544 CA LYS A 36 5.945 10.047 5.274 1.00 0.00 C ATOM 545 C LYS A 36 5.231 8.665 5.324 1.00 0.00 C ATOM 546 O LYS A 36 5.086 8.064 6.394 1.00 0.00 O ATOM 547 CB LYS A 36 7.359 9.986 5.913 1.00 0.00 C ATOM 548 CG LYS A 36 8.290 11.151 5.496 1.00 0.00 C ATOM 549 CD LYS A 36 9.695 11.117 6.130 1.00 0.00 C ATOM 550 CE LYS A 36 9.717 11.524 7.616 1.00 0.00 C ATOM 551 NZ LYS A 36 11.087 11.523 8.156 1.00 0.00 N ATOM 0 H LYS A 36 5.497 11.304 6.911 1.00 0.00 H new ATOM 0 HA LYS A 36 6.050 10.318 4.223 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.256 9.987 6.998 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.830 9.042 5.639 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.396 11.142 4.411 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.810 12.093 5.761 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.103 10.111 6.032 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.352 11.783 5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.281 12.517 7.729 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.097 10.836 8.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.065 11.801 9.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.493 10.569 8.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.671 12.197 7.622 1.00 0.00 H new ATOM 565 N GLY A 37 4.765 8.203 4.151 1.00 0.00 N ATOM 566 CA GLY A 37 3.889 7.017 4.055 1.00 0.00 C ATOM 567 C GLY A 37 4.658 5.694 3.948 1.00 0.00 C ATOM 568 O GLY A 37 5.194 5.365 2.887 1.00 0.00 O ATOM 0 H GLY A 37 4.980 8.633 3.252 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.242 6.982 4.931 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.242 7.123 3.184 1.00 0.00 H new ATOM 572 N VAL A 38 4.665 4.931 5.051 1.00 0.00 N ATOM 573 CA VAL A 38 5.264 3.567 5.083 1.00 0.00 C ATOM 574 C VAL A 38 4.092 2.578 4.811 1.00 0.00 C ATOM 575 O VAL A 38 3.186 2.416 5.638 1.00 0.00 O ATOM 576 CB VAL A 38 6.041 3.258 6.404 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.713 1.863 6.382 1.00 0.00 C ATOM 578 CG2 VAL A 38 7.140 4.295 6.746 1.00 0.00 C ATOM 0 H VAL A 38 4.264 5.227 5.941 1.00 0.00 H new ATOM 0 HA VAL A 38 6.037 3.470 4.320 1.00 0.00 H new ATOM 0 HB VAL A 38 5.266 3.299 7.169 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.239 1.698 7.322 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.951 1.094 6.253 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.422 1.814 5.556 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.633 4.010 7.676 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.874 4.326 5.941 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.687 5.280 6.862 1.00 0.00 H new ATOM 588 N SER A 39 4.144 1.932 3.638 1.00 0.00 N ATOM 589 CA SER A 39 3.143 0.920 3.221 1.00 0.00 C ATOM 590 C SER A 39 3.886 -0.423 3.061 1.00 0.00 C ATOM 591 O SER A 39 4.682 -0.617 2.137 1.00 0.00 O ATOM 592 CB SER A 39 2.440 1.322 1.913 1.00 0.00 C ATOM 593 OG SER A 39 1.678 2.514 2.078 1.00 0.00 O ATOM 0 H SER A 39 4.877 2.091 2.947 1.00 0.00 H new ATOM 0 HA SER A 39 2.360 0.838 3.975 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.183 1.469 1.129 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.787 0.513 1.586 1.00 0.00 H new ATOM 0 HG SER A 39 1.245 2.745 1.230 1.00 0.00 H new ATOM 599 N GLU A 40 3.612 -1.339 3.993 1.00 0.00 N ATOM 600 CA GLU A 40 4.313 -2.636 4.104 1.00 0.00 C ATOM 601 C GLU A 40 3.724 -3.700 3.137 1.00 0.00 C ATOM 602 O GLU A 40 2.578 -3.611 2.688 1.00 0.00 O ATOM 603 CB GLU A 40 4.195 -3.130 5.572 1.00 0.00 C ATOM 604 CG GLU A 40 4.930 -2.308 6.649 1.00 0.00 C ATOM 605 CD GLU A 40 4.058 -1.328 7.442 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.810 -0.203 6.956 1.00 0.00 O ATOM 607 OE2 GLU A 40 3.623 -1.679 8.561 1.00 0.00 O ATOM 0 H GLU A 40 2.891 -1.207 4.703 1.00 0.00 H new ATOM 0 HA GLU A 40 5.357 -2.495 3.826 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.138 -3.163 5.834 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.566 -4.154 5.616 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.400 -2.998 7.350 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.732 -1.747 6.169 1.00 0.00 H new ATOM 614 N ILE A 41 4.534 -4.733 2.865 1.00 0.00 N ATOM 615 CA ILE A 41 4.046 -6.038 2.337 1.00 0.00 C ATOM 616 C ILE A 41 4.823 -7.104 3.174 1.00 0.00 C ATOM 617 O ILE A 41 6.051 -7.039 3.301 1.00 0.00 O ATOM 618 CB ILE A 41 4.237 -6.225 0.787 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.546 -5.114 -0.066 1.00 0.00 C ATOM 620 CG2 ILE A 41 3.751 -7.623 0.317 1.00 0.00 C ATOM 621 CD1 ILE A 41 3.810 -5.155 -1.580 1.00 0.00 C ATOM 0 H ILE A 41 5.544 -4.699 3.000 1.00 0.00 H new ATOM 0 HA ILE A 41 2.965 -6.123 2.446 1.00 0.00 H new ATOM 0 HB ILE A 41 5.311 -6.139 0.620 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.470 -5.178 0.096 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.868 -4.143 0.311 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.898 -7.717 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.321 -8.398 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.692 -7.737 0.550 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.278 -4.336 -2.064 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.879 -5.054 -1.766 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.460 -6.105 -1.985 1.00 0.00 H new ATOM 633 N VAL A 42 4.094 -8.099 3.709 1.00 0.00 N ATOM 634 CA VAL A 42 4.683 -9.206 4.515 1.00 0.00 C ATOM 635 C VAL A 42 4.439 -10.503 3.685 1.00 0.00 C ATOM 636 O VAL A 42 3.332 -11.052 3.683 1.00 0.00 O ATOM 637 CB VAL A 42 4.086 -9.245 5.966 1.00 0.00 C ATOM 638 CG1 VAL A 42 4.664 -10.398 6.819 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.284 -7.926 6.757 1.00 0.00 C ATOM 0 H VAL A 42 3.082 -8.167 3.601 1.00 0.00 H new ATOM 0 HA VAL A 42 5.752 -9.075 4.685 1.00 0.00 H new ATOM 0 HB VAL A 42 3.020 -9.402 5.800 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.215 -10.376 7.812 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.441 -11.352 6.341 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.744 -10.280 6.906 1.00 0.00 H new ATOM 0 HG21 VAL A 42 3.846 -8.028 7.750 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.349 -7.714 6.850 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.796 -7.108 6.228 1.00 0.00 H new ATOM 649 N GLN A 43 5.494 -10.992 3.004 1.00 0.00 N ATOM 650 CA GLN A 43 5.433 -12.236 2.192 1.00 0.00 C ATOM 651 C GLN A 43 5.534 -13.492 3.103 1.00 0.00 C ATOM 652 O GLN A 43 6.534 -13.701 3.797 1.00 0.00 O ATOM 653 CB GLN A 43 6.555 -12.201 1.116 1.00 0.00 C ATOM 654 CG GLN A 43 6.608 -13.421 0.158 1.00 0.00 C ATOM 655 CD GLN A 43 7.659 -13.305 -0.962 1.00 0.00 C ATOM 656 OE1 GLN A 43 8.751 -12.765 -0.785 1.00 0.00 O ATOM 657 NE2 GLN A 43 7.363 -13.833 -2.140 1.00 0.00 N ATOM 0 H GLN A 43 6.410 -10.543 2.997 1.00 0.00 H new ATOM 0 HA GLN A 43 4.472 -12.296 1.681 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.431 -11.298 0.518 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.516 -12.118 1.623 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.815 -14.318 0.742 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.626 -13.555 -0.295 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.458 -14.280 -2.286 1.00 0.00 H new ATOM 0 HE22 GLN A 43 8.040 -13.792 -2.902 1.00 0.00 H new ATOM 666 N ASN A 44 4.492 -14.335 3.032 1.00 0.00 N ATOM 667 CA ASN A 44 4.519 -15.718 3.582 1.00 0.00 C ATOM 668 C ASN A 44 4.078 -16.683 2.439 1.00 0.00 C ATOM 669 O ASN A 44 2.953 -17.196 2.435 1.00 0.00 O ATOM 670 CB ASN A 44 3.623 -15.828 4.853 1.00 0.00 C ATOM 671 CG ASN A 44 4.073 -14.997 6.074 1.00 0.00 C ATOM 672 OD1 ASN A 44 5.182 -15.153 6.585 1.00 0.00 O ATOM 673 ND2 ASN A 44 3.227 -14.103 6.563 1.00 0.00 N ATOM 0 H ASN A 44 3.605 -14.087 2.595 1.00 0.00 H new ATOM 0 HA ASN A 44 5.521 -15.992 3.911 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.610 -15.526 4.586 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.575 -16.876 5.150 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.492 -13.537 7.369 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.310 -13.980 6.133 1.00 0.00 H new ATOM 680 N GLY A 45 4.970 -16.899 1.445 1.00 0.00 N ATOM 681 CA GLY A 45 4.659 -17.695 0.234 1.00 0.00 C ATOM 682 C GLY A 45 3.644 -17.012 -0.712 1.00 0.00 C ATOM 683 O GLY A 45 3.881 -15.901 -1.197 1.00 0.00 O ATOM 0 H GLY A 45 5.920 -16.529 1.459 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.582 -17.884 -0.313 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.264 -18.664 0.538 1.00 0.00 H new ATOM 687 N LYS A 46 2.501 -17.686 -0.920 1.00 0.00 N ATOM 688 CA LYS A 46 1.314 -17.096 -1.606 1.00 0.00 C ATOM 689 C LYS A 46 0.516 -16.011 -0.813 1.00 0.00 C ATOM 690 O LYS A 46 -0.073 -15.136 -1.454 1.00 0.00 O ATOM 691 CB LYS A 46 0.378 -18.158 -2.239 1.00 0.00 C ATOM 692 CG LYS A 46 0.084 -19.462 -1.478 1.00 0.00 C ATOM 693 CD LYS A 46 -0.543 -19.335 -0.071 1.00 0.00 C ATOM 694 CE LYS A 46 -1.018 -20.667 0.541 1.00 0.00 C ATOM 695 NZ LYS A 46 -2.279 -21.154 -0.050 1.00 0.00 N ATOM 0 H LYS A 46 2.363 -18.652 -0.623 1.00 0.00 H new ATOM 0 HA LYS A 46 1.777 -16.535 -2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.578 -17.673 -2.437 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.802 -18.433 -3.205 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.583 -20.068 -2.091 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.018 -20.015 -1.382 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.188 -18.882 0.599 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -1.391 -18.652 -0.125 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.243 -21.421 0.403 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.152 -20.540 1.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.549 -22.052 0.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.029 -20.450 0.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.149 -21.304 -1.071 1.00 0.00 H new ATOM 709 N HIS A 47 0.495 -16.040 0.538 1.00 0.00 N ATOM 710 CA HIS A 47 -0.161 -14.996 1.372 1.00 0.00 C ATOM 711 C HIS A 47 0.698 -13.699 1.418 1.00 0.00 C ATOM 712 O HIS A 47 1.907 -13.749 1.661 1.00 0.00 O ATOM 713 CB HIS A 47 -0.389 -15.504 2.823 1.00 0.00 C ATOM 714 CG HIS A 47 -1.495 -16.547 2.988 1.00 0.00 C ATOM 715 ND1 HIS A 47 -1.279 -17.895 3.202 1.00 0.00 N ATOM 716 CD2 HIS A 47 -2.876 -16.280 2.996 1.00 0.00 C ATOM 717 CE1 HIS A 47 -2.573 -18.328 3.310 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.613 -17.438 3.207 1.00 0.00 N ATOM 0 H HIS A 47 0.930 -16.784 1.084 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.124 -14.774 0.913 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.545 -15.928 3.192 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.623 -14.648 3.457 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.308 -15.300 2.856 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.777 -19.375 3.477 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.621 -17.583 3.267 1.00 0.00 H new ATOM 726 N PHE A 48 0.046 -12.549 1.187 1.00 0.00 N ATOM 727 CA PHE A 48 0.719 -11.219 1.187 1.00 0.00 C ATOM 728 C PHE A 48 -0.140 -10.250 2.035 1.00 0.00 C ATOM 729 O PHE A 48 -1.143 -9.710 1.553 1.00 0.00 O ATOM 730 CB PHE A 48 0.910 -10.670 -0.254 1.00 0.00 C ATOM 731 CG PHE A 48 1.928 -11.413 -1.131 1.00 0.00 C ATOM 732 CD1 PHE A 48 3.283 -11.079 -1.074 1.00 0.00 C ATOM 733 CD2 PHE A 48 1.510 -12.433 -1.991 1.00 0.00 C ATOM 734 CE1 PHE A 48 4.200 -11.749 -1.876 1.00 0.00 C ATOM 735 CE2 PHE A 48 2.439 -13.119 -2.773 1.00 0.00 C ATOM 736 CZ PHE A 48 3.784 -12.765 -2.723 1.00 0.00 C ATOM 0 H PHE A 48 -0.955 -12.503 0.995 1.00 0.00 H new ATOM 0 HA PHE A 48 1.716 -11.317 1.615 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.056 -10.689 -0.759 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.214 -9.625 -0.186 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.619 -10.299 -0.406 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.463 -12.691 -2.050 1.00 0.00 H new ATOM 0 HE1 PHE A 48 5.244 -11.476 -1.839 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.115 -13.924 -3.416 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.502 -13.281 -3.343 1.00 0.00 H new ATOM 746 N LYS A 49 0.274 -10.029 3.299 1.00 0.00 N ATOM 747 CA LYS A 49 -0.432 -9.116 4.233 1.00 0.00 C ATOM 748 C LYS A 49 0.222 -7.717 4.155 1.00 0.00 C ATOM 749 O LYS A 49 1.305 -7.471 4.695 1.00 0.00 O ATOM 750 CB LYS A 49 -0.432 -9.712 5.659 1.00 0.00 C ATOM 751 CG LYS A 49 -1.348 -9.020 6.703 1.00 0.00 C ATOM 752 CD LYS A 49 -0.745 -7.837 7.496 1.00 0.00 C ATOM 753 CE LYS A 49 0.418 -8.231 8.432 1.00 0.00 C ATOM 754 NZ LYS A 49 0.912 -7.084 9.211 1.00 0.00 N ATOM 0 H LYS A 49 1.099 -10.472 3.703 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.479 -9.004 3.950 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.725 -10.760 5.590 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.590 -9.691 6.036 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.239 -8.662 6.187 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.676 -9.774 7.418 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.391 -7.085 6.791 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.533 -7.372 8.089 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.086 -9.015 9.112 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.234 -8.646 7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.765 -7.363 9.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.142 -6.300 8.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.178 -6.777 9.881 1.00 0.00 H new ATOM 768 N PHE A 50 -0.497 -6.814 3.484 1.00 0.00 N ATOM 769 CA PHE A 50 -0.097 -5.392 3.344 1.00 0.00 C ATOM 770 C PHE A 50 -0.682 -4.536 4.497 1.00 0.00 C ATOM 771 O PHE A 50 -1.870 -4.642 4.820 1.00 0.00 O ATOM 772 CB PHE A 50 -0.419 -4.835 1.926 1.00 0.00 C ATOM 773 CG PHE A 50 -1.893 -4.667 1.497 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.605 -3.511 1.847 1.00 0.00 C ATOM 775 CD2 PHE A 50 -2.512 -5.636 0.701 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.912 -3.329 1.401 1.00 0.00 C ATOM 777 CE2 PHE A 50 -3.816 -5.446 0.252 1.00 0.00 C ATOM 778 CZ PHE A 50 -4.510 -4.288 0.590 1.00 0.00 C ATOM 0 H PHE A 50 -1.376 -7.038 3.018 1.00 0.00 H new ATOM 0 HA PHE A 50 0.987 -5.330 3.436 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.060 -3.860 1.840 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.061 -5.491 1.200 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.138 -2.758 2.465 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.976 -6.535 0.434 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.461 -2.443 1.685 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -4.290 -6.199 -0.360 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.514 -4.134 0.222 1.00 0.00 H new ATOM 788 N THR A 51 0.167 -3.677 5.083 1.00 0.00 N ATOM 789 CA THR A 51 -0.255 -2.721 6.143 1.00 0.00 C ATOM 790 C THR A 51 0.030 -1.290 5.611 1.00 0.00 C ATOM 791 O THR A 51 1.154 -0.790 5.707 1.00 0.00 O ATOM 792 CB THR A 51 0.437 -3.060 7.495 1.00 0.00 C ATOM 793 OG1 THR A 51 0.066 -4.370 7.908 1.00 0.00 O ATOM 794 CG2 THR A 51 0.076 -2.102 8.641 1.00 0.00 C ATOM 0 H THR A 51 1.157 -3.618 4.845 1.00 0.00 H new ATOM 0 HA THR A 51 -1.321 -2.793 6.360 1.00 0.00 H new ATOM 0 HB THR A 51 1.506 -2.970 7.305 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.371 -4.522 8.827 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.599 -2.406 9.548 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.373 -1.088 8.374 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.000 -2.132 8.815 1.00 0.00 H new ATOM 802 N ILE A 52 -1.023 -0.631 5.094 1.00 0.00 N ATOM 803 CA ILE A 52 -0.964 0.800 4.666 1.00 0.00 C ATOM 804 C ILE A 52 -1.164 1.694 5.929 1.00 0.00 C ATOM 805 O ILE A 52 -1.984 1.396 6.800 1.00 0.00 O ATOM 806 CB ILE A 52 -1.995 1.063 3.503 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.531 0.383 2.177 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.299 2.565 3.235 1.00 0.00 C ATOM 809 CD1 ILE A 52 -2.582 0.298 1.061 1.00 0.00 C ATOM 0 H ILE A 52 -1.937 -1.062 4.957 1.00 0.00 H new ATOM 0 HA ILE A 52 0.007 1.057 4.243 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.926 0.616 3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.668 0.928 1.795 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.193 -0.627 2.409 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -3.017 2.651 2.420 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.715 3.018 4.135 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -1.378 3.080 2.963 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -2.148 -0.192 0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.439 -0.277 1.412 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -2.905 1.303 0.789 1.00 0.00 H new ATOM 821 N THR A 53 -0.422 2.813 5.977 1.00 0.00 N ATOM 822 CA THR A 53 -0.630 3.881 6.993 1.00 0.00 C ATOM 823 C THR A 53 -0.973 5.190 6.222 1.00 0.00 C ATOM 824 O THR A 53 -0.077 5.933 5.806 1.00 0.00 O ATOM 825 CB THR A 53 0.589 4.032 7.954 1.00 0.00 C ATOM 826 OG1 THR A 53 1.788 4.339 7.247 1.00 0.00 O ATOM 827 CG2 THR A 53 0.860 2.813 8.854 1.00 0.00 C ATOM 0 H THR A 53 0.335 3.010 5.322 1.00 0.00 H new ATOM 0 HA THR A 53 -1.456 3.622 7.655 1.00 0.00 H new ATOM 0 HB THR A 53 0.300 4.859 8.602 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.097 3.543 6.766 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.726 3.012 9.486 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.011 2.623 9.481 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.058 1.939 8.233 1.00 0.00 H new ATOM 901 N ILE A 59 -4.871 0.665 7.277 1.00 0.00 N ATOM 902 CA ILE A 59 -5.725 -0.234 6.445 1.00 0.00 C ATOM 903 C ILE A 59 -4.930 -1.563 6.237 1.00 0.00 C ATOM 904 O ILE A 59 -3.987 -1.613 5.440 1.00 0.00 O ATOM 905 CB ILE A 59 -6.190 0.464 5.108 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.964 1.811 5.299 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.075 -0.478 4.250 1.00 0.00 C ATOM 908 CD1 ILE A 59 -6.088 3.074 5.291 1.00 0.00 C ATOM 0 HA ILE A 59 -6.663 -0.465 6.950 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.253 0.694 4.602 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.709 1.899 4.508 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.506 1.770 6.244 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.376 0.037 3.338 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.509 -1.373 3.992 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.962 -0.760 4.817 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.717 3.954 5.430 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.360 3.017 6.100 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.566 3.148 4.337 1.00 0.00 H new ATOM 920 N GLN A 60 -5.339 -2.625 6.960 1.00 0.00 N ATOM 921 CA GLN A 60 -4.653 -3.948 6.940 1.00 0.00 C ATOM 922 C GLN A 60 -5.527 -4.986 6.187 1.00 0.00 C ATOM 923 O GLN A 60 -6.688 -5.207 6.553 1.00 0.00 O ATOM 924 CB GLN A 60 -4.400 -4.463 8.385 1.00 0.00 C ATOM 925 CG GLN A 60 -3.310 -3.694 9.155 1.00 0.00 C ATOM 926 CD GLN A 60 -3.047 -4.237 10.567 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.692 -3.835 11.534 1.00 0.00 O ATOM 928 NE2 GLN A 60 -2.100 -5.152 10.718 1.00 0.00 N ATOM 0 H GLN A 60 -6.152 -2.598 7.575 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.697 -3.823 6.432 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -5.333 -4.406 8.946 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -4.120 -5.515 8.338 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -2.382 -3.729 8.584 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.601 -2.646 9.227 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -1.572 -5.478 9.908 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -1.900 -5.531 11.644 1.00 0.00 H new ATOM 937 N ASN A 61 -4.953 -5.635 5.155 1.00 0.00 N ATOM 938 CA ASN A 61 -5.658 -6.703 4.376 1.00 0.00 C ATOM 939 C ASN A 61 -4.641 -7.735 3.801 1.00 0.00 C ATOM 940 O ASN A 61 -3.539 -7.373 3.377 1.00 0.00 O ATOM 941 CB ASN A 61 -6.520 -6.147 3.205 1.00 0.00 C ATOM 942 CG ASN A 61 -7.730 -5.271 3.571 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.795 -5.767 3.939 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.592 -3.960 3.470 1.00 0.00 N ATOM 0 H ASN A 61 -4.004 -5.447 4.832 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.330 -7.185 5.086 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.868 -5.565 2.553 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.881 -6.994 2.621 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.374 -3.346 3.698 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.704 -3.563 3.164 1.00 0.00 H new ATOM 951 N GLU A 62 -5.058 -9.019 3.749 1.00 0.00 N ATOM 952 CA GLU A 62 -4.230 -10.142 3.226 1.00 0.00 C ATOM 953 C GLU A 62 -4.911 -10.791 1.986 1.00 0.00 C ATOM 954 O GLU A 62 -6.098 -11.133 2.017 1.00 0.00 O ATOM 955 CB GLU A 62 -3.985 -11.164 4.373 1.00 0.00 C ATOM 956 CG GLU A 62 -2.996 -12.304 4.037 1.00 0.00 C ATOM 957 CD GLU A 62 -2.759 -13.267 5.205 1.00 0.00 C ATOM 958 OE1 GLU A 62 -3.677 -14.047 5.541 1.00 0.00 O ATOM 959 OE2 GLU A 62 -1.649 -13.259 5.782 1.00 0.00 O ATOM 0 H GLU A 62 -5.981 -9.313 4.068 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.262 -9.771 2.888 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.612 -10.626 5.244 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.941 -11.605 4.656 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.377 -12.866 3.184 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.043 -11.871 3.734 1.00 0.00 H new ATOM 966 N PHE A 63 -4.112 -10.999 0.921 1.00 0.00 N ATOM 967 CA PHE A 63 -4.524 -11.769 -0.286 1.00 0.00 C ATOM 968 C PHE A 63 -3.646 -13.031 -0.482 1.00 0.00 C ATOM 969 O PHE A 63 -2.421 -12.985 -0.353 1.00 0.00 O ATOM 970 CB PHE A 63 -4.513 -10.917 -1.588 1.00 0.00 C ATOM 971 CG PHE A 63 -3.208 -10.219 -2.027 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.259 -10.901 -2.798 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.997 -8.872 -1.715 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.126 -10.239 -3.262 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.864 -8.212 -2.181 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.931 -8.895 -2.957 1.00 0.00 C ATOM 0 H PHE A 63 -3.159 -10.640 0.866 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.554 -12.072 -0.101 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.828 -11.565 -2.406 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.276 -10.146 -1.481 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.407 -11.945 -3.034 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.717 -8.342 -1.109 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.398 -10.768 -3.859 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.708 -7.171 -1.941 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.054 -8.381 -3.323 1.00 0.00 H new ATOM 986 N THR A 64 -4.289 -14.118 -0.935 1.00 0.00 N ATOM 987 CA THR A 64 -3.589 -15.249 -1.599 1.00 0.00 C ATOM 988 C THR A 64 -3.525 -14.963 -3.137 1.00 0.00 C ATOM 989 O THR A 64 -4.501 -14.507 -3.745 1.00 0.00 O ATOM 990 CB THR A 64 -4.338 -16.573 -1.261 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.301 -16.802 0.144 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.782 -17.837 -1.936 1.00 0.00 C ATOM 0 H THR A 64 -5.298 -14.246 -0.857 1.00 0.00 H new ATOM 0 HA THR A 64 -2.565 -15.354 -1.241 1.00 0.00 H new ATOM 0 HB THR A 64 -5.346 -16.418 -1.645 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.774 -17.635 0.352 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.374 -18.701 -1.634 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.832 -17.723 -3.019 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.745 -17.985 -1.634 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.379 -15.298 -3.764 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.210 -15.234 -5.249 1.00 0.00 C ATOM 1002 C VAL A 65 -2.943 -16.462 -5.876 1.00 0.00 C ATOM 1003 O VAL A 65 -2.676 -17.622 -5.542 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.697 -15.118 -5.640 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.374 -15.303 -7.143 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.113 -13.749 -5.222 1.00 0.00 C ATOM 0 H VAL A 65 -1.546 -15.619 -3.270 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.667 -14.333 -5.657 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.242 -15.948 -5.099 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.700 -15.203 -7.299 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.697 -16.293 -7.465 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.898 -14.544 -7.724 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.938 -13.699 -5.507 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.662 -12.951 -5.722 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.202 -13.630 -4.142 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.891 -16.148 -6.768 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.875 -17.123 -7.296 1.00 0.00 C ATOM 1018 C GLY A 66 -6.131 -17.386 -6.429 1.00 0.00 C ATOM 1019 O GLY A 66 -6.582 -18.531 -6.336 1.00 0.00 O ATOM 0 H GLY A 66 -4.004 -15.209 -7.150 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.205 -16.776 -8.275 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.363 -18.073 -7.450 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.696 -16.324 -5.828 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.907 -16.397 -4.968 1.00 0.00 C ATOM 1025 C GLU A 67 -8.654 -15.032 -5.057 1.00 0.00 C ATOM 1026 O GLU A 67 -8.028 -13.965 -5.055 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.482 -16.719 -3.506 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.635 -17.080 -2.544 1.00 0.00 C ATOM 1029 CD GLU A 67 -8.143 -17.385 -1.127 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.001 -16.440 -0.319 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -7.889 -18.570 -0.816 1.00 0.00 O ATOM 0 H GLU A 67 -6.327 -15.378 -5.922 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.577 -17.188 -5.303 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.775 -17.548 -3.526 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.951 -15.857 -3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.346 -16.255 -2.508 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.171 -17.946 -2.933 1.00 0.00 H new ATOM 1038 N GLU A 68 -10.004 -15.071 -5.047 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.840 -13.848 -4.870 1.00 0.00 C ATOM 1040 C GLU A 68 -10.783 -13.386 -3.388 1.00 0.00 C ATOM 1041 O GLU A 68 -11.343 -14.029 -2.492 1.00 0.00 O ATOM 1042 CB GLU A 68 -12.311 -14.076 -5.306 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.515 -14.095 -6.832 1.00 0.00 C ATOM 1044 CD GLU A 68 -13.979 -14.277 -7.235 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -14.463 -15.430 -7.260 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -14.655 -13.264 -7.528 1.00 0.00 O ATOM 0 H GLU A 68 -10.543 -15.930 -5.158 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.431 -13.070 -5.515 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.660 -15.022 -4.891 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.933 -13.291 -4.876 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.140 -13.163 -7.255 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -11.922 -14.902 -7.263 1.00 0.00 H new ATOM 1053 N CYS A 69 -10.054 -12.282 -3.169 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.729 -11.780 -1.812 1.00 0.00 C ATOM 1055 C CYS A 69 -10.490 -10.462 -1.538 1.00 0.00 C ATOM 1056 O CYS A 69 -10.531 -9.554 -2.375 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.210 -11.560 -1.685 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.279 -13.053 -2.171 1.00 0.00 S ATOM 0 H CYS A 69 -9.671 -11.708 -3.920 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.039 -12.520 -1.074 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.908 -10.721 -2.312 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -7.964 -11.294 -0.657 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.619 -13.403 -3.376 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.051 -10.368 -0.324 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.833 -9.192 0.132 1.00 0.00 C ATOM 1066 C GLU A 70 -10.872 -8.093 0.664 1.00 0.00 C ATOM 1067 O GLU A 70 -10.458 -8.114 1.829 1.00 0.00 O ATOM 1068 CB GLU A 70 -12.860 -9.679 1.188 1.00 0.00 C ATOM 1069 CG GLU A 70 -14.168 -10.252 0.599 1.00 0.00 C ATOM 1070 CD GLU A 70 -15.140 -9.193 0.061 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -15.965 -8.674 0.845 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -15.082 -8.874 -1.147 1.00 0.00 O ATOM 0 H GLU A 70 -10.979 -11.105 0.378 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.387 -8.735 -0.688 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.390 -10.444 1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.108 -8.846 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.917 -10.941 -0.208 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.674 -10.834 1.369 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.502 -7.162 -0.235 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.450 -6.147 0.028 1.00 0.00 C ATOM 1081 C LEU A 71 -10.105 -4.747 -0.034 1.00 0.00 C ATOM 1082 O LEU A 71 -10.683 -4.357 -1.057 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.274 -6.225 -0.988 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.564 -7.589 -1.211 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.497 -7.452 -2.315 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.960 -8.184 0.076 1.00 0.00 C ATOM 0 H LEU A 71 -10.919 -7.087 -1.163 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.025 -6.341 1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.650 -5.887 -1.954 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.517 -5.507 -0.672 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.329 -8.297 -1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.004 -8.412 -2.465 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.973 -7.139 -3.244 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.759 -6.708 -2.017 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.480 -9.136 -0.153 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.221 -7.494 0.484 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.751 -8.344 0.809 1.00 0.00 H new ATOM 1180 N LYS A 78 -14.633 -3.472 1.256 1.00 0.00 N ATOM 1181 CA LYS A 78 -14.027 -4.782 0.879 1.00 0.00 C ATOM 1182 C LYS A 78 -14.619 -5.325 -0.460 1.00 0.00 C ATOM 1183 O LYS A 78 -15.839 -5.446 -0.615 1.00 0.00 O ATOM 1184 CB LYS A 78 -14.221 -5.832 2.008 1.00 0.00 C ATOM 1185 CG LYS A 78 -13.302 -5.739 3.247 1.00 0.00 C ATOM 1186 CD LYS A 78 -13.676 -4.654 4.283 1.00 0.00 C ATOM 1187 CE LYS A 78 -12.937 -4.759 5.634 1.00 0.00 C ATOM 1188 NZ LYS A 78 -11.490 -4.479 5.548 1.00 0.00 N ATOM 0 HA LYS A 78 -12.960 -4.612 0.736 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.253 -5.767 2.352 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.093 -6.822 1.570 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.300 -6.707 3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.283 -5.554 2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -13.473 -3.674 3.850 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.749 -4.704 4.468 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.390 -4.063 6.340 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -13.080 -5.761 6.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.062 -4.569 6.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.043 -5.158 4.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -11.344 -3.513 5.192 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.722 -5.616 -1.420 1.00 0.00 N ATOM 1203 CA VAL A 79 -14.091 -5.926 -2.833 1.00 0.00 C ATOM 1204 C VAL A 79 -13.196 -7.092 -3.359 1.00 0.00 C ATOM 1205 O VAL A 79 -11.975 -7.111 -3.159 1.00 0.00 O ATOM 1206 CB VAL A 79 -14.036 -4.675 -3.786 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -15.299 -3.794 -3.691 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -12.785 -3.777 -3.649 1.00 0.00 C ATOM 0 H VAL A 79 -12.717 -5.645 -1.248 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.135 -6.238 -2.838 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.978 -5.140 -4.770 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -15.204 -2.947 -4.370 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -16.175 -4.382 -3.965 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -15.412 -3.429 -2.670 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.854 -2.947 -4.353 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.726 -3.387 -2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.891 -4.363 -3.865 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.830 -8.047 -4.071 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.166 -9.274 -4.598 1.00 0.00 C ATOM 1220 C LYS A 80 -12.213 -8.969 -5.790 1.00 0.00 C ATOM 1221 O LYS A 80 -12.583 -8.247 -6.723 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.227 -10.315 -5.053 1.00 0.00 C ATOM 1223 CG LYS A 80 -15.082 -10.941 -3.924 1.00 0.00 C ATOM 1224 CD LYS A 80 -16.020 -12.080 -4.376 1.00 0.00 C ATOM 1225 CE LYS A 80 -17.177 -11.632 -5.292 1.00 0.00 C ATOM 1226 NZ LYS A 80 -18.054 -12.761 -5.648 1.00 0.00 N ATOM 0 H LYS A 80 -14.822 -7.995 -4.302 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.569 -9.678 -3.781 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.897 -9.835 -5.767 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.716 -11.118 -5.585 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.414 -11.324 -3.152 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.683 -10.156 -3.465 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -15.430 -12.833 -4.899 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.439 -12.561 -3.492 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.761 -10.861 -4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.771 -11.185 -6.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.821 -12.424 -6.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.501 -13.486 -6.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.460 -13.171 -4.783 1.00 0.00 H new ATOM 1240 N THR A 81 -10.994 -9.543 -5.746 1.00 0.00 N ATOM 1241 CA THR A 81 -9.979 -9.374 -6.823 1.00 0.00 C ATOM 1242 C THR A 81 -9.004 -10.593 -6.844 1.00 0.00 C ATOM 1243 O THR A 81 -8.596 -11.096 -5.791 1.00 0.00 O ATOM 1244 CB THR A 81 -9.258 -7.994 -6.720 1.00 0.00 C ATOM 1245 OG1 THR A 81 -8.619 -7.711 -7.955 1.00 0.00 O ATOM 1246 CG2 THR A 81 -8.229 -7.838 -5.583 1.00 0.00 C ATOM 0 H THR A 81 -10.681 -10.132 -4.975 1.00 0.00 H new ATOM 0 HA THR A 81 -10.484 -9.362 -7.789 1.00 0.00 H new ATOM 0 HB THR A 81 -10.052 -7.287 -6.479 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.674 -7.965 -7.900 1.00 0.00 H new ATOM 0 HG21 THR A 81 -7.798 -6.837 -5.617 1.00 0.00 H new ATOM 0 HG22 THR A 81 -8.722 -7.988 -4.623 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.438 -8.578 -5.704 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.603 -11.027 -8.055 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.690 -12.193 -8.245 1.00 0.00 C ATOM 1256 C VAL A 82 -6.298 -11.624 -8.657 1.00 0.00 C ATOM 1257 O VAL A 82 -6.170 -10.913 -9.661 1.00 0.00 O ATOM 1258 CB VAL A 82 -8.234 -13.244 -9.276 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -7.369 -14.527 -9.302 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.692 -13.693 -9.025 1.00 0.00 C ATOM 0 H VAL A 82 -8.895 -10.589 -8.929 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.613 -12.752 -7.313 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.190 -12.711 -10.226 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.780 -15.228 -10.028 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.347 -14.271 -9.582 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.370 -14.987 -8.314 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.985 -14.419 -9.784 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.767 -14.149 -8.038 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.353 -12.828 -9.076 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.264 -11.974 -7.871 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.872 -11.477 -8.078 1.00 0.00 C ATOM 1272 C VAL A 83 -3.061 -12.582 -8.830 1.00 0.00 C ATOM 1273 O VAL A 83 -3.155 -13.768 -8.498 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.193 -11.046 -6.727 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.869 -10.281 -6.973 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.084 -10.191 -5.786 1.00 0.00 C ATOM 0 H VAL A 83 -5.358 -12.606 -7.076 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.893 -10.574 -8.688 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.008 -11.993 -6.221 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.428 -9.999 -6.017 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.175 -10.921 -7.518 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.071 -9.384 -7.558 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.527 -9.945 -4.882 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.374 -9.272 -6.295 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.977 -10.755 -5.519 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.254 -12.176 -9.830 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.314 -13.085 -10.544 1.00 0.00 C ATOM 1288 C GLN A 84 0.117 -12.489 -10.450 1.00 0.00 C ATOM 1289 O GLN A 84 0.334 -11.295 -10.675 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.709 -13.273 -12.036 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.792 -14.333 -12.342 1.00 0.00 C ATOM 1292 CD GLN A 84 -4.249 -14.009 -11.961 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.666 -12.857 -11.824 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -5.065 -15.043 -11.821 1.00 0.00 N ATOM 0 H GLN A 84 -2.230 -11.215 -10.170 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.355 -14.067 -10.072 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -2.055 -12.313 -12.419 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.810 -13.534 -12.595 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.765 -14.539 -13.412 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.511 -15.255 -11.833 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.710 -15.992 -11.936 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -6.048 -14.890 -11.598 1.00 0.00 H new ATOM 1303 N LEU A 85 1.100 -13.365 -10.175 1.00 0.00 N ATOM 1304 CA LEU A 85 2.536 -13.000 -10.167 1.00 0.00 C ATOM 1305 C LEU A 85 3.116 -13.249 -11.587 1.00 0.00 C ATOM 1306 O LEU A 85 3.340 -14.396 -11.991 1.00 0.00 O ATOM 1307 CB LEU A 85 3.240 -13.813 -9.043 1.00 0.00 C ATOM 1308 CG LEU A 85 4.772 -13.619 -8.897 1.00 0.00 C ATOM 1309 CD1 LEU A 85 5.211 -12.151 -8.716 1.00 0.00 C ATOM 1310 CD2 LEU A 85 5.329 -14.483 -7.748 1.00 0.00 C ATOM 0 H LEU A 85 0.926 -14.345 -9.952 1.00 0.00 H new ATOM 0 HA LEU A 85 2.699 -11.946 -9.944 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.772 -13.555 -8.093 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.046 -14.872 -9.217 1.00 0.00 H new ATOM 0 HG LEU A 85 5.194 -13.948 -9.847 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.296 -12.105 -8.622 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.897 -11.568 -9.582 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.751 -11.742 -7.817 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.405 -14.329 -7.666 1.00 0.00 H new ATOM 0 HD22 LEU A 85 4.849 -14.197 -6.812 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.127 -15.534 -7.953 1.00 0.00 H new ATOM 1322 N GLU A 86 3.357 -12.147 -12.319 1.00 0.00 N ATOM 1323 CA GLU A 86 3.952 -12.186 -13.676 1.00 0.00 C ATOM 1324 C GLU A 86 5.488 -12.000 -13.527 1.00 0.00 C ATOM 1325 O GLU A 86 5.983 -10.974 -13.048 1.00 0.00 O ATOM 1326 CB GLU A 86 3.306 -11.097 -14.565 1.00 0.00 C ATOM 1327 CG GLU A 86 3.411 -11.361 -16.082 1.00 0.00 C ATOM 1328 CD GLU A 86 2.728 -10.282 -16.933 1.00 0.00 C ATOM 1329 OE1 GLU A 86 1.490 -10.126 -16.838 1.00 0.00 O ATOM 1330 OE2 GLU A 86 3.425 -9.593 -17.708 1.00 0.00 O ATOM 0 H GLU A 86 3.147 -11.204 -11.992 1.00 0.00 H new ATOM 0 HA GLU A 86 3.762 -13.141 -14.167 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.253 -11.005 -14.297 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.776 -10.139 -14.343 1.00 0.00 H new ATOM 0 HG2 GLU A 86 4.463 -11.423 -16.361 1.00 0.00 H new ATOM 0 HG3 GLU A 86 2.964 -12.329 -16.307 1.00 0.00 H new ATOM 1337 N GLY A 87 6.211 -13.056 -13.905 1.00 0.00 N ATOM 1338 CA GLY A 87 7.664 -13.177 -13.661 1.00 0.00 C ATOM 1339 C GLY A 87 8.004 -13.517 -12.192 1.00 0.00 C ATOM 1340 O GLY A 87 7.471 -14.475 -11.623 1.00 0.00 O ATOM 0 H GLY A 87 5.811 -13.858 -14.391 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.073 -13.951 -14.311 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.152 -12.241 -13.934 1.00 0.00 H new ATOM 1344 N ASP A 88 8.892 -12.702 -11.607 1.00 0.00 N ATOM 1345 CA ASP A 88 9.244 -12.763 -10.156 1.00 0.00 C ATOM 1346 C ASP A 88 8.920 -11.461 -9.341 1.00 0.00 C ATOM 1347 O ASP A 88 8.971 -11.517 -8.108 1.00 0.00 O ATOM 1348 CB ASP A 88 10.741 -13.178 -10.053 1.00 0.00 C ATOM 1349 CG ASP A 88 11.210 -13.632 -8.662 1.00 0.00 C ATOM 1350 OD1 ASP A 88 10.885 -14.769 -8.254 1.00 0.00 O ATOM 1351 OD2 ASP A 88 11.903 -12.851 -7.972 1.00 0.00 O ATOM 0 H ASP A 88 9.395 -11.975 -12.116 1.00 0.00 H new ATOM 0 HA ASP A 88 8.604 -13.507 -9.681 1.00 0.00 H new ATOM 0 HB2 ASP A 88 10.925 -13.987 -10.760 1.00 0.00 H new ATOM 0 HB3 ASP A 88 11.356 -12.334 -10.367 1.00 0.00 H new ATOM 1356 N ASN A 89 8.594 -10.321 -9.988 1.00 0.00 N ATOM 1357 CA ASN A 89 8.414 -9.001 -9.312 1.00 0.00 C ATOM 1358 C ASN A 89 7.048 -8.270 -9.513 1.00 0.00 C ATOM 1359 O ASN A 89 6.823 -7.293 -8.794 1.00 0.00 O ATOM 1360 CB ASN A 89 9.616 -8.069 -9.646 1.00 0.00 C ATOM 1361 CG ASN A 89 9.722 -7.499 -11.082 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.829 -8.241 -12.058 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.708 -6.185 -11.243 1.00 0.00 N ATOM 0 H ASN A 89 8.446 -10.282 -10.996 1.00 0.00 H new ATOM 0 HA ASN A 89 8.390 -9.245 -8.250 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.587 -7.227 -8.955 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.533 -8.620 -9.438 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.786 -5.785 -12.178 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.619 -5.573 -10.432 1.00 0.00 H new ATOM 1370 N LYS A 90 6.171 -8.666 -10.460 1.00 0.00 N ATOM 1371 CA LYS A 90 5.020 -7.835 -10.891 1.00 0.00 C ATOM 1372 C LYS A 90 3.679 -8.510 -10.484 1.00 0.00 C ATOM 1373 O LYS A 90 3.162 -9.364 -11.210 1.00 0.00 O ATOM 1374 CB LYS A 90 5.202 -7.598 -12.416 1.00 0.00 C ATOM 1375 CG LYS A 90 4.291 -6.502 -12.993 1.00 0.00 C ATOM 1376 CD LYS A 90 4.629 -6.030 -14.425 1.00 0.00 C ATOM 1377 CE LYS A 90 4.391 -7.040 -15.567 1.00 0.00 C ATOM 1378 NZ LYS A 90 5.504 -7.992 -15.740 1.00 0.00 N ATOM 0 H LYS A 90 6.237 -9.561 -10.945 1.00 0.00 H new ATOM 0 HA LYS A 90 4.984 -6.864 -10.396 1.00 0.00 H new ATOM 0 HB2 LYS A 90 6.241 -7.332 -12.610 1.00 0.00 H new ATOM 0 HB3 LYS A 90 5.008 -8.532 -12.944 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.264 -6.868 -12.984 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.327 -5.639 -12.328 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.042 -5.136 -14.635 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.678 -5.735 -14.446 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.474 -7.595 -15.368 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.238 -6.496 -16.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.491 -8.369 -16.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.407 -7.505 -15.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.400 -8.774 -15.063 1.00 0.00 H new ATOM 1392 N LEU A 91 3.107 -8.096 -9.334 1.00 0.00 N ATOM 1393 CA LEU A 91 1.776 -8.580 -8.864 1.00 0.00 C ATOM 1394 C LEU A 91 0.659 -7.699 -9.501 1.00 0.00 C ATOM 1395 O LEU A 91 0.456 -6.546 -9.107 1.00 0.00 O ATOM 1396 CB LEU A 91 1.685 -8.576 -7.307 1.00 0.00 C ATOM 1397 CG LEU A 91 2.526 -9.636 -6.539 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.609 -9.305 -5.035 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.978 -11.066 -6.699 1.00 0.00 C ATOM 0 H LEU A 91 3.544 -7.423 -8.704 1.00 0.00 H new ATOM 0 HA LEU A 91 1.640 -9.614 -9.182 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.984 -7.589 -6.954 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.639 -8.710 -7.030 1.00 0.00 H new ATOM 0 HG LEU A 91 3.520 -9.597 -6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.203 -10.065 -4.527 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.077 -8.330 -4.902 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.605 -9.286 -4.611 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.606 -11.761 -6.141 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.959 -11.110 -6.316 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.981 -11.341 -7.754 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.042 -8.262 -10.502 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.074 -7.539 -11.305 1.00 0.00 C ATOM 1413 C VAL A 92 -2.487 -7.890 -10.758 1.00 0.00 C ATOM 1414 O VAL A 92 -2.833 -9.073 -10.658 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.942 -7.813 -12.846 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.332 -7.181 -13.446 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.021 -9.294 -13.296 1.00 0.00 C ATOM 0 H VAL A 92 0.084 -9.234 -10.786 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.912 -6.467 -11.193 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.838 -7.331 -13.238 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.378 -7.398 -14.513 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.308 -6.102 -13.296 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.211 -7.596 -12.953 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.917 -9.351 -14.380 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.219 -9.861 -12.824 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.983 -9.713 -13.001 1.00 0.00 H new ATOM 1427 N THR A 93 -3.303 -6.870 -10.409 1.00 0.00 N ATOM 1428 CA THR A 93 -4.675 -7.104 -9.877 1.00 0.00 C ATOM 1429 C THR A 93 -5.594 -5.895 -10.201 1.00 0.00 C ATOM 1430 O THR A 93 -5.283 -4.755 -9.848 1.00 0.00 O ATOM 1431 CB THR A 93 -4.654 -7.488 -8.368 1.00 0.00 C ATOM 1432 OG1 THR A 93 -5.924 -8.000 -7.998 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.254 -6.396 -7.361 1.00 0.00 C ATOM 0 H THR A 93 -3.044 -5.886 -10.483 1.00 0.00 H new ATOM 0 HA THR A 93 -5.105 -7.969 -10.383 1.00 0.00 H new ATOM 0 HB THR A 93 -3.852 -8.224 -8.302 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.890 -8.979 -7.982 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.283 -6.804 -6.351 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.245 -6.048 -7.583 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.950 -5.560 -7.435 1.00 0.00 H new ATOM 1441 N THR A 94 -6.740 -6.176 -10.844 1.00 0.00 N ATOM 1442 CA THR A 94 -7.746 -5.143 -11.221 1.00 0.00 C ATOM 1443 C THR A 94 -9.052 -5.343 -10.402 1.00 0.00 C ATOM 1444 O THR A 94 -9.612 -6.444 -10.342 1.00 0.00 O ATOM 1445 CB THR A 94 -7.959 -5.095 -12.764 1.00 0.00 C ATOM 1446 OG1 THR A 94 -8.703 -3.927 -13.098 1.00 0.00 O ATOM 1447 CG2 THR A 94 -8.650 -6.307 -13.414 1.00 0.00 C ATOM 0 H THR A 94 -7.004 -7.122 -11.121 1.00 0.00 H new ATOM 0 HA THR A 94 -7.369 -4.155 -10.958 1.00 0.00 H new ATOM 0 HB THR A 94 -6.947 -5.097 -13.168 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.557 -3.240 -12.415 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.735 -6.144 -14.488 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.060 -7.205 -13.229 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.645 -6.432 -12.986 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.548 -4.241 -9.816 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.834 -4.214 -9.065 1.00 0.00 C ATOM 1457 C PHE A 95 -12.004 -4.008 -10.072 1.00 0.00 C ATOM 1458 O PHE A 95 -12.616 -4.986 -10.512 1.00 0.00 O ATOM 1459 CB PHE A 95 -10.774 -3.190 -7.886 1.00 0.00 C ATOM 1460 CG PHE A 95 -9.758 -3.487 -6.768 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -10.089 -4.392 -5.758 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -8.518 -2.839 -6.729 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -9.210 -4.622 -4.704 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -7.630 -3.084 -5.682 1.00 0.00 C ATOM 1465 CZ PHE A 95 -7.979 -3.971 -4.667 1.00 0.00 C ATOM 0 H PHE A 95 -9.075 -3.338 -9.844 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.021 -5.169 -8.573 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.548 -2.207 -8.299 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -11.766 -3.128 -7.438 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -11.032 -4.916 -5.795 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -8.248 -2.147 -7.513 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -9.482 -5.306 -3.914 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -6.672 -2.586 -5.658 1.00 0.00 H new ATOM 0 HZ PHE A 95 -7.295 -4.154 -3.851 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.256 -2.749 -10.457 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.142 -2.383 -11.593 1.00 0.00 C ATOM 1477 C LYS A 96 -12.347 -1.371 -12.470 1.00 0.00 C ATOM 1478 O LYS A 96 -11.796 -1.771 -13.500 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.538 -1.878 -11.118 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.490 -2.970 -10.586 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.856 -2.400 -10.146 1.00 0.00 C ATOM 1482 CE LYS A 96 -17.886 -3.451 -9.689 1.00 0.00 C ATOM 1483 NZ LYS A 96 -18.424 -4.255 -10.805 1.00 0.00 N ATOM 0 H LYS A 96 -11.850 -1.939 -9.988 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.394 -3.254 -12.198 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.390 -1.135 -10.334 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -15.024 -1.370 -11.951 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.646 -3.721 -11.361 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.022 -3.476 -9.742 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.693 -1.695 -9.331 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -17.281 -1.835 -10.976 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.420 -4.116 -8.961 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.709 -2.948 -9.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.111 -4.944 -10.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.894 -3.629 -11.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.646 -4.760 -11.276 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.256 -0.089 -12.051 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.436 0.949 -12.739 1.00 0.00 C ATOM 1499 C ASN A 97 -9.937 0.990 -12.282 1.00 0.00 C ATOM 1500 O ASN A 97 -9.067 1.225 -13.125 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.163 2.316 -12.582 1.00 0.00 C ATOM 1502 CG ASN A 97 -11.804 3.415 -13.607 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -11.240 3.171 -14.674 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -12.177 4.651 -13.319 1.00 0.00 N ATOM 0 H ASN A 97 -12.746 0.261 -11.228 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.361 0.691 -13.795 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -13.237 2.138 -12.636 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -11.953 2.700 -11.584 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -11.998 5.405 -13.982 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -12.644 4.850 -12.434 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.633 0.752 -10.983 1.00 0.00 N ATOM 1512 CA ILE A 98 -8.241 0.689 -10.437 1.00 0.00 C ATOM 1513 C ILE A 98 -7.536 -0.599 -10.984 1.00 0.00 C ATOM 1514 O ILE A 98 -8.080 -1.702 -10.874 1.00 0.00 O ATOM 1515 CB ILE A 98 -8.266 0.730 -8.859 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.939 2.009 -8.263 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.851 0.571 -8.232 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.404 1.888 -6.803 1.00 0.00 C ATOM 0 H ILE A 98 -10.348 0.596 -10.273 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.670 1.557 -10.766 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.882 -0.129 -8.591 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.234 2.837 -8.335 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.799 2.268 -8.880 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.928 0.607 -7.145 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -6.425 -0.385 -8.534 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.207 1.380 -8.577 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -9.856 2.828 -6.486 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.138 1.086 -6.720 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.548 1.664 -6.166 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.325 -0.429 -11.543 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.506 -1.549 -12.083 1.00 0.00 C ATOM 1532 C LYS A 99 -4.090 -1.449 -11.450 1.00 0.00 C ATOM 1533 O LYS A 99 -3.241 -0.683 -11.916 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.529 -1.479 -13.633 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.857 -2.673 -14.349 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.951 -2.640 -15.892 1.00 0.00 C ATOM 1537 CE LYS A 99 -6.355 -2.821 -16.512 1.00 0.00 C ATOM 1538 NZ LYS A 99 -6.927 -4.163 -16.289 1.00 0.00 N ATOM 0 H LYS A 99 -5.880 0.484 -11.637 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.900 -2.531 -11.822 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.565 -1.413 -13.964 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.034 -0.560 -13.948 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.805 -2.705 -14.064 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.312 -3.596 -13.991 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.549 -1.687 -16.236 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.302 -3.421 -16.288 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.028 -2.073 -16.093 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.297 -2.633 -17.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.868 -4.217 -16.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -6.305 -4.880 -16.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.013 -4.339 -15.267 1.00 0.00 H new ATOM 1552 N SER A 100 -3.860 -2.230 -10.377 1.00 0.00 N ATOM 1553 CA SER A 100 -2.647 -2.128 -9.529 1.00 0.00 C ATOM 1554 C SER A 100 -1.525 -3.055 -10.063 1.00 0.00 C ATOM 1555 O SER A 100 -1.581 -4.278 -9.907 1.00 0.00 O ATOM 1556 CB SER A 100 -3.037 -2.485 -8.076 1.00 0.00 C ATOM 1557 OG SER A 100 -1.960 -2.216 -7.184 1.00 0.00 O ATOM 0 H SER A 100 -4.510 -2.953 -10.069 1.00 0.00 H new ATOM 0 HA SER A 100 -2.255 -1.111 -9.556 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.914 -1.911 -7.778 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.311 -3.538 -8.016 1.00 0.00 H new ATOM 0 HG SER A 100 -2.227 -2.447 -6.270 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.507 -2.438 -10.685 1.00 0.00 N ATOM 1564 CA VAL A 101 0.646 -3.161 -11.288 1.00 0.00 C ATOM 1565 C VAL A 101 1.834 -2.930 -10.308 1.00 0.00 C ATOM 1566 O VAL A 101 2.509 -1.896 -10.363 1.00 0.00 O ATOM 1567 CB VAL A 101 0.895 -2.667 -12.757 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.128 -3.330 -13.410 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.319 -2.888 -13.694 1.00 0.00 C ATOM 0 H VAL A 101 -0.452 -1.425 -10.789 1.00 0.00 H new ATOM 0 HA VAL A 101 0.480 -4.233 -11.399 1.00 0.00 H new ATOM 0 HB VAL A 101 1.069 -1.597 -12.646 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.251 -2.950 -14.424 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.018 -3.098 -12.825 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.986 -4.410 -13.442 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.079 -2.524 -14.693 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.553 -3.952 -13.742 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.181 -2.344 -13.307 1.00 0.00 H new ATOM 1579 N THR A 102 2.056 -3.898 -9.398 1.00 0.00 N ATOM 1580 CA THR A 102 2.974 -3.725 -8.238 1.00 0.00 C ATOM 1581 C THR A 102 4.357 -4.344 -8.600 1.00 0.00 C ATOM 1582 O THR A 102 4.620 -5.517 -8.321 1.00 0.00 O ATOM 1583 CB THR A 102 2.321 -4.325 -6.954 1.00 0.00 C ATOM 1584 OG1 THR A 102 0.993 -3.839 -6.771 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.095 -4.005 -5.665 1.00 0.00 C ATOM 0 H THR A 102 1.613 -4.816 -9.438 1.00 0.00 H new ATOM 0 HA THR A 102 3.147 -2.672 -8.017 1.00 0.00 H new ATOM 0 HB THR A 102 2.332 -5.402 -7.120 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.014 -2.866 -6.657 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.584 -4.453 -4.813 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.104 -4.410 -5.737 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.146 -2.925 -5.530 1.00 0.00 H new ATOM 1593 N GLU A 103 5.230 -3.526 -9.216 1.00 0.00 N ATOM 1594 CA GLU A 103 6.592 -3.934 -9.642 1.00 0.00 C ATOM 1595 C GLU A 103 7.598 -3.725 -8.486 1.00 0.00 C ATOM 1596 O GLU A 103 7.544 -2.699 -7.811 1.00 0.00 O ATOM 1597 CB GLU A 103 7.017 -3.044 -10.840 1.00 0.00 C ATOM 1598 CG GLU A 103 6.414 -3.464 -12.195 1.00 0.00 C ATOM 1599 CD GLU A 103 6.835 -2.538 -13.335 1.00 0.00 C ATOM 1600 OE1 GLU A 103 6.134 -1.531 -13.584 1.00 0.00 O ATOM 1601 OE2 GLU A 103 7.869 -2.806 -13.985 1.00 0.00 O ATOM 0 H GLU A 103 5.013 -2.554 -9.436 1.00 0.00 H new ATOM 0 HA GLU A 103 6.585 -4.987 -9.923 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.727 -2.014 -10.632 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.104 -3.060 -10.920 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.723 -4.483 -12.426 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.327 -3.470 -12.119 1.00 0.00 H new ATOM 1608 N LEU A 104 8.540 -4.663 -8.302 1.00 0.00 N ATOM 1609 CA LEU A 104 9.631 -4.519 -7.300 1.00 0.00 C ATOM 1610 C LEU A 104 10.986 -4.563 -8.061 1.00 0.00 C ATOM 1611 O LEU A 104 11.491 -5.640 -8.395 1.00 0.00 O ATOM 1612 CB LEU A 104 9.479 -5.595 -6.185 1.00 0.00 C ATOM 1613 CG LEU A 104 10.032 -5.203 -4.789 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.746 -6.319 -3.773 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.529 -4.844 -4.763 1.00 0.00 C ATOM 0 H LEU A 104 8.576 -5.535 -8.831 1.00 0.00 H new ATOM 0 HA LEU A 104 9.583 -3.564 -6.777 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.421 -5.837 -6.081 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.983 -6.504 -6.512 1.00 0.00 H new ATOM 0 HG LEU A 104 9.505 -4.288 -4.518 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.139 -6.032 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.670 -6.477 -3.699 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.226 -7.241 -4.101 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.823 -4.584 -3.746 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.114 -5.699 -5.103 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.711 -3.995 -5.422 1.00 0.00 H new ATOM 1627 N ASN A 105 11.562 -3.377 -8.337 1.00 0.00 N ATOM 1628 CA ASN A 105 12.770 -3.249 -9.199 1.00 0.00 C ATOM 1629 C ASN A 105 14.025 -3.106 -8.295 1.00 0.00 C ATOM 1630 O ASN A 105 14.355 -2.005 -7.843 1.00 0.00 O ATOM 1631 CB ASN A 105 12.619 -2.053 -10.183 1.00 0.00 C ATOM 1632 CG ASN A 105 11.475 -2.181 -11.213 1.00 0.00 C ATOM 1633 OD1 ASN A 105 11.533 -2.984 -12.143 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.415 -1.403 -11.058 1.00 0.00 N ATOM 0 H ASN A 105 11.215 -2.488 -7.978 1.00 0.00 H new ATOM 0 HA ASN A 105 12.886 -4.144 -9.810 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.461 -1.144 -9.602 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.558 -1.928 -10.722 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.636 -1.466 -11.713 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.377 -0.741 -10.283 1.00 0.00 H new ATOM 1641 N GLY A 106 14.706 -4.233 -8.008 1.00 0.00 N ATOM 1642 CA GLY A 106 15.872 -4.247 -7.092 1.00 0.00 C ATOM 1643 C GLY A 106 15.447 -4.223 -5.612 1.00 0.00 C ATOM 1644 O GLY A 106 14.838 -5.184 -5.131 1.00 0.00 O ATOM 0 H GLY A 106 14.471 -5.147 -8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.471 -5.138 -7.282 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.506 -3.386 -7.300 1.00 0.00 H new ATOM 1648 N ASP A 107 15.752 -3.109 -4.921 1.00 0.00 N ATOM 1649 CA ASP A 107 15.220 -2.838 -3.554 1.00 0.00 C ATOM 1650 C ASP A 107 14.464 -1.469 -3.504 1.00 0.00 C ATOM 1651 O ASP A 107 14.782 -0.587 -2.699 1.00 0.00 O ATOM 1652 CB ASP A 107 16.362 -2.940 -2.499 1.00 0.00 C ATOM 1653 CG ASP A 107 17.031 -4.311 -2.283 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.456 -5.358 -2.661 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.144 -4.341 -1.715 1.00 0.00 O ATOM 0 H ASP A 107 16.364 -2.376 -5.279 1.00 0.00 H new ATOM 0 HA ASP A 107 14.483 -3.601 -3.302 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.140 -2.230 -2.780 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.961 -2.610 -1.541 1.00 0.00 H new ATOM 1660 N ILE A 108 13.407 -1.328 -4.330 1.00 0.00 N ATOM 1661 CA ILE A 108 12.378 -0.257 -4.194 1.00 0.00 C ATOM 1662 C ILE A 108 10.959 -0.928 -4.233 1.00 0.00 C ATOM 1663 O ILE A 108 10.814 -2.096 -3.863 1.00 0.00 O ATOM 1664 CB ILE A 108 12.616 0.932 -5.196 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.626 0.519 -6.695 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.838 1.815 -4.852 1.00 0.00 C ATOM 1667 CD1 ILE A 108 11.988 1.558 -7.620 1.00 0.00 C ATOM 0 H ILE A 108 13.235 -1.954 -5.117 1.00 0.00 H new ATOM 0 HA ILE A 108 12.458 0.243 -3.229 1.00 0.00 H new ATOM 0 HB ILE A 108 11.730 1.550 -5.052 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.656 0.348 -7.009 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.097 -0.428 -6.806 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.932 2.611 -5.591 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.704 2.253 -3.863 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.741 1.205 -4.859 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.030 1.203 -8.650 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.948 1.712 -7.332 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.531 2.500 -7.538 1.00 0.00 H new ATOM 1679 N ILE A 109 9.899 -0.203 -4.651 1.00 0.00 N ATOM 1680 CA ILE A 109 8.648 -0.807 -5.178 1.00 0.00 C ATOM 1681 C ILE A 109 7.925 0.306 -5.995 1.00 0.00 C ATOM 1682 O ILE A 109 7.526 1.335 -5.438 1.00 0.00 O ATOM 1683 CB ILE A 109 7.767 -1.544 -4.099 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.867 -2.652 -4.707 1.00 0.00 C ATOM 1685 CG2 ILE A 109 6.970 -0.613 -3.150 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.320 -3.675 -3.700 1.00 0.00 C ATOM 0 H ILE A 109 9.883 0.817 -4.634 1.00 0.00 H new ATOM 0 HA ILE A 109 8.880 -1.643 -5.838 1.00 0.00 H new ATOM 0 HB ILE A 109 8.503 -2.031 -3.460 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.026 -2.178 -5.213 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.437 -3.184 -5.468 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.397 -1.216 -2.446 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.662 0.026 -2.601 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.290 0.007 -3.735 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.704 -4.406 -4.223 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.151 -4.184 -3.211 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.717 -3.162 -2.951 1.00 0.00 H new ATOM 1698 N THR A 110 7.756 0.091 -7.314 1.00 0.00 N ATOM 1699 CA THR A 110 7.021 1.032 -8.200 1.00 0.00 C ATOM 1700 C THR A 110 5.574 0.477 -8.369 1.00 0.00 C ATOM 1701 O THR A 110 5.317 -0.387 -9.214 1.00 0.00 O ATOM 1702 CB THR A 110 7.784 1.207 -9.546 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.132 1.603 -9.315 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.169 2.259 -10.483 1.00 0.00 C ATOM 0 H THR A 110 8.119 -0.730 -7.798 1.00 0.00 H new ATOM 0 HA THR A 110 6.957 2.032 -7.770 1.00 0.00 H new ATOM 0 HB THR A 110 7.719 0.230 -10.025 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.594 1.706 -10.173 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.758 2.320 -11.398 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.146 1.974 -10.729 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.166 3.230 -9.988 1.00 0.00 H new ATOM 1712 N ASN A 111 4.641 0.988 -7.548 1.00 0.00 N ATOM 1713 CA ASN A 111 3.213 0.577 -7.574 1.00 0.00 C ATOM 1714 C ASN A 111 2.434 1.572 -8.476 1.00 0.00 C ATOM 1715 O ASN A 111 2.194 2.723 -8.096 1.00 0.00 O ATOM 1716 CB ASN A 111 2.679 0.491 -6.121 1.00 0.00 C ATOM 1717 CG ASN A 111 1.195 0.090 -5.976 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.772 -0.978 -6.414 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.380 0.940 -5.369 1.00 0.00 N ATOM 0 H ASN A 111 4.848 1.698 -6.845 1.00 0.00 H new ATOM 0 HA ASN A 111 3.081 -0.416 -8.004 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.286 -0.229 -5.572 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.823 1.460 -5.643 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.608 0.711 -5.262 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.741 1.824 -5.009 1.00 0.00 H new ATOM 1726 N THR A 112 2.060 1.087 -9.672 1.00 0.00 N ATOM 1727 CA THR A 112 1.428 1.920 -10.724 1.00 0.00 C ATOM 1728 C THR A 112 -0.088 1.571 -10.776 1.00 0.00 C ATOM 1729 O THR A 112 -0.473 0.549 -11.352 1.00 0.00 O ATOM 1730 CB THR A 112 2.156 1.732 -12.091 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.562 1.926 -11.947 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.685 2.707 -13.184 1.00 0.00 C ATOM 0 H THR A 112 2.184 0.111 -9.942 1.00 0.00 H new ATOM 0 HA THR A 112 1.523 2.980 -10.490 1.00 0.00 H new ATOM 0 HB THR A 112 1.913 0.714 -12.396 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.000 1.802 -12.815 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.236 2.515 -14.105 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.619 2.566 -13.363 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.866 3.732 -12.860 1.00 0.00 H new ATOM 1740 N MET A 113 -0.934 2.436 -10.181 1.00 0.00 N ATOM 1741 CA MET A 113 -2.411 2.255 -10.186 1.00 0.00 C ATOM 1742 C MET A 113 -3.012 3.125 -11.321 1.00 0.00 C ATOM 1743 O MET A 113 -3.162 4.344 -11.182 1.00 0.00 O ATOM 1744 CB MET A 113 -3.040 2.590 -8.809 1.00 0.00 C ATOM 1745 CG MET A 113 -2.756 1.574 -7.691 1.00 0.00 C ATOM 1746 SD MET A 113 -3.565 2.111 -6.169 1.00 0.00 S ATOM 1747 CE MET A 113 -3.515 0.587 -5.205 1.00 0.00 C ATOM 0 H MET A 113 -0.623 3.273 -9.687 1.00 0.00 H new ATOM 0 HA MET A 113 -2.644 1.207 -10.372 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.676 3.567 -8.490 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.119 2.677 -8.933 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.120 0.588 -7.980 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.682 1.483 -7.532 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.460 0.829 -4.144 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.416 0.005 -5.398 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.639 0.005 -5.490 1.00 0.00 H new ATOM 1757 N THR A 114 -3.354 2.480 -12.451 1.00 0.00 N ATOM 1758 CA THR A 114 -3.942 3.171 -13.631 1.00 0.00 C ATOM 1759 C THR A 114 -5.488 3.150 -13.496 1.00 0.00 C ATOM 1760 O THR A 114 -6.110 2.082 -13.518 1.00 0.00 O ATOM 1761 CB THR A 114 -3.463 2.575 -14.989 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.773 1.191 -15.105 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.962 2.750 -15.268 1.00 0.00 C ATOM 0 H THR A 114 -3.235 1.475 -12.580 1.00 0.00 H new ATOM 0 HA THR A 114 -3.590 4.202 -13.641 1.00 0.00 H new ATOM 0 HB THR A 114 -4.013 3.155 -15.730 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.458 0.857 -15.971 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.717 2.306 -16.233 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.716 3.812 -15.284 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.386 2.256 -14.485 1.00 0.00 H new ATOM 1771 N LEU A 115 -6.093 4.344 -13.354 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.556 4.498 -13.154 1.00 0.00 C ATOM 1773 C LEU A 115 -8.254 4.486 -14.540 1.00 0.00 C ATOM 1774 O LEU A 115 -8.356 3.421 -15.157 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.752 5.702 -12.179 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.162 5.914 -11.571 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -9.609 4.756 -10.659 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.202 7.232 -10.774 1.00 0.00 C ATOM 0 H LEU A 115 -5.588 5.230 -13.374 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.067 3.677 -12.652 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.046 5.586 -11.357 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.475 6.613 -12.711 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.856 5.953 -12.410 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -10.604 4.966 -10.266 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.634 3.830 -11.233 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.906 4.652 -9.832 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.197 7.371 -10.351 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.468 7.193 -9.969 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.970 8.065 -11.437 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.684 5.651 -15.032 1.00 0.00 N ATOM 1791 CA GLY A 116 -9.140 5.818 -16.430 1.00 0.00 C ATOM 1792 C GLY A 116 -7.961 6.230 -17.329 1.00 0.00 C ATOM 1793 O GLY A 116 -7.187 5.374 -17.769 1.00 0.00 O ATOM 0 H GLY A 116 -8.729 6.508 -14.480 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.574 4.886 -16.792 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.924 6.574 -16.477 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.811 7.547 -17.540 1.00 0.00 N ATOM 1798 CA ASP A 117 -6.551 8.143 -18.091 1.00 0.00 C ATOM 1799 C ASP A 117 -5.468 8.539 -17.024 1.00 0.00 C ATOM 1800 O ASP A 117 -4.349 8.889 -17.413 1.00 0.00 O ATOM 1801 CB ASP A 117 -6.902 9.375 -18.975 1.00 0.00 C ATOM 1802 CG ASP A 117 -7.658 9.058 -20.275 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -7.010 8.664 -21.270 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -8.901 9.198 -20.303 1.00 0.00 O ATOM 0 H ASP A 117 -8.539 8.233 -17.342 1.00 0.00 H new ATOM 0 HA ASP A 117 -6.088 7.350 -18.679 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.503 10.066 -18.384 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.978 9.894 -19.229 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.771 8.487 -15.708 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.883 8.974 -14.616 1.00 0.00 C ATOM 1811 C ILE A 118 -3.876 7.836 -14.278 1.00 0.00 C ATOM 1812 O ILE A 118 -4.279 6.755 -13.839 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.766 9.398 -13.387 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.710 10.607 -13.700 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.934 9.730 -12.120 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.963 10.698 -12.817 1.00 0.00 C ATOM 0 H ILE A 118 -6.650 8.101 -15.364 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.312 9.854 -14.913 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.375 8.517 -13.184 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.141 11.530 -13.593 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -7.022 10.544 -14.742 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.604 10.015 -11.309 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.358 8.854 -11.823 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.255 10.555 -12.336 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.552 11.567 -13.110 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.561 9.795 -12.940 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.666 10.797 -11.773 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.573 8.120 -14.449 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.490 7.153 -14.125 1.00 0.00 C ATOM 1830 C VAL A 119 -0.883 7.616 -12.767 1.00 0.00 C ATOM 1831 O VAL A 119 -0.003 8.483 -12.731 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.450 7.019 -15.294 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.664 5.993 -14.971 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -1.085 6.624 -16.652 1.00 0.00 C ATOM 0 H VAL A 119 -2.236 9.012 -14.810 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.872 6.138 -14.018 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.026 8.019 -15.387 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.359 5.935 -15.809 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.200 6.308 -14.076 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.218 5.013 -14.801 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.306 6.551 -17.410 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.587 5.661 -16.553 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.810 7.382 -16.949 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.337 6.989 -11.663 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.675 7.102 -10.335 1.00 0.00 C ATOM 1846 C PHE A 120 0.596 6.215 -10.326 1.00 0.00 C ATOM 1847 O PHE A 120 0.553 5.073 -10.790 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.692 6.700 -9.231 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.196 6.780 -7.774 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -1.143 8.008 -7.109 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -0.779 5.621 -7.108 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.664 8.082 -5.803 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -0.315 5.694 -5.799 1.00 0.00 C ATOM 1854 CZ PHE A 120 -0.253 6.924 -5.149 1.00 0.00 C ATOM 0 H PHE A 120 -2.165 6.394 -11.659 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.360 8.126 -10.136 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.570 7.339 -9.328 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.018 5.678 -9.424 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.475 8.905 -7.611 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -0.818 4.667 -7.613 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -0.612 9.036 -5.299 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -0.003 4.796 -5.286 1.00 0.00 H new ATOM 0 HZ PHE A 120 0.115 6.980 -4.135 1.00 0.00 H new ATOM 1864 N LYS A 121 1.708 6.751 -9.800 1.00 0.00 N ATOM 1865 CA LYS A 121 2.978 5.985 -9.681 1.00 0.00 C ATOM 1866 C LYS A 121 3.719 6.422 -8.391 1.00 0.00 C ATOM 1867 O LYS A 121 4.396 7.455 -8.366 1.00 0.00 O ATOM 1868 CB LYS A 121 3.824 6.137 -10.975 1.00 0.00 C ATOM 1869 CG LYS A 121 5.051 5.201 -11.039 1.00 0.00 C ATOM 1870 CD LYS A 121 5.810 5.240 -12.383 1.00 0.00 C ATOM 1871 CE LYS A 121 6.591 6.544 -12.640 1.00 0.00 C ATOM 1872 NZ LYS A 121 7.274 6.520 -13.946 1.00 0.00 N ATOM 0 H LYS A 121 1.763 7.707 -9.449 1.00 0.00 H new ATOM 0 HA LYS A 121 2.777 4.918 -9.584 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.187 5.943 -11.838 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.163 7.170 -11.055 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.740 5.469 -10.238 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.724 4.179 -10.849 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.506 4.402 -12.417 1.00 0.00 H new ATOM 0 HD3 LYS A 121 5.096 5.094 -13.193 1.00 0.00 H new ATOM 0 HE2 LYS A 121 5.907 7.392 -12.602 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.325 6.691 -11.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 7.789 7.413 -14.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.945 5.726 -13.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 6.571 6.405 -14.703 1.00 0.00 H new ATOM 1886 N ARG A 122 3.613 5.590 -7.340 1.00 0.00 N ATOM 1887 CA ARG A 122 4.367 5.779 -6.073 1.00 0.00 C ATOM 1888 C ARG A 122 5.674 4.935 -6.096 1.00 0.00 C ATOM 1889 O ARG A 122 5.652 3.733 -6.377 1.00 0.00 O ATOM 1890 CB ARG A 122 3.486 5.511 -4.822 1.00 0.00 C ATOM 1891 CG ARG A 122 2.928 4.082 -4.610 1.00 0.00 C ATOM 1892 CD ARG A 122 2.153 3.884 -3.291 1.00 0.00 C ATOM 1893 NE ARG A 122 3.065 3.798 -2.120 1.00 0.00 N ATOM 1894 CZ ARG A 122 2.806 4.291 -0.892 1.00 0.00 C ATOM 1895 NH1 ARG A 122 1.686 4.930 -0.563 1.00 0.00 N ATOM 1896 NH2 ARG A 122 3.724 4.132 0.043 1.00 0.00 N ATOM 0 H ARG A 122 3.007 4.769 -7.337 1.00 0.00 H new ATOM 0 HA ARG A 122 4.659 6.826 -5.996 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.071 5.774 -3.941 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.639 6.197 -4.858 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.270 3.836 -5.443 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.757 3.375 -4.639 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.458 4.712 -3.150 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.556 2.974 -3.354 1.00 0.00 H new ATOM 0 HE ARG A 122 3.960 3.328 -2.257 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.956 5.073 -1.261 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.557 5.277 0.387 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.596 3.649 -0.175 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.562 4.492 0.983 1.00 0.00 H new ATOM 1910 N ILE A 123 6.803 5.591 -5.788 1.00 0.00 N ATOM 1911 CA ILE A 123 8.148 4.948 -5.731 1.00 0.00 C ATOM 1912 C ILE A 123 8.509 4.960 -4.220 1.00 0.00 C ATOM 1913 O ILE A 123 8.712 6.033 -3.645 1.00 0.00 O ATOM 1914 CB ILE A 123 9.185 5.698 -6.645 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.810 5.625 -8.159 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.630 5.168 -6.438 1.00 0.00 C ATOM 1917 CD1 ILE A 123 9.567 6.596 -9.081 1.00 0.00 C ATOM 0 H ILE A 123 6.821 6.587 -5.569 1.00 0.00 H new ATOM 0 HA ILE A 123 8.159 3.931 -6.123 1.00 0.00 H new ATOM 0 HB ILE A 123 9.148 6.743 -6.337 1.00 0.00 H new ATOM 0 HG12 ILE A 123 8.986 4.608 -8.510 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.742 5.816 -8.259 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.314 5.713 -7.088 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.925 5.312 -5.399 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.666 4.106 -6.682 1.00 0.00 H new ATOM 0 HD11 ILE A 123 9.229 6.460 -10.108 1.00 0.00 H new ATOM 0 HD12 ILE A 123 9.373 7.622 -8.767 1.00 0.00 H new ATOM 0 HD13 ILE A 123 10.637 6.395 -9.021 1.00 0.00 H new ATOM 1929 N SER A 124 8.573 3.769 -3.595 1.00 0.00 N ATOM 1930 CA SER A 124 8.739 3.647 -2.122 1.00 0.00 C ATOM 1931 C SER A 124 9.865 2.625 -1.808 1.00 0.00 C ATOM 1932 O SER A 124 9.771 1.447 -2.159 1.00 0.00 O ATOM 1933 CB SER A 124 7.396 3.234 -1.475 1.00 0.00 C ATOM 1934 OG SER A 124 6.365 4.174 -1.756 1.00 0.00 O ATOM 0 H SER A 124 8.513 2.874 -4.081 1.00 0.00 H new ATOM 0 HA SER A 124 9.030 4.609 -1.700 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.102 2.251 -1.843 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.524 3.146 -0.396 1.00 0.00 H new ATOM 0 HG SER A 124 6.132 4.658 -0.937 1.00 0.00 H new ATOM 1940 N LYS A 125 10.939 3.091 -1.150 1.00 0.00 N ATOM 1941 CA LYS A 125 12.214 2.345 -1.026 1.00 0.00 C ATOM 1942 C LYS A 125 12.181 1.248 0.073 1.00 0.00 C ATOM 1943 O LYS A 125 11.829 1.528 1.222 1.00 0.00 O ATOM 1944 CB LYS A 125 13.329 3.395 -0.790 1.00 0.00 C ATOM 1945 CG LYS A 125 14.767 2.854 -0.918 1.00 0.00 C ATOM 1946 CD LYS A 125 15.840 3.964 -0.877 1.00 0.00 C ATOM 1947 CE LYS A 125 17.033 3.682 -1.809 1.00 0.00 C ATOM 1948 NZ LYS A 125 18.003 4.793 -1.785 1.00 0.00 N ATOM 0 H LYS A 125 10.953 3.999 -0.685 1.00 0.00 H new ATOM 0 HA LYS A 125 12.405 1.785 -1.942 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.198 4.209 -1.503 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.203 3.820 0.206 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.955 2.146 -0.111 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.859 2.303 -1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.384 4.913 -1.157 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.202 4.074 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.526 2.759 -1.504 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.675 3.531 -2.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.796 4.575 -2.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 17.537 5.668 -2.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 18.361 4.920 -0.817 1.00 0.00 H new ATOM 1962 N ARG A 126 12.603 0.016 -0.284 1.00 0.00 N ATOM 1963 CA ARG A 126 12.625 -1.136 0.644 1.00 0.00 C ATOM 1964 C ARG A 126 13.781 -1.003 1.676 1.00 0.00 C ATOM 1965 O ARG A 126 14.959 -0.925 1.306 1.00 0.00 O ATOM 1966 CB ARG A 126 12.748 -2.429 -0.204 1.00 0.00 C ATOM 1967 CG ARG A 126 12.397 -3.697 0.595 1.00 0.00 C ATOM 1968 CD ARG A 126 12.358 -5.000 -0.227 1.00 0.00 C ATOM 1969 NE ARG A 126 13.700 -5.570 -0.515 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.382 -6.389 0.316 1.00 0.00 C ATOM 1971 NH1 ARG A 126 13.936 -6.786 1.506 1.00 0.00 N ATOM 1972 NH2 ARG A 126 15.566 -6.823 -0.071 1.00 0.00 N ATOM 0 H ARG A 126 12.937 -0.208 -1.221 1.00 0.00 H new ATOM 0 HA ARG A 126 11.704 -1.171 1.226 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.089 -2.355 -1.069 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.766 -2.514 -0.584 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.125 -3.814 1.398 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.424 -3.553 1.065 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.767 -5.741 0.312 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.845 -4.808 -1.170 1.00 0.00 H new ATOM 0 HE ARG A 126 14.138 -5.326 -1.403 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.026 -6.470 1.841 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.504 -7.406 2.083 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.943 -6.539 -0.975 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.105 -7.442 0.534 1.00 0.00 H new ATOM 1986 N ILE A 127 13.400 -0.946 2.962 1.00 0.00 N ATOM 1987 CA ILE A 127 14.326 -0.608 4.076 1.00 0.00 C ATOM 1988 C ILE A 127 14.100 -1.598 5.235 1.00 0.00 C ATOM 1989 O ILE A 127 12.989 -1.822 5.720 1.00 0.00 O ATOM 1990 CB ILE A 127 14.266 0.902 4.510 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.859 1.411 4.951 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.870 1.816 3.414 1.00 0.00 C ATOM 1993 CD1 ILE A 127 12.845 2.750 5.699 1.00 0.00 C ATOM 0 H ILE A 127 12.445 -1.131 3.268 1.00 0.00 H new ATOM 0 HA ILE A 127 15.350 -0.723 3.722 1.00 0.00 H new ATOM 0 HB ILE A 127 14.876 0.959 5.412 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.231 1.503 4.065 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.401 0.654 5.588 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.817 2.856 3.737 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.911 1.541 3.244 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.307 1.695 2.488 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.819 3.011 5.959 1.00 0.00 H new ATOM 0 HD12 ILE A 127 13.439 2.665 6.609 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.267 3.527 5.062 1.00 0.00 H new