USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 747 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 11 LYS NZ :NH3+ -149:sc= 0.894 (180deg=0) USER MOD Set 1.2: A 79 SER OG : rot 104:sc= 2.02 USER MOD Single : A 1 GLY N :NH3+ 170:sc= -0.16 (180deg=-0.263) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 150:sc= 0 (180deg=-0.262) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= 0.547 K(o=0.55,f=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.89 K(o=1.9,f=-3.7!) USER MOD Single : A 20 SER OG : rot -140:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00494 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -129:sc= -0.265 (180deg=-0.856) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 78:sc= 1.35 USER MOD Single : A 40 GLN : amide:sc= 0.00547 X(o=0.0055,f=0) USER MOD Single : A 48 CYS SG : rot 59:sc= 0.0768 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.068 X(o=-0.068,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.018) USER MOD Single : A 60 ASN : amide:sc= 0.537 K(o=0.54,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -166:sc= 1.1 (180deg=0.925) USER MOD Single : A 72 LYS NZ :NH3+ 164:sc= 1.37 (180deg=1.17) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 62:sc= 0.163 USER MOD Single : A 91 LYS NZ :NH3+ 142:sc= 1.32 (180deg=0.546) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.846 6.242 -5.202 1.00 25.00 N ATOM 2 CA GLY A 1 3.374 5.906 -6.562 1.00 25.00 C ATOM 3 C GLY A 1 4.878 5.744 -6.601 1.00 25.00 C ATOM 4 O GLY A 1 5.550 5.768 -7.607 1.00 25.00 O ATOM 0 H1 GLY A 1 1.842 6.504 -5.274 1.00 25.00 H new ATOM 0 H2 GLY A 1 2.944 5.416 -4.578 1.00 25.00 H new ATOM 0 H3 GLY A 1 3.385 7.039 -4.808 1.00 25.00 H new ATOM 0 HA2 GLY A 1 2.908 4.983 -6.906 1.00 25.00 H new ATOM 0 HA3 GLY A 1 3.082 6.690 -7.261 1.00 25.00 H new ATOM 9 N SER A 2 5.422 5.610 -5.396 1.00 25.00 N ATOM 10 CA SER A 2 6.857 5.453 -5.169 1.00 25.00 C ATOM 11 C SER A 2 7.081 4.571 -3.951 1.00 25.00 C ATOM 12 O SER A 2 6.176 4.381 -3.145 1.00 25.00 O ATOM 13 CB SER A 2 7.505 6.818 -4.946 1.00 25.00 C ATOM 14 OG SER A 2 7.341 7.636 -6.090 1.00 25.00 O ATOM 0 H SER A 2 4.872 5.607 -4.537 1.00 25.00 H new ATOM 0 HA SER A 2 7.311 4.988 -6.044 1.00 25.00 H new ATOM 0 HB2 SER A 2 7.058 7.302 -4.078 1.00 25.00 H new ATOM 0 HB3 SER A 2 8.566 6.693 -4.730 1.00 25.00 H new ATOM 0 HG SER A 2 7.760 8.508 -5.932 1.00 25.00 H new ATOM 20 N MET A 3 8.289 4.046 -3.815 1.00 25.00 N ATOM 21 CA MET A 3 8.636 3.165 -2.705 1.00 25.00 C ATOM 22 C MET A 3 9.963 3.631 -2.116 1.00 25.00 C ATOM 23 O MET A 3 10.780 4.225 -2.819 1.00 25.00 O ATOM 24 CB MET A 3 8.743 1.721 -3.223 1.00 25.00 C ATOM 25 CG MET A 3 8.967 0.664 -2.141 1.00 25.00 C ATOM 26 SD MET A 3 8.908 -1.011 -2.811 1.00 25.00 S ATOM 27 CE MET A 3 10.477 -1.131 -3.707 1.00 25.00 C ATOM 0 H MET A 3 9.055 4.216 -4.467 1.00 25.00 H new ATOM 0 HA MET A 3 7.871 3.197 -1.930 1.00 25.00 H new ATOM 0 HB2 MET A 3 7.830 1.477 -3.766 1.00 25.00 H new ATOM 0 HB3 MET A 3 9.563 1.667 -3.939 1.00 25.00 H new ATOM 0 HG2 MET A 3 9.934 0.831 -1.666 1.00 25.00 H new ATOM 0 HG3 MET A 3 8.208 0.772 -1.366 1.00 25.00 H new ATOM 0 HE1 MET A 3 10.820 -2.166 -3.703 1.00 25.00 H new ATOM 0 HE2 MET A 3 10.335 -0.799 -4.736 1.00 25.00 H new ATOM 0 HE3 MET A 3 11.222 -0.500 -3.222 1.00 25.00 H new ATOM 37 N LYS A 4 10.177 3.352 -0.838 1.00 25.00 N ATOM 38 CA LYS A 4 11.449 3.623 -0.172 1.00 25.00 C ATOM 39 C LYS A 4 11.880 2.266 0.334 1.00 25.00 C ATOM 40 O LYS A 4 11.019 1.497 0.748 1.00 25.00 O ATOM 41 CB LYS A 4 11.267 4.601 1.000 1.00 25.00 C ATOM 42 CG LYS A 4 10.721 5.981 0.605 1.00 25.00 C ATOM 43 CD LYS A 4 11.675 6.745 -0.313 1.00 25.00 C ATOM 44 CE LYS A 4 11.133 8.137 -0.614 1.00 25.00 C ATOM 45 NZ LYS A 4 12.039 8.880 -1.557 1.00 25.00 N ATOM 0 H LYS A 4 9.474 2.931 -0.230 1.00 25.00 H new ATOM 0 HA LYS A 4 12.178 4.086 -0.837 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.591 4.153 1.728 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.228 4.734 1.497 1.00 25.00 H new ATOM 0 HG2 LYS A 4 9.760 5.859 0.105 1.00 25.00 H new ATOM 0 HG3 LYS A 4 10.540 6.568 1.505 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.655 6.825 0.158 1.00 25.00 H new ATOM 0 HD3 LYS A 4 11.812 6.194 -1.243 1.00 25.00 H new ATOM 0 HE2 LYS A 4 10.137 8.056 -1.050 1.00 25.00 H new ATOM 0 HE3 LYS A 4 11.030 8.699 0.314 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 11.646 9.824 -1.744 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 12.982 8.976 -1.129 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 12.117 8.354 -2.451 1.00 25.00 H new ATOM 59 N TYR A 5 13.180 1.990 0.278 1.00 25.00 N ATOM 60 CA TYR A 5 13.775 0.705 0.650 1.00 25.00 C ATOM 61 C TYR A 5 13.275 -0.515 -0.148 1.00 25.00 C ATOM 62 O TYR A 5 12.300 -0.447 -0.892 1.00 25.00 O ATOM 63 CB TYR A 5 13.613 0.479 2.149 1.00 25.00 C ATOM 64 CG TYR A 5 14.460 1.405 2.995 1.00 25.00 C ATOM 65 CD1 TYR A 5 13.881 2.169 4.029 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.855 1.508 2.785 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.681 3.020 4.839 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.649 2.358 3.588 1.00 25.00 C ATOM 69 CZ TYR A 5 16.059 3.103 4.609 1.00 25.00 C ATOM 70 OH TYR A 5 16.835 3.917 5.392 1.00 25.00 O ATOM 0 H TYR A 5 13.870 2.672 -0.036 1.00 25.00 H new ATOM 0 HA TYR A 5 14.829 0.783 0.384 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.565 0.612 2.417 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.873 -0.553 2.383 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.818 2.107 4.208 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.320 0.929 2.000 1.00 25.00 H new ATOM 0 HE1 TYR A 5 14.227 3.600 5.629 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.712 2.431 3.411 1.00 25.00 H new ATOM 0 HH TYR A 5 17.769 3.858 5.101 1.00 25.00 H new ATOM 80 N LEU A 6 14.006 -1.614 -0.030 1.00 25.00 N ATOM 81 CA LEU A 6 13.724 -2.840 -0.781 1.00 25.00 C ATOM 82 C LEU A 6 12.486 -3.565 -0.244 1.00 25.00 C ATOM 83 O LEU A 6 11.652 -4.041 -1.015 1.00 25.00 O ATOM 84 CB LEU A 6 14.928 -3.794 -0.692 1.00 25.00 C ATOM 85 CG LEU A 6 16.302 -3.316 -1.189 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.360 -4.380 -0.853 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.303 -3.043 -2.688 1.00 25.00 C ATOM 0 H LEU A 6 14.814 -1.686 0.589 1.00 25.00 H new ATOM 0 HA LEU A 6 13.537 -2.552 -1.815 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.040 -4.085 0.353 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.674 -4.696 -1.248 1.00 25.00 H new ATOM 0 HG LEU A 6 16.536 -2.378 -0.686 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.336 -4.046 -1.204 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.394 -4.531 0.226 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.101 -5.319 -1.343 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.293 -2.708 -2.996 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.046 -3.956 -3.224 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.570 -2.269 -2.917 1.00 25.00 H new ATOM 99 N ASN A 7 12.388 -3.640 1.082 1.00 25.00 N ATOM 100 CA ASN A 7 11.276 -4.302 1.789 1.00 25.00 C ATOM 101 C ASN A 7 11.066 -5.760 1.355 1.00 25.00 C ATOM 102 O ASN A 7 9.972 -6.147 0.926 1.00 25.00 O ATOM 103 CB ASN A 7 9.979 -3.509 1.615 1.00 25.00 C ATOM 104 CG ASN A 7 10.094 -2.108 2.111 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.080 -1.858 3.300 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.212 -1.186 1.207 1.00 25.00 N ATOM 0 H ASN A 7 13.084 -3.240 1.710 1.00 25.00 H new ATOM 0 HA ASN A 7 11.553 -4.323 2.843 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.704 -3.496 0.560 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.174 -4.015 2.148 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.298 -0.208 1.484 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.219 -1.439 0.219 1.00 25.00 H new ATOM 113 N VAL A 8 12.115 -6.565 1.479 1.00 25.00 N ATOM 114 CA VAL A 8 12.064 -7.990 1.127 1.00 25.00 C ATOM 115 C VAL A 8 12.217 -8.782 2.422 1.00 25.00 C ATOM 116 O VAL A 8 12.690 -8.245 3.406 1.00 25.00 O ATOM 117 CB VAL A 8 13.178 -8.371 0.075 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.704 -7.134 -0.640 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.351 -9.126 0.697 1.00 25.00 C ATOM 0 H VAL A 8 13.024 -6.256 1.824 1.00 25.00 H new ATOM 0 HA VAL A 8 11.113 -8.227 0.650 1.00 25.00 H new ATOM 0 HB VAL A 8 12.694 -9.035 -0.641 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.470 -7.427 -1.358 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.885 -6.641 -1.164 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.134 -6.448 0.089 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.084 -9.360 -0.075 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.817 -8.507 1.463 1.00 25.00 H new ATOM 0 HG23 VAL A 8 13.991 -10.051 1.147 1.00 25.00 H new ATOM 129 N LEU A 9 11.821 -10.045 2.438 1.00 25.00 N ATOM 130 CA LEU A 9 11.967 -10.862 3.646 1.00 25.00 C ATOM 131 C LEU A 9 13.235 -11.706 3.567 1.00 25.00 C ATOM 132 O LEU A 9 13.584 -12.218 2.500 1.00 25.00 O ATOM 133 CB LEU A 9 10.754 -11.781 3.825 1.00 25.00 C ATOM 134 CG LEU A 9 9.386 -11.092 3.981 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.308 -12.159 4.163 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.361 -10.125 5.168 1.00 25.00 C ATOM 0 H LEU A 9 11.401 -10.527 1.643 1.00 25.00 H new ATOM 0 HA LEU A 9 12.035 -10.190 4.502 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.703 -12.450 2.966 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.924 -12.403 4.703 1.00 25.00 H new ATOM 0 HG LEU A 9 9.197 -10.508 3.080 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.336 -11.679 4.274 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.292 -12.813 3.291 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.526 -12.748 5.054 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.377 -9.662 5.240 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.573 -10.672 6.087 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.116 -9.352 5.024 1.00 25.00 H new ATOM 148 N ALA A 10 13.908 -11.873 4.697 1.00 25.00 N ATOM 149 CA ALA A 10 15.101 -12.713 4.776 1.00 25.00 C ATOM 150 C ALA A 10 15.058 -13.563 6.044 1.00 25.00 C ATOM 151 O ALA A 10 14.551 -13.112 7.064 1.00 25.00 O ATOM 152 CB ALA A 10 16.346 -11.842 4.759 1.00 25.00 C ATOM 0 H ALA A 10 13.647 -11.435 5.580 1.00 25.00 H new ATOM 0 HA ALA A 10 15.129 -13.379 3.914 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.233 -12.473 4.818 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.373 -11.264 3.835 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.327 -11.163 5.611 1.00 25.00 H new ATOM 158 N LYS A 11 15.586 -14.782 5.969 1.00 25.00 N ATOM 159 CA LYS A 11 15.620 -15.703 7.110 1.00 25.00 C ATOM 160 C LYS A 11 17.032 -15.853 7.647 1.00 25.00 C ATOM 161 O LYS A 11 17.986 -15.973 6.878 1.00 25.00 O ATOM 162 CB LYS A 11 15.106 -17.087 6.699 1.00 25.00 C ATOM 163 CG LYS A 11 15.138 -18.134 7.827 1.00 25.00 C ATOM 164 CD LYS A 11 14.315 -19.389 7.516 1.00 25.00 C ATOM 165 CE LYS A 11 12.806 -19.123 7.667 1.00 25.00 C ATOM 166 NZ LYS A 11 11.956 -20.365 7.755 1.00 25.00 N ATOM 0 H LYS A 11 16.002 -15.162 5.119 1.00 25.00 H new ATOM 0 HA LYS A 11 14.979 -15.284 7.886 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.082 -16.989 6.339 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.705 -17.451 5.864 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.172 -18.424 8.014 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.763 -17.680 8.744 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.527 -19.723 6.500 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.612 -20.196 8.185 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.644 -18.523 8.563 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.469 -18.527 6.819 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.021 -20.176 7.341 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.416 -21.138 7.233 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 11.844 -20.639 8.752 1.00 25.00 H new ATOM 180 N ALA A 12 17.149 -15.903 8.960 1.00 25.00 N ATOM 181 CA ALA A 12 18.418 -16.129 9.629 1.00 25.00 C ATOM 182 C ALA A 12 18.837 -17.598 9.510 1.00 25.00 C ATOM 183 O ALA A 12 18.064 -18.492 9.846 1.00 25.00 O ATOM 184 CB ALA A 12 18.264 -15.738 11.083 1.00 25.00 C ATOM 0 H ALA A 12 16.361 -15.787 9.598 1.00 25.00 H new ATOM 0 HA ALA A 12 19.196 -15.525 9.161 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.207 -15.900 11.605 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.989 -14.685 11.150 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.485 -16.347 11.543 1.00 25.00 H new ATOM 190 N LEU A 13 20.060 -17.852 9.060 1.00 25.00 N ATOM 191 CA LEU A 13 20.583 -19.221 8.995 1.00 25.00 C ATOM 192 C LEU A 13 21.254 -19.572 10.300 1.00 25.00 C ATOM 193 O LEU A 13 21.527 -20.734 10.569 1.00 25.00 O ATOM 194 CB LEU A 13 21.646 -19.367 7.909 1.00 25.00 C ATOM 195 CG LEU A 13 21.308 -19.201 6.432 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.876 -19.626 6.080 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.567 -17.788 5.998 1.00 25.00 C ATOM 0 H LEU A 13 20.709 -17.135 8.735 1.00 25.00 H new ATOM 0 HA LEU A 13 19.737 -19.874 8.781 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.431 -18.646 8.136 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.081 -20.360 8.024 1.00 25.00 H new ATOM 0 HG LEU A 13 21.964 -19.877 5.884 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.705 -19.481 5.013 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.737 -20.678 6.330 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.167 -19.022 6.646 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.322 -17.681 4.941 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.949 -17.108 6.584 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.619 -17.547 6.153 1.00 25.00 H new ATOM 209 N TYR A 14 21.562 -18.549 11.076 1.00 25.00 N ATOM 210 CA TYR A 14 22.275 -18.697 12.335 1.00 25.00 C ATOM 211 C TYR A 14 21.777 -17.641 13.289 1.00 25.00 C ATOM 212 O TYR A 14 21.127 -16.690 12.868 1.00 25.00 O ATOM 213 CB TYR A 14 23.772 -18.487 12.127 1.00 25.00 C ATOM 214 CG TYR A 14 24.375 -19.437 11.125 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.529 -19.056 9.778 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.788 -20.727 11.511 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.068 -19.953 8.828 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.344 -21.621 10.566 1.00 25.00 C ATOM 219 CZ TYR A 14 25.475 -21.229 9.233 1.00 25.00 C ATOM 220 OH TYR A 14 26.002 -22.096 8.316 1.00 25.00 O ATOM 0 H TYR A 14 21.323 -17.584 10.850 1.00 25.00 H new ATOM 0 HA TYR A 14 22.104 -19.699 12.729 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.945 -17.463 11.796 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.284 -18.604 13.082 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.231 -18.066 9.467 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.679 -21.037 12.540 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.165 -19.655 7.794 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.666 -22.604 10.875 1.00 25.00 H new ATOM 0 HH TYR A 14 26.235 -22.939 8.759 1.00 25.00 H new ATOM 230 N ASP A 15 22.124 -17.783 14.554 1.00 25.00 N ATOM 231 CA ASP A 15 21.823 -16.763 15.549 1.00 25.00 C ATOM 232 C ASP A 15 22.720 -15.566 15.281 1.00 25.00 C ATOM 233 O ASP A 15 23.811 -15.705 14.712 1.00 25.00 O ATOM 234 CB ASP A 15 22.128 -17.272 16.962 1.00 25.00 C ATOM 235 CG ASP A 15 21.073 -18.220 17.490 1.00 25.00 C ATOM 236 OD1 ASP A 15 20.420 -18.930 16.693 1.00 25.00 O ATOM 237 OD2 ASP A 15 20.881 -18.251 18.719 1.00 25.00 O ATOM 0 H ASP A 15 22.617 -18.597 14.921 1.00 25.00 H new ATOM 0 HA ASP A 15 20.766 -16.503 15.483 1.00 25.00 H new ATOM 0 HB2 ASP A 15 23.094 -17.777 16.960 1.00 25.00 H new ATOM 0 HB3 ASP A 15 22.215 -16.421 17.638 1.00 25.00 H new ATOM 242 N ASN A 16 22.307 -14.407 15.761 1.00 25.00 N ATOM 243 CA ASN A 16 23.160 -13.231 15.734 1.00 25.00 C ATOM 244 C ASN A 16 23.024 -12.488 17.041 1.00 25.00 C ATOM 245 O ASN A 16 21.917 -12.248 17.516 1.00 25.00 O ATOM 246 CB ASN A 16 22.812 -12.288 14.587 1.00 25.00 C ATOM 247 CG ASN A 16 23.923 -11.315 14.315 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.038 -11.727 14.027 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.658 -10.051 14.446 1.00 25.00 N ATOM 0 H ASN A 16 21.387 -14.254 16.174 1.00 25.00 H new ATOM 0 HA ASN A 16 24.184 -13.572 15.584 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.607 -12.868 13.687 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.900 -11.742 14.828 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.394 -9.359 14.308 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.714 -9.750 14.687 1.00 25.00 H new ATOM 256 N VAL A 17 24.154 -12.094 17.597 1.00 25.00 N ATOM 257 CA VAL A 17 24.187 -11.306 18.809 1.00 25.00 C ATOM 258 C VAL A 17 24.651 -9.948 18.342 1.00 25.00 C ATOM 259 O VAL A 17 25.647 -9.834 17.629 1.00 25.00 O ATOM 260 CB VAL A 17 25.160 -11.904 19.862 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.223 -11.017 21.116 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.701 -13.325 20.249 1.00 25.00 C ATOM 0 H VAL A 17 25.075 -12.313 17.218 1.00 25.00 H new ATOM 0 HA VAL A 17 23.219 -11.274 19.308 1.00 25.00 H new ATOM 0 HB VAL A 17 26.157 -11.950 19.423 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.911 -11.457 21.838 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.573 -10.022 20.841 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.230 -10.942 21.559 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.387 -13.740 20.988 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.697 -13.281 20.670 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.695 -13.959 19.363 1.00 25.00 H new ATOM 272 N ALA A 18 23.878 -8.936 18.687 1.00 25.00 N ATOM 273 CA ALA A 18 24.187 -7.574 18.308 1.00 25.00 C ATOM 274 C ALA A 18 25.300 -7.086 19.225 1.00 25.00 C ATOM 275 O ALA A 18 25.132 -7.038 20.442 1.00 25.00 O ATOM 276 CB ALA A 18 22.948 -6.708 18.441 1.00 25.00 C ATOM 0 H ALA A 18 23.023 -9.035 19.235 1.00 25.00 H new ATOM 0 HA ALA A 18 24.513 -7.519 17.269 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.187 -5.684 18.154 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.163 -7.093 17.790 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.602 -6.724 19.475 1.00 25.00 H new ATOM 282 N GLU A 19 26.443 -6.783 18.637 1.00 25.00 N ATOM 283 CA GLU A 19 27.619 -6.355 19.393 1.00 25.00 C ATOM 284 C GLU A 19 27.807 -4.857 19.231 1.00 25.00 C ATOM 285 O GLU A 19 28.449 -4.200 20.041 1.00 25.00 O ATOM 286 CB GLU A 19 28.847 -7.119 18.896 1.00 25.00 C ATOM 287 CG GLU A 19 28.744 -8.609 19.202 1.00 25.00 C ATOM 288 CD GLU A 19 29.946 -9.409 18.727 1.00 25.00 C ATOM 289 OE1 GLU A 19 29.823 -10.083 17.673 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.984 -9.414 19.411 1.00 25.00 O ATOM 0 H GLU A 19 26.588 -6.824 17.628 1.00 25.00 H new ATOM 0 HA GLU A 19 27.482 -6.572 20.452 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.955 -6.975 17.821 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.743 -6.712 19.364 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.629 -8.744 20.278 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.844 -9.007 18.733 1.00 25.00 H new ATOM 297 N SER A 20 27.190 -4.319 18.192 1.00 25.00 N ATOM 298 CA SER A 20 27.186 -2.883 17.946 1.00 25.00 C ATOM 299 C SER A 20 25.789 -2.358 18.222 1.00 25.00 C ATOM 300 O SER A 20 24.806 -3.086 18.071 1.00 25.00 O ATOM 301 CB SER A 20 27.597 -2.607 16.504 1.00 25.00 C ATOM 302 OG SER A 20 28.938 -3.007 16.313 1.00 25.00 O ATOM 0 H SER A 20 26.679 -4.862 17.496 1.00 25.00 H new ATOM 0 HA SER A 20 27.898 -2.379 18.600 1.00 25.00 H new ATOM 0 HB2 SER A 20 26.944 -3.147 15.819 1.00 25.00 H new ATOM 0 HB3 SER A 20 27.487 -1.546 16.280 1.00 25.00 H new ATOM 0 HG SER A 20 29.398 -2.352 15.748 1.00 25.00 H new ATOM 308 N PRO A 21 25.671 -1.084 18.621 1.00 25.00 N ATOM 309 CA PRO A 21 24.345 -0.548 18.948 1.00 25.00 C ATOM 310 C PRO A 21 23.431 -0.382 17.737 1.00 25.00 C ATOM 311 O PRO A 21 22.224 -0.224 17.892 1.00 25.00 O ATOM 312 CB PRO A 21 24.678 0.801 19.589 1.00 25.00 C ATOM 313 CG PRO A 21 25.965 1.195 18.955 1.00 25.00 C ATOM 314 CD PRO A 21 26.727 -0.073 18.828 1.00 25.00 C ATOM 0 HA PRO A 21 23.781 -1.222 19.593 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.897 1.537 19.397 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.776 0.715 20.671 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.802 1.658 17.982 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.502 1.920 19.567 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.424 -0.042 17.990 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.314 -0.281 19.723 1.00 25.00 H new ATOM 322 N ASP A 22 23.991 -0.455 16.538 1.00 25.00 N ATOM 323 CA ASP A 22 23.208 -0.325 15.317 1.00 25.00 C ATOM 324 C ASP A 22 22.864 -1.693 14.766 1.00 25.00 C ATOM 325 O ASP A 22 22.265 -1.790 13.722 1.00 25.00 O ATOM 326 CB ASP A 22 24.005 0.448 14.255 1.00 25.00 C ATOM 327 CG ASP A 22 23.349 1.770 13.877 1.00 25.00 C ATOM 328 OD1 ASP A 22 22.698 2.391 14.747 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.469 2.176 12.700 1.00 25.00 O ATOM 0 H ASP A 22 24.988 -0.604 16.384 1.00 25.00 H new ATOM 0 HA ASP A 22 22.292 0.216 15.556 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.011 0.640 14.629 1.00 25.00 H new ATOM 0 HB3 ASP A 22 24.109 -0.170 13.363 1.00 25.00 H new ATOM 334 N GLU A 23 23.276 -2.756 15.440 1.00 25.00 N ATOM 335 CA GLU A 23 23.077 -4.112 14.937 1.00 25.00 C ATOM 336 C GLU A 23 21.809 -4.750 15.525 1.00 25.00 C ATOM 337 O GLU A 23 21.360 -4.382 16.613 1.00 25.00 O ATOM 338 CB GLU A 23 24.321 -4.947 15.280 1.00 25.00 C ATOM 339 CG GLU A 23 24.413 -6.272 14.541 1.00 25.00 C ATOM 340 CD GLU A 23 25.654 -7.064 14.891 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.428 -6.653 15.789 1.00 25.00 O ATOM 342 OE2 GLU A 23 25.838 -8.146 14.293 1.00 25.00 O ATOM 0 H GLU A 23 23.752 -2.708 16.341 1.00 25.00 H new ATOM 0 HA GLU A 23 22.940 -4.078 13.856 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.211 -4.358 15.057 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.328 -5.142 16.352 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.531 -6.870 14.770 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.401 -6.084 13.467 1.00 25.00 H new ATOM 349 N LEU A 24 21.240 -5.712 14.811 1.00 25.00 N ATOM 350 CA LEU A 24 20.091 -6.473 15.307 1.00 25.00 C ATOM 351 C LEU A 24 20.507 -7.825 15.850 1.00 25.00 C ATOM 352 O LEU A 24 21.379 -8.492 15.300 1.00 25.00 O ATOM 353 CB LEU A 24 19.072 -6.726 14.197 1.00 25.00 C ATOM 354 CG LEU A 24 18.265 -5.508 13.736 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.348 -5.906 12.591 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.453 -4.915 14.889 1.00 25.00 C ATOM 0 H LEU A 24 21.554 -5.988 13.881 1.00 25.00 H new ATOM 0 HA LEU A 24 19.651 -5.869 16.100 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.598 -7.136 13.335 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.375 -7.491 14.539 1.00 25.00 H new ATOM 0 HG LEU A 24 18.960 -4.742 13.391 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.775 -5.038 12.265 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.945 -6.280 11.759 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.665 -6.686 12.926 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.891 -4.052 14.532 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.762 -5.666 15.271 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.127 -4.604 15.687 1.00 25.00 H new ATOM 368 N SER A 25 19.821 -8.254 16.894 1.00 25.00 N ATOM 369 CA SER A 25 20.027 -9.560 17.476 1.00 25.00 C ATOM 370 C SER A 25 18.805 -10.396 17.151 1.00 25.00 C ATOM 371 O SER A 25 17.671 -9.928 17.242 1.00 25.00 O ATOM 372 CB SER A 25 20.210 -9.438 18.988 1.00 25.00 C ATOM 373 OG SER A 25 19.253 -8.545 19.535 1.00 25.00 O ATOM 0 H SER A 25 19.103 -7.701 17.361 1.00 25.00 H new ATOM 0 HA SER A 25 20.925 -10.028 17.073 1.00 25.00 H new ATOM 0 HB2 SER A 25 20.108 -10.419 19.453 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.216 -9.083 19.211 1.00 25.00 H new ATOM 0 HG SER A 25 19.383 -8.480 20.504 1.00 25.00 H new ATOM 379 N PHE A 26 19.056 -11.623 16.737 1.00 25.00 N ATOM 380 CA PHE A 26 17.995 -12.571 16.378 1.00 25.00 C ATOM 381 C PHE A 26 18.442 -14.029 16.496 1.00 25.00 C ATOM 382 O PHE A 26 19.622 -14.322 16.677 1.00 25.00 O ATOM 383 CB PHE A 26 17.486 -12.293 14.958 1.00 25.00 C ATOM 384 CG PHE A 26 18.561 -12.236 13.914 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.198 -13.406 13.454 1.00 25.00 C ATOM 386 CD2 PHE A 26 18.910 -11.003 13.344 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.165 -13.342 12.417 1.00 25.00 C ATOM 388 CE2 PHE A 26 19.857 -10.931 12.315 1.00 25.00 C ATOM 389 CZ PHE A 26 20.481 -12.108 11.835 1.00 25.00 C ATOM 0 H PHE A 26 19.998 -12.000 16.637 1.00 25.00 H new ATOM 0 HA PHE A 26 17.186 -12.422 17.093 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.771 -13.068 14.683 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.946 -11.346 14.958 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.948 -14.360 13.895 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.443 -10.098 13.703 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.656 -14.242 12.078 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.113 -9.974 11.886 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.195 -12.055 11.026 1.00 25.00 H new ATOM 399 N ARG A 27 17.480 -14.934 16.386 1.00 25.00 N ATOM 400 CA ARG A 27 17.697 -16.376 16.507 1.00 25.00 C ATOM 401 C ARG A 27 17.653 -17.007 15.114 1.00 25.00 C ATOM 402 O ARG A 27 17.005 -16.491 14.204 1.00 25.00 O ATOM 403 CB ARG A 27 16.561 -16.934 17.399 1.00 25.00 C ATOM 404 CG ARG A 27 16.551 -18.447 17.701 1.00 25.00 C ATOM 405 CD ARG A 27 17.659 -18.864 18.653 1.00 25.00 C ATOM 406 NE ARG A 27 17.505 -20.267 19.086 1.00 25.00 N ATOM 407 CZ ARG A 27 18.485 -21.047 19.537 1.00 25.00 C ATOM 408 NH1 ARG A 27 19.728 -20.654 19.617 1.00 25.00 N ATOM 409 NH2 ARG A 27 18.201 -22.264 19.911 1.00 25.00 N ATOM 0 H ARG A 27 16.507 -14.686 16.207 1.00 25.00 H new ATOM 0 HA ARG A 27 18.666 -16.602 16.951 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.594 -16.404 18.351 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.612 -16.682 16.926 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.587 -18.721 18.130 1.00 25.00 H new ATOM 0 HG3 ARG A 27 16.653 -19.000 16.767 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.625 -18.737 18.165 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.655 -18.211 19.526 1.00 25.00 H new ATOM 0 HE ARG A 27 16.570 -20.672 19.035 1.00 25.00 H new ATOM 0 HH11 ARG A 27 19.984 -19.710 19.326 1.00 25.00 H new ATOM 0 HH12 ARG A 27 20.442 -21.291 19.970 1.00 25.00 H new ATOM 0 HH21 ARG A 27 17.241 -22.604 19.855 1.00 25.00 H new ATOM 0 HH22 ARG A 27 18.939 -22.876 20.259 1.00 25.00 H new ATOM 423 N LYS A 28 18.323 -18.138 14.955 1.00 25.00 N ATOM 424 CA LYS A 28 18.277 -18.915 13.716 1.00 25.00 C ATOM 425 C LYS A 28 16.822 -19.225 13.370 1.00 25.00 C ATOM 426 O LYS A 28 16.069 -19.724 14.196 1.00 25.00 O ATOM 427 CB LYS A 28 19.070 -20.211 13.933 1.00 25.00 C ATOM 428 CG LYS A 28 19.092 -21.187 12.768 1.00 25.00 C ATOM 429 CD LYS A 28 20.204 -22.221 13.002 1.00 25.00 C ATOM 430 CE LYS A 28 20.301 -23.261 11.888 1.00 25.00 C ATOM 431 NZ LYS A 28 21.689 -23.866 11.857 1.00 25.00 N ATOM 0 H LYS A 28 18.915 -18.547 15.678 1.00 25.00 H new ATOM 0 HA LYS A 28 18.716 -18.355 12.890 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.099 -19.946 14.178 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.657 -20.724 14.802 1.00 25.00 H new ATOM 0 HG2 LYS A 28 18.127 -21.686 12.677 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.265 -20.654 11.833 1.00 25.00 H new ATOM 0 HD2 LYS A 28 21.159 -21.704 13.092 1.00 25.00 H new ATOM 0 HD3 LYS A 28 20.026 -22.729 13.950 1.00 25.00 H new ATOM 0 HE2 LYS A 28 19.559 -24.044 12.045 1.00 25.00 H new ATOM 0 HE3 LYS A 28 20.077 -22.798 10.927 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 21.743 -24.572 11.095 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 22.390 -23.117 11.686 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 21.888 -24.325 12.769 1.00 25.00 H new ATOM 445 N GLY A 29 16.443 -18.911 12.140 1.00 25.00 N ATOM 446 CA GLY A 29 15.085 -19.128 11.676 1.00 25.00 C ATOM 447 C GLY A 29 14.206 -17.888 11.686 1.00 25.00 C ATOM 448 O GLY A 29 13.120 -17.913 11.097 1.00 25.00 O ATOM 0 H GLY A 29 17.064 -18.502 11.442 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.121 -19.523 10.661 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.620 -19.892 12.299 1.00 25.00 H new ATOM 452 N ASP A 30 14.654 -16.813 12.316 1.00 25.00 N ATOM 453 CA ASP A 30 13.858 -15.584 12.404 1.00 25.00 C ATOM 454 C ASP A 30 13.756 -14.916 11.045 1.00 25.00 C ATOM 455 O ASP A 30 14.611 -15.125 10.178 1.00 25.00 O ATOM 456 CB ASP A 30 14.487 -14.592 13.389 1.00 25.00 C ATOM 457 CG ASP A 30 14.224 -14.959 14.844 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.811 -14.305 15.735 1.00 25.00 O ATOM 459 OD2 ASP A 30 13.423 -15.881 15.098 1.00 25.00 O ATOM 0 H ASP A 30 15.563 -16.760 12.776 1.00 25.00 H new ATOM 0 HA ASP A 30 12.865 -15.864 12.755 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.563 -14.550 13.218 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.094 -13.594 13.194 1.00 25.00 H new ATOM 464 N ILE A 31 12.719 -14.107 10.869 1.00 25.00 N ATOM 465 CA ILE A 31 12.494 -13.380 9.620 1.00 25.00 C ATOM 466 C ILE A 31 12.574 -11.888 9.882 1.00 25.00 C ATOM 467 O ILE A 31 11.877 -11.371 10.748 1.00 25.00 O ATOM 468 CB ILE A 31 11.087 -13.672 9.014 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.912 -15.171 8.722 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.874 -12.856 7.705 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.960 -15.777 7.814 1.00 25.00 C ATOM 0 H ILE A 31 12.011 -13.935 11.583 1.00 25.00 H new ATOM 0 HA ILE A 31 13.260 -13.709 8.918 1.00 25.00 H new ATOM 0 HB ILE A 31 10.341 -13.370 9.749 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.917 -15.712 9.668 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.931 -15.325 8.272 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.887 -13.073 7.297 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.950 -11.791 7.924 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.636 -13.132 6.976 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.748 -16.836 7.670 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.943 -15.269 6.850 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.945 -15.662 8.267 1.00 25.00 H new ATOM 483 N MET A 32 13.379 -11.195 9.094 1.00 25.00 N ATOM 484 CA MET A 32 13.479 -9.743 9.174 1.00 25.00 C ATOM 485 C MET A 32 13.221 -9.141 7.811 1.00 25.00 C ATOM 486 O MET A 32 13.395 -9.795 6.775 1.00 25.00 O ATOM 487 CB MET A 32 14.852 -9.318 9.689 1.00 25.00 C ATOM 488 CG MET A 32 16.018 -9.900 8.927 1.00 25.00 C ATOM 489 SD MET A 32 17.288 -10.400 10.081 1.00 25.00 S ATOM 490 CE MET A 32 16.549 -11.939 10.788 1.00 25.00 C ATOM 0 H MET A 32 13.979 -11.617 8.385 1.00 25.00 H new ATOM 0 HA MET A 32 12.729 -9.380 9.877 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.918 -8.231 9.653 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.938 -9.608 10.736 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.690 -10.755 8.336 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.415 -9.163 8.229 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.573 -11.887 11.877 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.517 -12.035 10.452 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.121 -12.804 10.453 1.00 25.00 H new ATOM 500 N THR A 33 12.795 -7.892 7.824 1.00 25.00 N ATOM 501 CA THR A 33 12.516 -7.155 6.595 1.00 25.00 C ATOM 502 C THR A 33 13.772 -6.424 6.163 1.00 25.00 C ATOM 503 O THR A 33 14.214 -5.522 6.846 1.00 25.00 O ATOM 504 CB THR A 33 11.402 -6.114 6.813 1.00 25.00 C ATOM 505 OG1 THR A 33 10.201 -6.784 7.204 1.00 25.00 O ATOM 506 CG2 THR A 33 11.128 -5.334 5.547 1.00 25.00 C ATOM 0 H THR A 33 12.632 -7.358 8.678 1.00 25.00 H new ATOM 0 HA THR A 33 12.193 -7.866 5.835 1.00 25.00 H new ATOM 0 HB THR A 33 11.730 -5.422 7.589 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.490 -6.125 7.345 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.337 -4.607 5.732 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.034 -4.814 5.237 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.815 -6.018 4.759 1.00 25.00 H new ATOM 514 N VAL A 34 14.348 -6.815 5.040 1.00 25.00 N ATOM 515 CA VAL A 34 15.553 -6.173 4.525 1.00 25.00 C ATOM 516 C VAL A 34 15.167 -4.871 3.864 1.00 25.00 C ATOM 517 O VAL A 34 14.321 -4.838 2.963 1.00 25.00 O ATOM 518 CB VAL A 34 16.275 -7.059 3.501 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.601 -6.425 3.051 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.527 -8.425 4.106 1.00 25.00 C ATOM 0 H VAL A 34 14.000 -7.579 4.461 1.00 25.00 H new ATOM 0 HA VAL A 34 16.232 -6.001 5.360 1.00 25.00 H new ATOM 0 HB VAL A 34 15.640 -7.159 2.621 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.088 -7.077 2.326 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.404 -5.456 2.593 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.252 -6.292 3.915 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.040 -9.056 3.380 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.146 -8.320 4.997 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.576 -8.884 4.377 1.00 25.00 H new ATOM 530 N LEU A 35 15.769 -3.798 4.333 1.00 25.00 N ATOM 531 CA LEU A 35 15.486 -2.465 3.849 1.00 25.00 C ATOM 532 C LEU A 35 16.514 -2.076 2.806 1.00 25.00 C ATOM 533 O LEU A 35 16.154 -1.645 1.724 1.00 25.00 O ATOM 534 CB LEU A 35 15.514 -1.497 5.021 1.00 25.00 C ATOM 535 CG LEU A 35 14.465 -1.800 6.100 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.752 -0.950 7.298 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.043 -1.545 5.601 1.00 25.00 C ATOM 0 H LEU A 35 16.475 -3.828 5.068 1.00 25.00 H new ATOM 0 HA LEU A 35 14.499 -2.434 3.388 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.505 -1.519 5.475 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.356 -0.485 4.648 1.00 25.00 H new ATOM 0 HG LEU A 35 14.528 -2.857 6.360 1.00 25.00 H new ATOM 0 HD11 LEU A 35 14.014 -1.154 8.074 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.749 -1.178 7.676 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.702 0.102 7.018 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.332 -1.772 6.396 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.941 -0.499 5.311 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.840 -2.182 4.740 1.00 25.00 H new ATOM 549 N GLU A 36 17.785 -2.312 3.088 1.00 25.00 N ATOM 550 CA GLU A 36 18.828 -2.119 2.079 1.00 25.00 C ATOM 551 C GLU A 36 20.001 -3.034 2.378 1.00 25.00 C ATOM 552 O GLU A 36 20.015 -3.704 3.403 1.00 25.00 O ATOM 553 CB GLU A 36 19.252 -0.646 1.969 1.00 25.00 C ATOM 554 CG GLU A 36 20.178 -0.108 2.989 1.00 25.00 C ATOM 555 CD GLU A 36 20.390 1.399 2.822 1.00 25.00 C ATOM 556 OE1 GLU A 36 21.188 1.978 3.590 1.00 25.00 O ATOM 557 OE2 GLU A 36 19.740 2.006 1.943 1.00 25.00 O ATOM 0 H GLU A 36 18.123 -2.634 3.995 1.00 25.00 H new ATOM 0 HA GLU A 36 18.425 -2.387 1.102 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.714 -0.504 0.992 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.348 -0.037 1.985 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.782 -0.312 3.984 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.137 -0.621 2.917 1.00 25.00 H new ATOM 564 N ARG A 37 20.965 -3.093 1.474 1.00 25.00 N ATOM 565 CA ARG A 37 22.134 -3.949 1.642 1.00 25.00 C ATOM 566 C ARG A 37 23.341 -3.081 1.438 1.00 25.00 C ATOM 567 O ARG A 37 23.253 -2.107 0.699 1.00 25.00 O ATOM 568 CB ARG A 37 22.141 -5.065 0.606 1.00 25.00 C ATOM 569 CG ARG A 37 20.916 -5.964 0.666 1.00 25.00 C ATOM 570 CD ARG A 37 21.106 -7.192 -0.201 1.00 25.00 C ATOM 571 NE ARG A 37 21.493 -6.828 -1.575 1.00 25.00 N ATOM 572 CZ ARG A 37 21.810 -7.686 -2.536 1.00 25.00 C ATOM 573 NH1 ARG A 37 21.790 -8.984 -2.351 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.160 -7.226 -3.705 1.00 25.00 N ATOM 0 H ARG A 37 20.963 -2.554 0.608 1.00 25.00 H new ATOM 0 HA ARG A 37 22.126 -4.408 2.631 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.209 -4.625 -0.389 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.034 -5.674 0.747 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.732 -6.266 1.697 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.037 -5.411 0.334 1.00 25.00 H new ATOM 0 HD2 ARG A 37 21.872 -7.832 0.236 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.182 -7.770 -0.223 1.00 25.00 H new ATOM 0 HE ARG A 37 21.519 -5.835 -1.806 1.00 25.00 H new ATOM 0 HH11 ARG A 37 21.524 -9.366 -1.443 1.00 25.00 H new ATOM 0 HH12 ARG A 37 22.040 -9.612 -3.115 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.187 -6.220 -3.870 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.407 -7.872 -4.454 1.00 25.00 H new ATOM 588 N ASP A 38 24.430 -3.435 2.105 1.00 25.00 N ATOM 589 CA ASP A 38 25.704 -2.720 2.023 1.00 25.00 C ATOM 590 C ASP A 38 25.457 -1.272 2.467 1.00 25.00 C ATOM 591 O ASP A 38 25.988 -0.293 1.939 1.00 25.00 O ATOM 592 CB ASP A 38 26.294 -2.898 0.621 1.00 25.00 C ATOM 593 CG ASP A 38 26.280 -4.371 0.188 1.00 25.00 C ATOM 594 OD1 ASP A 38 26.786 -5.228 0.962 1.00 25.00 O ATOM 595 OD2 ASP A 38 25.615 -4.698 -0.828 1.00 25.00 O ATOM 0 H ASP A 38 24.458 -4.240 2.730 1.00 25.00 H new ATOM 0 HA ASP A 38 26.465 -3.119 2.694 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.725 -2.302 -0.093 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.317 -2.523 0.605 1.00 25.00 H new ATOM 600 N THR A 39 24.573 -1.186 3.452 1.00 25.00 N ATOM 601 CA THR A 39 24.093 0.070 4.015 1.00 25.00 C ATOM 602 C THR A 39 25.214 0.848 4.673 1.00 25.00 C ATOM 603 O THR A 39 26.121 0.271 5.237 1.00 25.00 O ATOM 604 CB THR A 39 22.982 -0.212 5.059 1.00 25.00 C ATOM 605 OG1 THR A 39 22.549 1.004 5.669 1.00 25.00 O ATOM 606 CG2 THR A 39 23.419 -1.165 6.116 1.00 25.00 C ATOM 0 H THR A 39 24.159 -2.008 3.893 1.00 25.00 H new ATOM 0 HA THR A 39 23.693 0.670 3.198 1.00 25.00 H new ATOM 0 HB THR A 39 22.156 -0.672 4.517 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.948 1.480 5.058 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.603 -1.327 6.820 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.696 -2.114 5.658 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.278 -0.753 6.645 1.00 25.00 H new ATOM 614 N GLN A 40 25.146 2.170 4.573 1.00 25.00 N ATOM 615 CA GLN A 40 26.151 3.091 5.130 1.00 25.00 C ATOM 616 C GLN A 40 27.572 2.841 4.593 1.00 25.00 C ATOM 617 O GLN A 40 28.544 3.340 5.149 1.00 25.00 O ATOM 618 CB GLN A 40 26.150 3.058 6.672 1.00 25.00 C ATOM 619 CG GLN A 40 24.759 2.964 7.298 1.00 25.00 C ATOM 620 CD GLN A 40 24.728 3.441 8.737 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.926 4.614 9.011 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.450 2.544 9.650 1.00 25.00 N ATOM 0 H GLN A 40 24.382 2.648 4.096 1.00 25.00 H new ATOM 0 HA GLN A 40 25.856 4.085 4.795 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.744 2.207 7.006 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.643 3.957 7.043 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.060 3.557 6.709 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.416 1.930 7.255 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.291 1.573 9.380 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.392 2.816 10.631 1.00 25.00 H new ATOM 631 N GLY A 41 27.686 2.069 3.516 1.00 25.00 N ATOM 632 CA GLY A 41 28.988 1.730 2.963 1.00 25.00 C ATOM 633 C GLY A 41 29.616 0.571 3.711 1.00 25.00 C ATOM 634 O GLY A 41 30.809 0.307 3.585 1.00 25.00 O ATOM 0 H GLY A 41 26.894 1.669 3.012 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.882 1.472 1.909 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.645 2.598 3.014 1.00 25.00 H new ATOM 638 N LEU A 42 28.815 -0.114 4.517 1.00 25.00 N ATOM 639 CA LEU A 42 29.282 -1.237 5.302 1.00 25.00 C ATOM 640 C LEU A 42 29.067 -2.498 4.480 1.00 25.00 C ATOM 641 O LEU A 42 27.983 -3.076 4.474 1.00 25.00 O ATOM 642 CB LEU A 42 28.500 -1.306 6.613 1.00 25.00 C ATOM 643 CG LEU A 42 28.544 -0.058 7.500 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.462 -0.167 8.551 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.892 0.086 8.173 1.00 25.00 C ATOM 0 H LEU A 42 27.825 0.097 4.641 1.00 25.00 H new ATOM 0 HA LEU A 42 30.339 -1.130 5.546 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.458 -1.521 6.378 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.877 -2.149 7.191 1.00 25.00 H new ATOM 0 HG LEU A 42 28.381 0.822 6.877 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.484 0.717 9.189 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.489 -0.240 8.065 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.632 -1.056 9.158 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.894 0.980 8.796 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.084 -0.789 8.794 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.670 0.171 7.414 1.00 25.00 H new ATOM 657 N ASP A 43 30.093 -2.894 3.749 1.00 25.00 N ATOM 658 CA ASP A 43 29.997 -4.055 2.863 1.00 25.00 C ATOM 659 C ASP A 43 29.589 -5.296 3.645 1.00 25.00 C ATOM 660 O ASP A 43 30.168 -5.622 4.684 1.00 25.00 O ATOM 661 CB ASP A 43 31.337 -4.330 2.171 1.00 25.00 C ATOM 662 CG ASP A 43 31.590 -3.416 0.982 1.00 25.00 C ATOM 663 OD1 ASP A 43 32.772 -3.260 0.603 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.618 -2.904 0.390 1.00 25.00 O ATOM 0 H ASP A 43 31.004 -2.434 3.746 1.00 25.00 H new ATOM 0 HA ASP A 43 29.241 -3.828 2.111 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.144 -4.209 2.893 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.361 -5.367 1.837 1.00 25.00 H new ATOM 669 N GLY A 44 28.573 -5.986 3.149 1.00 25.00 N ATOM 670 CA GLY A 44 28.105 -7.203 3.790 1.00 25.00 C ATOM 671 C GLY A 44 27.089 -6.976 4.893 1.00 25.00 C ATOM 672 O GLY A 44 26.406 -7.924 5.294 1.00 25.00 O ATOM 0 H GLY A 44 28.059 -5.724 2.308 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.664 -7.852 3.033 1.00 25.00 H new ATOM 0 HA3 GLY A 44 28.962 -7.734 4.205 1.00 25.00 H new ATOM 676 N TRP A 45 26.952 -5.753 5.384 1.00 25.00 N ATOM 677 CA TRP A 45 25.968 -5.445 6.397 1.00 25.00 C ATOM 678 C TRP A 45 24.676 -5.046 5.704 1.00 25.00 C ATOM 679 O TRP A 45 24.671 -4.226 4.797 1.00 25.00 O ATOM 680 CB TRP A 45 26.501 -4.300 7.243 1.00 25.00 C ATOM 681 CG TRP A 45 27.559 -4.753 8.202 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.900 -4.551 8.123 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.359 -5.496 9.412 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.555 -5.086 9.193 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.636 -5.691 10.009 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.222 -6.002 10.063 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.794 -6.383 11.227 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.374 -6.680 11.283 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.658 -6.870 11.852 1.00 25.00 C ATOM 0 H TRP A 45 27.517 -4.956 5.091 1.00 25.00 H new ATOM 0 HA TRP A 45 25.774 -6.304 7.039 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.910 -3.528 6.591 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.679 -3.847 7.798 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.388 -4.030 7.312 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.561 -5.043 9.358 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.241 -5.871 9.630 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.772 -6.529 11.660 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.502 -7.061 11.794 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.752 -7.402 12.787 1.00 25.00 H new ATOM 700 N TRP A 46 23.573 -5.648 6.108 1.00 25.00 N ATOM 701 CA TRP A 46 22.284 -5.394 5.474 1.00 25.00 C ATOM 702 C TRP A 46 21.350 -4.755 6.485 1.00 25.00 C ATOM 703 O TRP A 46 21.139 -5.292 7.564 1.00 25.00 O ATOM 704 CB TRP A 46 21.689 -6.707 4.941 1.00 25.00 C ATOM 705 CG TRP A 46 22.524 -7.361 3.839 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.638 -6.867 3.234 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.303 -8.646 3.218 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.124 -7.714 2.288 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.338 -8.831 2.251 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.336 -9.660 3.376 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.421 -9.988 1.448 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.433 -10.833 2.586 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.467 -10.977 1.623 1.00 25.00 C ATOM 0 H TRP A 46 23.540 -6.320 6.875 1.00 25.00 H new ATOM 0 HA TRP A 46 22.417 -4.715 4.631 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.583 -7.409 5.768 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.687 -6.512 4.558 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.084 -5.914 3.477 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.941 -7.544 1.702 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.533 -9.545 4.089 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.207 -10.100 0.716 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.712 -11.626 2.718 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.510 -11.871 1.018 1.00 25.00 H new ATOM 724 N LEU A 47 20.804 -3.599 6.142 1.00 25.00 N ATOM 725 CA LEU A 47 19.879 -2.895 7.019 1.00 25.00 C ATOM 726 C LEU A 47 18.575 -3.653 7.004 1.00 25.00 C ATOM 727 O LEU A 47 17.985 -3.841 5.945 1.00 25.00 O ATOM 728 CB LEU A 47 19.640 -1.473 6.509 1.00 25.00 C ATOM 729 CG LEU A 47 18.645 -0.616 7.301 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.053 -0.463 8.755 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.513 0.753 6.643 1.00 25.00 C ATOM 0 H LEU A 47 20.986 -3.125 5.257 1.00 25.00 H new ATOM 0 HA LEU A 47 20.290 -2.835 8.027 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.598 -0.953 6.490 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.291 -1.535 5.478 1.00 25.00 H new ATOM 0 HG LEU A 47 17.682 -1.126 7.290 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.319 0.151 9.276 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.103 -1.446 9.224 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.031 0.015 8.810 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.806 1.361 7.207 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.485 1.246 6.630 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.154 0.632 5.621 1.00 25.00 H new ATOM 743 N CYS A 48 18.122 -4.089 8.164 1.00 25.00 N ATOM 744 CA CYS A 48 16.869 -4.811 8.266 1.00 25.00 C ATOM 745 C CYS A 48 16.051 -4.298 9.429 1.00 25.00 C ATOM 746 O CYS A 48 16.529 -3.523 10.253 1.00 25.00 O ATOM 747 CB CYS A 48 17.128 -6.318 8.426 1.00 25.00 C ATOM 748 SG CYS A 48 18.297 -7.000 7.220 1.00 25.00 S ATOM 0 H CYS A 48 18.606 -3.955 9.052 1.00 25.00 H new ATOM 0 HA CYS A 48 16.306 -4.648 7.347 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.508 -6.506 9.430 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.181 -6.850 8.339 1.00 25.00 H new ATOM 0 HG CYS A 48 19.436 -6.382 7.322 1.00 25.00 H new ATOM 754 N SER A 49 14.810 -4.745 9.483 1.00 25.00 N ATOM 755 CA SER A 49 13.897 -4.394 10.552 1.00 25.00 C ATOM 756 C SER A 49 13.326 -5.685 11.124 1.00 25.00 C ATOM 757 O SER A 49 12.908 -6.584 10.382 1.00 25.00 O ATOM 758 CB SER A 49 12.812 -3.460 10.013 1.00 25.00 C ATOM 759 OG SER A 49 11.549 -4.095 9.913 1.00 25.00 O ATOM 0 H SER A 49 14.406 -5.366 8.782 1.00 25.00 H new ATOM 0 HA SER A 49 14.406 -3.857 11.353 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.728 -2.592 10.666 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.109 -3.092 9.031 1.00 25.00 H new ATOM 0 HG SER A 49 10.889 -3.459 9.566 1.00 25.00 H new ATOM 765 N LEU A 50 13.393 -5.806 12.440 1.00 25.00 N ATOM 766 CA LEU A 50 12.961 -7.002 13.151 1.00 25.00 C ATOM 767 C LEU A 50 12.347 -6.573 14.472 1.00 25.00 C ATOM 768 O LEU A 50 12.926 -5.761 15.179 1.00 25.00 O ATOM 769 CB LEU A 50 14.168 -7.898 13.430 1.00 25.00 C ATOM 770 CG LEU A 50 13.845 -9.220 14.138 1.00 25.00 C ATOM 771 CD1 LEU A 50 14.030 -10.374 13.205 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.720 -9.379 15.366 1.00 25.00 C ATOM 0 H LEU A 50 13.751 -5.072 13.051 1.00 25.00 H new ATOM 0 HA LEU A 50 12.236 -7.552 12.551 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.662 -8.121 12.484 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.881 -7.342 14.039 1.00 25.00 H new ATOM 0 HG LEU A 50 12.802 -9.203 14.453 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.796 -11.303 13.725 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.365 -10.260 12.349 1.00 25.00 H new ATOM 0 HD13 LEU A 50 15.064 -10.401 12.860 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.483 -10.320 15.862 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.769 -9.379 15.068 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.538 -8.552 16.052 1.00 25.00 H new ATOM 784 N HIS A 51 11.161 -7.090 14.772 1.00 25.00 N ATOM 785 CA HIS A 51 10.448 -6.801 16.031 1.00 25.00 C ATOM 786 C HIS A 51 10.264 -5.293 16.275 1.00 25.00 C ATOM 787 O HIS A 51 10.250 -4.836 17.410 1.00 25.00 O ATOM 788 CB HIS A 51 11.182 -7.446 17.224 1.00 25.00 C ATOM 789 CG HIS A 51 11.353 -8.931 17.099 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.230 -9.674 17.848 1.00 25.00 N ATOM 791 CD2 HIS A 51 10.735 -9.834 16.286 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.122 -10.949 17.474 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.219 -11.101 16.526 1.00 25.00 N ATOM 0 H HIS A 51 10.657 -7.725 14.153 1.00 25.00 H new ATOM 0 HA HIS A 51 9.452 -7.235 15.937 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.164 -6.984 17.327 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.630 -7.229 18.138 1.00 25.00 H new ATOM 0 HD2 HIS A 51 9.975 -9.591 15.558 1.00 25.00 H new ATOM 0 HE1 HIS A 51 12.702 -11.757 17.895 1.00 25.00 H new ATOM 0 HE2 HIS A 51 10.939 -11.969 16.069 1.00 25.00 H new ATOM 801 N GLY A 52 10.121 -4.527 15.201 1.00 25.00 N ATOM 802 CA GLY A 52 9.927 -3.088 15.327 1.00 25.00 C ATOM 803 C GLY A 52 11.199 -2.296 15.581 1.00 25.00 C ATOM 804 O GLY A 52 11.134 -1.108 15.875 1.00 25.00 O ATOM 0 H GLY A 52 10.135 -4.873 14.242 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.460 -2.717 14.415 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.229 -2.899 16.142 1.00 25.00 H new ATOM 808 N ARG A 53 12.357 -2.932 15.452 1.00 25.00 N ATOM 809 CA ARG A 53 13.640 -2.273 15.657 1.00 25.00 C ATOM 810 C ARG A 53 14.374 -2.384 14.345 1.00 25.00 C ATOM 811 O ARG A 53 14.212 -3.364 13.631 1.00 25.00 O ATOM 812 CB ARG A 53 14.422 -2.970 16.782 1.00 25.00 C ATOM 813 CG ARG A 53 15.306 -2.029 17.607 1.00 25.00 C ATOM 814 CD ARG A 53 16.769 -2.098 17.185 1.00 25.00 C ATOM 815 NE ARG A 53 17.584 -1.120 17.922 1.00 25.00 N ATOM 816 CZ ARG A 53 18.890 -0.925 17.758 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.611 -1.605 16.906 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.483 -0.025 18.482 1.00 25.00 N ATOM 0 H ARG A 53 12.433 -3.918 15.203 1.00 25.00 H new ATOM 0 HA ARG A 53 13.518 -1.231 15.954 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.715 -3.464 17.449 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.047 -3.749 16.346 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.946 -1.006 17.498 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.221 -2.286 18.663 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.154 -3.102 17.362 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.850 -1.909 16.115 1.00 25.00 H new ATOM 0 HE ARG A 53 17.109 -0.544 18.616 1.00 25.00 H new ATOM 0 HH11 ARG A 53 19.175 -2.324 16.329 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.610 -1.417 16.818 1.00 25.00 H new ATOM 0 HH21 ARG A 53 18.948 0.517 19.161 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.484 0.140 18.372 1.00 25.00 H new ATOM 832 N GLN A 54 15.161 -1.381 14.020 1.00 25.00 N ATOM 833 CA GLN A 54 15.929 -1.365 12.781 1.00 25.00 C ATOM 834 C GLN A 54 17.402 -1.469 13.114 1.00 25.00 C ATOM 835 O GLN A 54 17.833 -0.972 14.150 1.00 25.00 O ATOM 836 CB GLN A 54 15.672 -0.061 12.029 1.00 25.00 C ATOM 837 CG GLN A 54 14.987 -0.254 10.710 1.00 25.00 C ATOM 838 CD GLN A 54 14.728 1.059 9.993 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.612 1.344 9.595 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.756 1.851 9.816 1.00 25.00 N ATOM 0 H GLN A 54 15.290 -0.553 14.601 1.00 25.00 H new ATOM 0 HA GLN A 54 15.628 -2.205 12.155 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.064 0.594 12.652 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.622 0.447 11.865 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.599 -0.896 10.077 1.00 25.00 H new ATOM 0 HG3 GLN A 54 14.041 -0.771 10.868 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.676 1.579 10.163 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.637 2.740 9.331 1.00 25.00 H new ATOM 849 N GLY A 55 18.168 -2.097 12.239 1.00 25.00 N ATOM 850 CA GLY A 55 19.598 -2.201 12.449 1.00 25.00 C ATOM 851 C GLY A 55 20.281 -3.015 11.374 1.00 25.00 C ATOM 852 O GLY A 55 19.612 -3.614 10.532 1.00 25.00 O ATOM 0 H GLY A 55 17.827 -2.538 11.385 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.032 -1.202 12.475 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.787 -2.656 13.421 1.00 25.00 H new ATOM 856 N ILE A 56 21.603 -3.029 11.385 1.00 25.00 N ATOM 857 CA ILE A 56 22.378 -3.777 10.403 1.00 25.00 C ATOM 858 C ILE A 56 22.460 -5.242 10.824 1.00 25.00 C ATOM 859 O ILE A 56 22.273 -5.589 11.994 1.00 25.00 O ATOM 860 CB ILE A 56 23.804 -3.171 10.216 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.613 -3.294 11.522 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.676 -1.686 9.814 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.013 -2.724 11.453 1.00 25.00 C ATOM 0 H ILE A 56 22.169 -2.527 12.069 1.00 25.00 H new ATOM 0 HA ILE A 56 21.872 -3.709 9.440 1.00 25.00 H new ATOM 0 HB ILE A 56 24.327 -3.719 9.432 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.068 -2.789 12.320 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.677 -4.347 11.796 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.670 -1.258 9.682 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.121 -1.609 8.879 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.147 -1.142 10.596 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.507 -2.855 12.416 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.580 -3.244 10.681 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.962 -1.662 11.213 1.00 25.00 H new ATOM 875 N VAL A 57 22.682 -6.095 9.843 1.00 25.00 N ATOM 876 CA VAL A 57 22.744 -7.543 10.038 1.00 25.00 C ATOM 877 C VAL A 57 23.834 -8.099 9.133 1.00 25.00 C ATOM 878 O VAL A 57 23.937 -7.690 7.981 1.00 25.00 O ATOM 879 CB VAL A 57 21.407 -8.203 9.606 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.466 -9.704 9.678 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.249 -7.662 10.443 1.00 25.00 C ATOM 0 H VAL A 57 22.827 -5.806 8.876 1.00 25.00 H new ATOM 0 HA VAL A 57 22.940 -7.752 11.090 1.00 25.00 H new ATOM 0 HB VAL A 57 21.237 -7.942 8.562 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.508 -10.121 9.367 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.253 -10.069 9.018 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.680 -10.011 10.702 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.319 -8.135 10.127 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.428 -7.881 11.496 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.173 -6.584 10.304 1.00 25.00 H new ATOM 891 N PRO A 58 24.636 -9.059 9.615 1.00 25.00 N ATOM 892 CA PRO A 58 25.618 -9.651 8.709 1.00 25.00 C ATOM 893 C PRO A 58 24.938 -10.535 7.657 1.00 25.00 C ATOM 894 O PRO A 58 24.328 -11.563 7.977 1.00 25.00 O ATOM 895 CB PRO A 58 26.499 -10.467 9.657 1.00 25.00 C ATOM 896 CG PRO A 58 25.580 -10.856 10.766 1.00 25.00 C ATOM 897 CD PRO A 58 24.664 -9.687 10.948 1.00 25.00 C ATOM 0 HA PRO A 58 26.180 -8.917 8.132 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.915 -11.343 9.159 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.340 -9.879 10.024 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.022 -11.758 10.516 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.134 -11.067 11.680 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.669 -10.002 11.264 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.037 -9.000 11.707 1.00 25.00 H new ATOM 905 N GLY A 59 25.059 -10.154 6.393 1.00 25.00 N ATOM 906 CA GLY A 59 24.467 -10.920 5.304 1.00 25.00 C ATOM 907 C GLY A 59 25.015 -12.331 5.231 1.00 25.00 C ATOM 908 O GLY A 59 24.362 -13.237 4.739 1.00 25.00 O ATOM 0 H GLY A 59 25.562 -9.318 6.096 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.386 -10.959 5.435 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.655 -10.410 4.359 1.00 25.00 H new ATOM 912 N ASN A 60 26.198 -12.534 5.794 1.00 25.00 N ATOM 913 CA ASN A 60 26.830 -13.855 5.837 1.00 25.00 C ATOM 914 C ASN A 60 26.030 -14.866 6.679 1.00 25.00 C ATOM 915 O ASN A 60 26.244 -16.071 6.580 1.00 25.00 O ATOM 916 CB ASN A 60 28.250 -13.730 6.410 1.00 25.00 C ATOM 917 CG ASN A 60 29.250 -14.595 5.677 1.00 25.00 C ATOM 918 OD1 ASN A 60 30.226 -14.105 5.150 1.00 25.00 O ATOM 919 ND2 ASN A 60 28.996 -15.873 5.618 1.00 25.00 N ATOM 0 H ASN A 60 26.748 -11.795 6.233 1.00 25.00 H new ATOM 0 HA ASN A 60 26.861 -14.230 4.814 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.569 -12.689 6.358 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.238 -14.008 7.464 1.00 25.00 H new ATOM 0 HD21 ASN A 60 29.629 -16.496 5.116 1.00 25.00 H new ATOM 0 HD22 ASN A 60 28.165 -16.249 6.074 1.00 25.00 H new ATOM 926 N ARG A 61 25.111 -14.372 7.503 1.00 25.00 N ATOM 927 CA ARG A 61 24.272 -15.231 8.350 1.00 25.00 C ATOM 928 C ARG A 61 22.804 -15.113 7.943 1.00 25.00 C ATOM 929 O ARG A 61 21.915 -15.605 8.650 1.00 25.00 O ATOM 930 CB ARG A 61 24.437 -14.831 9.827 1.00 25.00 C ATOM 931 CG ARG A 61 25.865 -14.999 10.357 1.00 25.00 C ATOM 932 CD ARG A 61 25.977 -14.569 11.818 1.00 25.00 C ATOM 933 NE ARG A 61 27.338 -14.801 12.335 1.00 25.00 N ATOM 934 CZ ARG A 61 27.782 -14.447 13.535 1.00 25.00 C ATOM 935 NH1 ARG A 61 27.052 -13.792 14.398 1.00 25.00 N ATOM 936 NH2 ARG A 61 29.003 -14.758 13.864 1.00 25.00 N ATOM 0 H ARG A 61 24.923 -13.375 7.606 1.00 25.00 H new ATOM 0 HA ARG A 61 24.589 -16.266 8.219 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.134 -13.791 9.948 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.761 -15.432 10.434 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.170 -16.041 10.260 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.551 -14.408 9.750 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.724 -13.513 11.910 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.256 -15.123 12.420 1.00 25.00 H new ATOM 0 HE ARG A 61 27.996 -15.275 11.717 1.00 25.00 H new ATOM 0 HH11 ARG A 61 26.095 -13.530 14.162 1.00 25.00 H new ATOM 0 HH12 ARG A 61 27.439 -13.543 15.308 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.596 -15.263 13.205 1.00 25.00 H new ATOM 0 HH22 ARG A 61 29.367 -14.497 14.780 1.00 25.00 H new ATOM 950 N LEU A 62 22.545 -14.463 6.815 1.00 25.00 N ATOM 951 CA LEU A 62 21.178 -14.194 6.374 1.00 25.00 C ATOM 952 C LEU A 62 20.889 -14.654 4.950 1.00 25.00 C ATOM 953 O LEU A 62 21.728 -14.563 4.069 1.00 25.00 O ATOM 954 CB LEU A 62 20.914 -12.692 6.463 1.00 25.00 C ATOM 955 CG LEU A 62 19.477 -12.287 6.781 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.020 -12.743 8.117 1.00 25.00 C ATOM 957 CD2 LEU A 62 19.338 -10.786 6.656 1.00 25.00 C ATOM 0 H LEU A 62 23.266 -14.110 6.185 1.00 25.00 H new ATOM 0 HA LEU A 62 20.522 -14.764 7.032 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.567 -12.272 7.228 1.00 25.00 H new ATOM 0 HB3 LEU A 62 21.199 -12.236 5.515 1.00 25.00 H new ATOM 0 HG LEU A 62 18.833 -12.786 6.057 1.00 25.00 H new ATOM 0 HD11 LEU A 62 17.991 -12.422 8.279 1.00 25.00 H new ATOM 0 HD12 LEU A 62 19.073 -13.831 8.168 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.660 -12.312 8.887 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.312 -10.495 6.883 1.00 25.00 H new ATOM 0 HD22 LEU A 62 20.017 -10.298 7.356 1.00 25.00 H new ATOM 0 HD23 LEU A 62 19.585 -10.481 5.639 1.00 25.00 H new ATOM 969 N LYS A 63 19.674 -15.133 4.730 1.00 25.00 N ATOM 970 CA LYS A 63 19.252 -15.578 3.399 1.00 25.00 C ATOM 971 C LYS A 63 18.021 -14.860 2.915 1.00 25.00 C ATOM 972 O LYS A 63 16.956 -14.961 3.511 1.00 25.00 O ATOM 973 CB LYS A 63 18.978 -17.083 3.385 1.00 25.00 C ATOM 974 CG LYS A 63 18.473 -17.593 2.027 1.00 25.00 C ATOM 975 CD LYS A 63 18.496 -19.114 1.919 1.00 25.00 C ATOM 976 CE LYS A 63 17.489 -19.795 2.842 1.00 25.00 C ATOM 977 NZ LYS A 63 17.592 -21.291 2.699 1.00 25.00 N ATOM 0 H LYS A 63 18.959 -15.226 5.452 1.00 25.00 H new ATOM 0 HA LYS A 63 20.077 -15.342 2.727 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.892 -17.615 3.648 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.240 -17.319 4.152 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.455 -17.238 1.867 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.088 -17.168 1.233 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.288 -19.402 0.889 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.497 -19.474 2.155 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.677 -19.506 3.876 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.479 -19.466 2.598 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 16.904 -21.748 3.330 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 17.391 -21.560 1.715 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.552 -21.599 2.953 1.00 25.00 H new ATOM 991 N ILE A 64 18.169 -14.178 1.796 1.00 25.00 N ATOM 992 CA ILE A 64 17.068 -13.468 1.164 1.00 25.00 C ATOM 993 C ILE A 64 16.071 -14.482 0.605 1.00 25.00 C ATOM 994 O ILE A 64 16.444 -15.384 -0.140 1.00 25.00 O ATOM 995 CB ILE A 64 17.603 -12.568 0.017 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.694 -11.613 0.539 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.483 -11.760 -0.608 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.258 -10.674 1.686 1.00 25.00 C ATOM 0 H ILE A 64 19.055 -14.099 1.297 1.00 25.00 H new ATOM 0 HA ILE A 64 16.573 -12.837 1.902 1.00 25.00 H new ATOM 0 HB ILE A 64 18.032 -13.222 -0.742 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.541 -12.208 0.881 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.048 -11.003 -0.292 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.885 -11.139 -1.408 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.731 -12.435 -1.016 1.00 25.00 H new ATOM 0 HG23 ILE A 64 16.026 -11.124 0.150 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.098 -10.044 1.980 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.434 -10.046 1.348 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.934 -11.269 2.540 1.00 25.00 H new ATOM 1010 N LEU A 65 14.810 -14.348 0.988 1.00 25.00 N ATOM 1011 CA LEU A 65 13.765 -15.299 0.592 1.00 25.00 C ATOM 1012 C LEU A 65 12.968 -14.837 -0.626 1.00 25.00 C ATOM 1013 O LEU A 65 11.750 -14.969 -0.659 1.00 25.00 O ATOM 1014 CB LEU A 65 12.798 -15.511 1.759 1.00 25.00 C ATOM 1015 CG LEU A 65 13.413 -15.985 3.079 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.287 -16.091 4.100 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.140 -17.333 2.916 1.00 25.00 C ATOM 0 H LEU A 65 14.477 -13.585 1.578 1.00 25.00 H new ATOM 0 HA LEU A 65 14.270 -16.227 0.324 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.275 -14.572 1.944 1.00 25.00 H new ATOM 0 HB3 LEU A 65 12.047 -16.239 1.452 1.00 25.00 H new ATOM 0 HG LEU A 65 14.165 -15.270 3.414 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.692 -16.427 5.055 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.819 -15.115 4.228 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.544 -16.807 3.749 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.563 -17.636 3.874 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.432 -18.089 2.576 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.940 -17.229 2.183 1.00 25.00 H new ATOM 1029 N VAL A 66 13.651 -14.280 -1.613 1.00 25.00 N ATOM 1030 CA VAL A 66 12.973 -13.791 -2.820 1.00 25.00 C ATOM 1031 C VAL A 66 13.219 -14.699 -4.022 1.00 25.00 C ATOM 1032 O VAL A 66 12.283 -15.172 -4.646 1.00 25.00 O ATOM 1033 CB VAL A 66 13.412 -12.342 -3.180 1.00 25.00 C ATOM 1034 CG1 VAL A 66 12.704 -11.847 -4.459 1.00 25.00 C ATOM 1035 CG2 VAL A 66 13.083 -11.400 -2.031 1.00 25.00 C ATOM 0 H VAL A 66 14.663 -14.152 -1.611 1.00 25.00 H new ATOM 0 HA VAL A 66 11.908 -13.795 -2.588 1.00 25.00 H new ATOM 0 HB VAL A 66 14.487 -12.352 -3.357 1.00 25.00 H new ATOM 0 HG11 VAL A 66 13.030 -10.832 -4.686 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.956 -12.504 -5.292 1.00 25.00 H new ATOM 0 HG13 VAL A 66 11.625 -11.855 -4.304 1.00 25.00 H new ATOM 0 HG21 VAL A 66 13.393 -10.388 -2.290 1.00 25.00 H new ATOM 0 HG22 VAL A 66 12.009 -11.414 -1.845 1.00 25.00 H new ATOM 0 HG23 VAL A 66 13.611 -11.723 -1.134 1.00 25.00 H new ATOM 1045 N GLY A 67 14.475 -14.911 -4.380 1.00 25.00 N ATOM 1046 CA GLY A 67 14.769 -15.595 -5.626 1.00 25.00 C ATOM 1047 C GLY A 67 14.614 -14.574 -6.737 1.00 25.00 C ATOM 1048 O GLY A 67 15.505 -13.756 -6.934 1.00 25.00 O ATOM 0 H GLY A 67 15.291 -14.626 -3.838 1.00 25.00 H new ATOM 0 HA2 GLY A 67 15.780 -16.002 -5.614 1.00 25.00 H new ATOM 0 HA3 GLY A 67 14.090 -16.434 -5.775 1.00 25.00 H new ATOM 1052 N MET A 68 13.466 -14.560 -7.406 1.00 25.00 N ATOM 1053 CA MET A 68 13.187 -13.561 -8.441 1.00 25.00 C ATOM 1054 C MET A 68 11.685 -13.278 -8.521 1.00 25.00 C ATOM 1055 O MET A 68 10.914 -14.117 -8.971 1.00 25.00 O ATOM 1056 CB MET A 68 13.710 -14.051 -9.803 1.00 25.00 C ATOM 1057 CG MET A 68 13.946 -12.938 -10.832 1.00 25.00 C ATOM 1058 SD MET A 68 12.426 -12.166 -11.449 1.00 25.00 S ATOM 1059 CE MET A 68 12.651 -10.441 -10.934 1.00 25.00 C ATOM 0 H MET A 68 12.711 -15.228 -7.253 1.00 25.00 H new ATOM 0 HA MET A 68 13.699 -12.635 -8.179 1.00 25.00 H new ATOM 0 HB2 MET A 68 14.645 -14.588 -9.647 1.00 25.00 H new ATOM 0 HB3 MET A 68 12.997 -14.765 -10.216 1.00 25.00 H new ATOM 0 HG2 MET A 68 14.574 -12.169 -10.382 1.00 25.00 H new ATOM 0 HG3 MET A 68 14.500 -13.349 -11.676 1.00 25.00 H new ATOM 0 HE1 MET A 68 11.790 -9.852 -11.249 1.00 25.00 H new ATOM 0 HE2 MET A 68 12.745 -10.395 -9.849 1.00 25.00 H new ATOM 0 HE3 MET A 68 13.553 -10.039 -11.394 1.00 25.00 H new ATOM 1069 N TYR A 69 11.283 -12.095 -8.074 1.00 25.00 N ATOM 1070 CA TYR A 69 9.892 -11.653 -8.163 1.00 25.00 C ATOM 1071 C TYR A 69 9.866 -10.150 -8.371 1.00 25.00 C ATOM 1072 O TYR A 69 10.718 -9.438 -7.851 1.00 25.00 O ATOM 1073 CB TYR A 69 9.124 -11.939 -6.870 1.00 25.00 C ATOM 1074 CG TYR A 69 8.733 -13.378 -6.669 1.00 25.00 C ATOM 1075 CD1 TYR A 69 7.479 -13.851 -7.109 1.00 25.00 C ATOM 1076 CD2 TYR A 69 9.599 -14.276 -6.027 1.00 25.00 C ATOM 1077 CE1 TYR A 69 7.098 -15.204 -6.902 1.00 25.00 C ATOM 1078 CE2 TYR A 69 9.224 -15.629 -5.817 1.00 25.00 C ATOM 1079 CZ TYR A 69 7.973 -16.076 -6.252 1.00 25.00 C ATOM 1080 OH TYR A 69 7.602 -17.378 -6.041 1.00 25.00 O ATOM 0 H TYR A 69 11.908 -11.415 -7.641 1.00 25.00 H new ATOM 0 HA TYR A 69 9.427 -12.192 -8.989 1.00 25.00 H new ATOM 0 HB2 TYR A 69 9.735 -11.622 -6.025 1.00 25.00 H new ATOM 0 HB3 TYR A 69 8.222 -11.328 -6.858 1.00 25.00 H new ATOM 0 HD1 TYR A 69 6.800 -13.176 -7.609 1.00 25.00 H new ATOM 0 HD2 TYR A 69 10.565 -13.933 -5.688 1.00 25.00 H new ATOM 0 HE1 TYR A 69 6.137 -15.556 -7.246 1.00 25.00 H new ATOM 0 HE2 TYR A 69 9.902 -16.310 -5.324 1.00 25.00 H new ATOM 0 HH TYR A 69 8.323 -17.853 -5.578 1.00 25.00 H new ATOM 1090 N ASP A 70 8.846 -9.679 -9.071 1.00 25.00 N ATOM 1091 CA ASP A 70 8.586 -8.242 -9.213 1.00 25.00 C ATOM 1092 C ASP A 70 7.725 -7.760 -8.039 1.00 25.00 C ATOM 1093 O ASP A 70 7.735 -6.591 -7.662 1.00 25.00 O ATOM 1094 CB ASP A 70 7.827 -7.991 -10.518 1.00 25.00 C ATOM 1095 CG ASP A 70 7.489 -6.525 -10.720 1.00 25.00 C ATOM 1096 OD1 ASP A 70 6.280 -6.207 -10.785 1.00 25.00 O ATOM 1097 OD2 ASP A 70 8.408 -5.700 -10.827 1.00 25.00 O ATOM 0 H ASP A 70 8.174 -10.273 -9.557 1.00 25.00 H new ATOM 0 HA ASP A 70 9.533 -7.703 -9.223 1.00 25.00 H new ATOM 0 HB2 ASP A 70 8.428 -8.341 -11.357 1.00 25.00 H new ATOM 0 HB3 ASP A 70 6.907 -8.576 -10.518 1.00 25.00 H new ATOM 1102 N LYS A 71 6.961 -8.682 -7.465 1.00 25.00 N ATOM 1103 CA LYS A 71 6.038 -8.348 -6.379 1.00 25.00 C ATOM 1104 C LYS A 71 6.524 -8.929 -5.061 1.00 25.00 C ATOM 1105 O LYS A 71 7.319 -9.857 -5.033 1.00 25.00 O ATOM 1106 CB LYS A 71 4.627 -8.872 -6.692 1.00 25.00 C ATOM 1107 CG LYS A 71 4.068 -8.463 -8.075 1.00 25.00 C ATOM 1108 CD LYS A 71 4.014 -6.943 -8.278 1.00 25.00 C ATOM 1109 CE LYS A 71 3.352 -6.603 -9.612 1.00 25.00 C ATOM 1110 NZ LYS A 71 3.772 -5.239 -10.088 1.00 25.00 N ATOM 0 H LYS A 71 6.960 -9.667 -7.731 1.00 25.00 H new ATOM 0 HA LYS A 71 6.001 -7.262 -6.289 1.00 25.00 H new ATOM 0 HB2 LYS A 71 4.638 -9.960 -6.629 1.00 25.00 H new ATOM 0 HB3 LYS A 71 3.944 -8.515 -5.921 1.00 25.00 H new ATOM 0 HG2 LYS A 71 4.687 -8.906 -8.856 1.00 25.00 H new ATOM 0 HG3 LYS A 71 3.065 -8.875 -8.191 1.00 25.00 H new ATOM 0 HD2 LYS A 71 3.459 -6.481 -7.462 1.00 25.00 H new ATOM 0 HD3 LYS A 71 5.023 -6.531 -8.251 1.00 25.00 H new ATOM 0 HE2 LYS A 71 3.621 -7.351 -10.357 1.00 25.00 H new ATOM 0 HE3 LYS A 71 2.268 -6.637 -9.504 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 3.143 -4.931 -10.857 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 3.713 -4.563 -9.300 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 4.751 -5.279 -10.437 1.00 25.00 H new ATOM 1124 N LYS A 72 6.027 -8.379 -3.966 1.00 25.00 N ATOM 1125 CA LYS A 72 6.374 -8.862 -2.628 1.00 25.00 C ATOM 1126 C LYS A 72 5.528 -10.102 -2.350 1.00 25.00 C ATOM 1127 O LYS A 72 4.467 -10.253 -2.944 1.00 25.00 O ATOM 1128 CB LYS A 72 6.083 -7.769 -1.593 1.00 25.00 C ATOM 1129 CG LYS A 72 6.941 -6.535 -1.793 1.00 25.00 C ATOM 1130 CD LYS A 72 6.676 -5.498 -0.718 1.00 25.00 C ATOM 1131 CE LYS A 72 7.521 -4.257 -0.951 1.00 25.00 C ATOM 1132 NZ LYS A 72 7.155 -3.557 -2.224 1.00 25.00 N ATOM 0 H LYS A 72 5.377 -7.593 -3.972 1.00 25.00 H new ATOM 0 HA LYS A 72 7.433 -9.111 -2.567 1.00 25.00 H new ATOM 0 HB2 LYS A 72 5.031 -7.489 -1.651 1.00 25.00 H new ATOM 0 HB3 LYS A 72 6.252 -8.167 -0.592 1.00 25.00 H new ATOM 0 HG2 LYS A 72 7.994 -6.816 -1.778 1.00 25.00 H new ATOM 0 HG3 LYS A 72 6.739 -6.105 -2.774 1.00 25.00 H new ATOM 0 HD2 LYS A 72 5.619 -5.230 -0.717 1.00 25.00 H new ATOM 0 HD3 LYS A 72 6.900 -5.918 0.263 1.00 25.00 H new ATOM 0 HE2 LYS A 72 7.397 -3.572 -0.112 1.00 25.00 H new ATOM 0 HE3 LYS A 72 8.574 -4.536 -0.981 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 7.548 -2.594 -2.216 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 7.543 -4.083 -3.033 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 6.120 -3.508 -2.308 1.00 25.00 H new ATOM 1146 N PRO A 73 5.961 -10.978 -1.418 1.00 25.00 N ATOM 1147 CA PRO A 73 5.140 -12.167 -1.146 1.00 25.00 C ATOM 1148 C PRO A 73 3.803 -11.878 -0.454 1.00 25.00 C ATOM 1149 O PRO A 73 2.940 -12.742 -0.416 1.00 25.00 O ATOM 1150 CB PRO A 73 6.051 -13.007 -0.244 1.00 25.00 C ATOM 1151 CG PRO A 73 6.877 -12.008 0.468 1.00 25.00 C ATOM 1152 CD PRO A 73 7.184 -10.977 -0.587 1.00 25.00 C ATOM 0 HA PRO A 73 4.836 -12.654 -2.073 1.00 25.00 H new ATOM 0 HB2 PRO A 73 5.472 -13.614 0.452 1.00 25.00 H new ATOM 0 HB3 PRO A 73 6.668 -13.691 -0.827 1.00 25.00 H new ATOM 0 HG2 PRO A 73 6.339 -11.571 1.310 1.00 25.00 H new ATOM 0 HG3 PRO A 73 7.787 -12.454 0.868 1.00 25.00 H new ATOM 0 HD2 PRO A 73 7.374 -9.997 -0.150 1.00 25.00 H new ATOM 0 HD3 PRO A 73 8.067 -11.244 -1.168 1.00 25.00 H new ATOM 1160 N ALA A 74 3.648 -10.664 0.074 1.00 25.00 N ATOM 1161 CA ALA A 74 2.401 -10.207 0.709 1.00 25.00 C ATOM 1162 C ALA A 74 1.893 -11.154 1.814 1.00 25.00 C ATOM 1163 O ALA A 74 0.693 -11.330 1.994 1.00 25.00 O ATOM 1164 CB ALA A 74 1.313 -9.985 -0.368 1.00 25.00 C ATOM 0 H ALA A 74 4.387 -9.961 0.076 1.00 25.00 H new ATOM 0 HA ALA A 74 2.626 -9.263 1.205 1.00 25.00 H new ATOM 0 HB1 ALA A 74 0.393 -9.647 0.109 1.00 25.00 H new ATOM 0 HB2 ALA A 74 1.652 -9.231 -1.078 1.00 25.00 H new ATOM 0 HB3 ALA A 74 1.126 -10.921 -0.895 1.00 25.00 H new ATOM 1170 N GLY A 75 2.818 -11.743 2.556 1.00 25.00 N ATOM 1171 CA GLY A 75 2.465 -12.653 3.628 1.00 25.00 C ATOM 1172 C GLY A 75 3.665 -12.829 4.529 1.00 25.00 C ATOM 1173 O GLY A 75 4.697 -12.193 4.303 1.00 25.00 O ATOM 0 H GLY A 75 3.821 -11.605 2.433 1.00 25.00 H new ATOM 0 HA2 GLY A 75 1.621 -12.260 4.195 1.00 25.00 H new ATOM 0 HA3 GLY A 75 2.154 -13.615 3.220 1.00 25.00 H new ATOM 1177 N SER A 76 3.543 -13.663 5.550 1.00 25.00 N ATOM 1178 CA SER A 76 4.626 -13.889 6.507 1.00 25.00 C ATOM 1179 C SER A 76 4.596 -15.342 6.966 1.00 25.00 C ATOM 1180 O SER A 76 3.607 -16.034 6.755 1.00 25.00 O ATOM 1181 CB SER A 76 4.453 -12.961 7.710 1.00 25.00 C ATOM 1182 OG SER A 76 4.462 -11.608 7.288 1.00 25.00 O ATOM 0 H SER A 76 2.698 -14.201 5.742 1.00 25.00 H new ATOM 0 HA SER A 76 5.584 -13.678 6.031 1.00 25.00 H new ATOM 0 HB2 SER A 76 3.516 -13.185 8.220 1.00 25.00 H new ATOM 0 HB3 SER A 76 5.255 -13.131 8.428 1.00 25.00 H new ATOM 0 HG SER A 76 4.349 -11.022 8.065 1.00 25.00 H new ATOM 1188 N GLY A 77 5.671 -15.791 7.597 1.00 25.00 N ATOM 1189 CA GLY A 77 5.747 -17.151 8.103 1.00 25.00 C ATOM 1190 C GLY A 77 6.905 -17.220 9.073 1.00 25.00 C ATOM 1191 O GLY A 77 7.635 -16.241 9.196 1.00 25.00 O ATOM 0 H GLY A 77 6.505 -15.230 7.771 1.00 25.00 H new ATOM 0 HA2 GLY A 77 4.816 -17.426 8.599 1.00 25.00 H new ATOM 0 HA3 GLY A 77 5.892 -17.856 7.284 1.00 25.00 H new ATOM 1195 N GLY A 78 7.065 -18.340 9.767 1.00 25.00 N ATOM 1196 CA GLY A 78 8.115 -18.475 10.771 1.00 25.00 C ATOM 1197 C GLY A 78 8.981 -19.711 10.592 1.00 25.00 C ATOM 1198 O GLY A 78 9.159 -20.212 9.473 1.00 25.00 O ATOM 0 H GLY A 78 6.481 -19.169 9.654 1.00 25.00 H new ATOM 0 HA2 GLY A 78 8.751 -17.590 10.739 1.00 25.00 H new ATOM 0 HA3 GLY A 78 7.657 -18.504 11.760 1.00 25.00 H new ATOM 1202 N SER A 79 9.506 -20.209 11.704 1.00 25.00 N ATOM 1203 CA SER A 79 10.324 -21.422 11.730 1.00 25.00 C ATOM 1204 C SER A 79 10.007 -22.182 13.007 1.00 25.00 C ATOM 1205 O SER A 79 9.482 -21.603 13.950 1.00 25.00 O ATOM 1206 CB SER A 79 11.810 -21.068 11.742 1.00 25.00 C ATOM 1207 OG SER A 79 12.164 -20.353 10.578 1.00 25.00 O ATOM 0 H SER A 79 9.377 -19.782 12.621 1.00 25.00 H new ATOM 0 HA SER A 79 10.105 -22.019 10.845 1.00 25.00 H new ATOM 0 HB2 SER A 79 12.039 -20.471 12.625 1.00 25.00 H new ATOM 0 HB3 SER A 79 12.405 -21.979 11.810 1.00 25.00 H new ATOM 0 HG SER A 79 12.275 -19.404 10.798 1.00 25.00 H new ATOM 1213 N GLY A 80 10.364 -23.457 13.045 1.00 25.00 N ATOM 1214 CA GLY A 80 10.204 -24.256 14.249 1.00 25.00 C ATOM 1215 C GLY A 80 11.416 -25.146 14.423 1.00 25.00 C ATOM 1216 O GLY A 80 11.616 -26.069 13.643 1.00 25.00 O ATOM 0 H GLY A 80 10.767 -23.960 12.255 1.00 25.00 H new ATOM 0 HA2 GLY A 80 10.087 -23.607 15.117 1.00 25.00 H new ATOM 0 HA3 GLY A 80 9.300 -24.862 14.180 1.00 25.00 H new ATOM 1220 N SER A 81 12.247 -24.849 15.411 1.00 25.00 N ATOM 1221 CA SER A 81 13.458 -25.626 15.670 1.00 25.00 C ATOM 1222 C SER A 81 13.828 -25.454 17.133 1.00 25.00 C ATOM 1223 O SER A 81 13.679 -24.364 17.677 1.00 25.00 O ATOM 1224 CB SER A 81 14.606 -25.123 14.789 1.00 25.00 C ATOM 1225 OG SER A 81 14.764 -23.720 14.923 1.00 25.00 O ATOM 0 H SER A 81 12.106 -24.069 16.053 1.00 25.00 H new ATOM 0 HA SER A 81 13.280 -26.677 15.442 1.00 25.00 H new ATOM 0 HB2 SER A 81 15.532 -25.626 15.067 1.00 25.00 H new ATOM 0 HB3 SER A 81 14.408 -25.374 13.747 1.00 25.00 H new ATOM 0 HG SER A 81 15.503 -23.418 14.354 1.00 25.00 H new ATOM 1231 N GLY A 82 14.298 -26.523 17.764 1.00 25.00 N ATOM 1232 CA GLY A 82 14.671 -26.468 19.173 1.00 25.00 C ATOM 1233 C GLY A 82 16.147 -26.714 19.413 1.00 25.00 C ATOM 1234 O GLY A 82 16.606 -26.650 20.544 1.00 25.00 O ATOM 0 H GLY A 82 14.430 -27.434 17.326 1.00 25.00 H new ATOM 0 HA2 GLY A 82 14.403 -25.491 19.575 1.00 25.00 H new ATOM 0 HA3 GLY A 82 14.092 -27.209 19.724 1.00 25.00 H new ATOM 1238 N LEU A 83 16.883 -27.016 18.351 1.00 25.00 N ATOM 1239 CA LEU A 83 18.309 -27.326 18.448 1.00 25.00 C ATOM 1240 C LEU A 83 19.058 -26.478 17.429 1.00 25.00 C ATOM 1241 O LEU A 83 18.497 -26.125 16.387 1.00 25.00 O ATOM 1242 CB LEU A 83 18.576 -28.806 18.161 1.00 25.00 C ATOM 1243 CG LEU A 83 18.107 -29.824 19.215 1.00 25.00 C ATOM 1244 CD1 LEU A 83 16.658 -30.263 18.991 1.00 25.00 C ATOM 1245 CD2 LEU A 83 19.020 -31.035 19.172 1.00 25.00 C ATOM 0 H LEU A 83 16.513 -27.054 17.401 1.00 25.00 H new ATOM 0 HA LEU A 83 18.648 -27.109 19.461 1.00 25.00 H new ATOM 0 HB2 LEU A 83 18.099 -29.057 17.214 1.00 25.00 H new ATOM 0 HB3 LEU A 83 19.649 -28.935 18.022 1.00 25.00 H new ATOM 0 HG LEU A 83 18.153 -29.343 20.192 1.00 25.00 H new ATOM 0 HD11 LEU A 83 16.373 -30.981 19.759 1.00 25.00 H new ATOM 0 HD12 LEU A 83 16.002 -29.394 19.045 1.00 25.00 H new ATOM 0 HD13 LEU A 83 16.566 -30.727 18.009 1.00 25.00 H new ATOM 0 HD21 LEU A 83 18.695 -31.762 19.916 1.00 25.00 H new ATOM 0 HD22 LEU A 83 18.979 -31.487 18.181 1.00 25.00 H new ATOM 0 HD23 LEU A 83 20.043 -30.727 19.388 1.00 25.00 H new ATOM 1257 N THR A 84 20.305 -26.148 17.733 1.00 25.00 N ATOM 1258 CA THR A 84 21.151 -25.343 16.844 1.00 25.00 C ATOM 1259 C THR A 84 22.583 -25.862 16.874 1.00 25.00 C ATOM 1260 O THR A 84 23.492 -25.219 17.389 1.00 25.00 O ATOM 1261 CB THR A 84 21.171 -23.862 17.246 1.00 25.00 C ATOM 1262 OG1 THR A 84 21.439 -23.745 18.648 1.00 25.00 O ATOM 1263 CG2 THR A 84 19.840 -23.188 16.960 1.00 25.00 C ATOM 0 H THR A 84 20.764 -26.427 18.600 1.00 25.00 H new ATOM 0 HA THR A 84 20.726 -25.428 15.844 1.00 25.00 H new ATOM 0 HB THR A 84 21.950 -23.374 16.660 1.00 25.00 H new ATOM 0 HG1 THR A 84 22.322 -24.121 18.845 1.00 25.00 H new ATOM 0 HG21 THR A 84 19.891 -22.141 17.257 1.00 25.00 H new ATOM 0 HG22 THR A 84 19.621 -23.252 15.894 1.00 25.00 H new ATOM 0 HG23 THR A 84 19.051 -23.687 17.523 1.00 25.00 H new ATOM 1271 N ASP A 85 22.753 -27.056 16.348 1.00 25.00 N ATOM 1272 CA ASP A 85 24.033 -27.771 16.384 1.00 25.00 C ATOM 1273 C ASP A 85 24.921 -27.433 15.184 1.00 25.00 C ATOM 1274 O ASP A 85 25.361 -28.309 14.450 1.00 25.00 O ATOM 1275 CB ASP A 85 23.755 -29.270 16.411 1.00 25.00 C ATOM 1276 CG ASP A 85 22.692 -29.634 17.421 1.00 25.00 C ATOM 1277 OD1 ASP A 85 22.926 -29.497 18.641 1.00 25.00 O ATOM 1278 OD2 ASP A 85 21.563 -29.941 16.980 1.00 25.00 O ATOM 0 H ASP A 85 22.008 -27.571 15.878 1.00 25.00 H new ATOM 0 HA ASP A 85 24.571 -27.460 17.280 1.00 25.00 H new ATOM 0 HB2 ASP A 85 23.440 -29.598 15.420 1.00 25.00 H new ATOM 0 HB3 ASP A 85 24.675 -29.805 16.646 1.00 25.00 H new ATOM 1283 N GLU A 86 25.150 -26.147 14.970 1.00 25.00 N ATOM 1284 CA GLU A 86 25.957 -25.668 13.867 1.00 25.00 C ATOM 1285 C GLU A 86 26.454 -24.296 14.274 1.00 25.00 C ATOM 1286 O GLU A 86 25.731 -23.517 14.905 1.00 25.00 O ATOM 1287 CB GLU A 86 25.141 -25.570 12.575 1.00 25.00 C ATOM 1288 CG GLU A 86 25.757 -26.336 11.405 1.00 25.00 C ATOM 1289 CD GLU A 86 27.043 -25.694 10.889 1.00 25.00 C ATOM 1290 OE1 GLU A 86 28.074 -25.727 11.604 1.00 25.00 O ATOM 1291 OE2 GLU A 86 27.010 -25.147 9.768 1.00 25.00 O ATOM 0 H GLU A 86 24.778 -25.405 15.562 1.00 25.00 H new ATOM 0 HA GLU A 86 26.778 -26.356 13.666 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.136 -25.951 12.759 1.00 25.00 H new ATOM 0 HB3 GLU A 86 25.038 -24.521 12.298 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.967 -27.359 11.717 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.033 -26.393 10.592 1.00 25.00 H new ATOM 1298 N LEU A 87 27.698 -24.027 13.940 1.00 25.00 N ATOM 1299 CA LEU A 87 28.361 -22.775 14.297 1.00 25.00 C ATOM 1300 C LEU A 87 28.200 -21.753 13.183 1.00 25.00 C ATOM 1301 O LEU A 87 28.156 -22.091 12.010 1.00 25.00 O ATOM 1302 CB LEU A 87 29.849 -23.018 14.558 1.00 25.00 C ATOM 1303 CG LEU A 87 30.174 -23.959 15.734 1.00 25.00 C ATOM 1304 CD1 LEU A 87 31.680 -24.204 15.785 1.00 25.00 C ATOM 1305 CD2 LEU A 87 29.702 -23.377 17.077 1.00 25.00 C ATOM 0 H LEU A 87 28.287 -24.669 13.410 1.00 25.00 H new ATOM 0 HA LEU A 87 27.897 -22.389 15.204 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.296 -23.429 13.653 1.00 25.00 H new ATOM 0 HB3 LEU A 87 30.329 -22.057 14.742 1.00 25.00 H new ATOM 0 HG LEU A 87 29.643 -24.897 15.572 1.00 25.00 H new ATOM 0 HD11 LEU A 87 31.912 -24.870 16.616 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.006 -24.662 14.851 1.00 25.00 H new ATOM 0 HD13 LEU A 87 32.198 -23.255 15.924 1.00 25.00 H new ATOM 0 HD21 LEU A 87 29.950 -24.070 17.881 1.00 25.00 H new ATOM 0 HD22 LEU A 87 30.198 -22.423 17.255 1.00 25.00 H new ATOM 0 HD23 LEU A 87 28.623 -23.225 17.048 1.00 25.00 H new ATOM 1317 N ALA A 88 28.096 -20.491 13.562 1.00 25.00 N ATOM 1318 CA ALA A 88 27.878 -19.434 12.590 1.00 25.00 C ATOM 1319 C ALA A 88 29.192 -18.944 11.963 1.00 25.00 C ATOM 1320 O ALA A 88 30.212 -18.845 12.649 1.00 25.00 O ATOM 1321 CB ALA A 88 27.153 -18.277 13.261 1.00 25.00 C ATOM 0 H ALA A 88 28.159 -20.175 14.530 1.00 25.00 H new ATOM 0 HA ALA A 88 27.269 -19.839 11.782 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.987 -17.481 12.535 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.194 -18.623 13.646 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.758 -17.897 14.084 1.00 25.00 H new ATOM 1327 N PRO A 89 29.159 -18.548 10.675 1.00 25.00 N ATOM 1328 CA PRO A 89 30.357 -17.957 10.072 1.00 25.00 C ATOM 1329 C PRO A 89 30.625 -16.568 10.645 1.00 25.00 C ATOM 1330 O PRO A 89 29.760 -15.989 11.321 1.00 25.00 O ATOM 1331 CB PRO A 89 29.988 -17.892 8.587 1.00 25.00 C ATOM 1332 CG PRO A 89 28.527 -17.720 8.587 1.00 25.00 C ATOM 1333 CD PRO A 89 28.040 -18.579 9.714 1.00 25.00 C ATOM 0 HA PRO A 89 31.268 -18.524 10.261 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.487 -17.061 8.088 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.282 -18.801 8.063 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.252 -16.676 8.738 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.092 -18.030 7.637 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.123 -18.185 10.152 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.824 -19.594 9.381 1.00 25.00 H new ATOM 1341 N PRO A 90 31.819 -16.007 10.395 1.00 25.00 N ATOM 1342 CA PRO A 90 32.079 -14.684 10.971 1.00 25.00 C ATOM 1343 C PRO A 90 31.243 -13.580 10.325 1.00 25.00 C ATOM 1344 O PRO A 90 30.706 -13.741 9.226 1.00 25.00 O ATOM 1345 CB PRO A 90 33.573 -14.483 10.702 1.00 25.00 C ATOM 1346 CG PRO A 90 33.830 -15.258 9.469 1.00 25.00 C ATOM 1347 CD PRO A 90 32.971 -16.489 9.607 1.00 25.00 C ATOM 0 HA PRO A 90 31.812 -14.632 12.026 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.814 -13.429 10.567 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.179 -14.845 11.533 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.564 -14.687 8.579 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.884 -15.519 9.377 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.662 -16.876 8.636 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.500 -17.294 10.117 1.00 25.00 H new ATOM 1355 N LYS A 91 31.140 -12.458 11.021 1.00 25.00 N ATOM 1356 CA LYS A 91 30.461 -11.277 10.502 1.00 25.00 C ATOM 1357 C LYS A 91 31.553 -10.413 9.877 1.00 25.00 C ATOM 1358 O LYS A 91 32.711 -10.501 10.290 1.00 25.00 O ATOM 1359 CB LYS A 91 29.746 -10.510 11.639 1.00 25.00 C ATOM 1360 CG LYS A 91 30.644 -10.173 12.851 1.00 25.00 C ATOM 1361 CD LYS A 91 29.960 -9.243 13.871 1.00 25.00 C ATOM 1362 CE LYS A 91 28.731 -9.881 14.531 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.202 -9.027 15.646 1.00 25.00 N ATOM 0 H LYS A 91 31.523 -12.339 11.959 1.00 25.00 H new ATOM 0 HA LYS A 91 29.694 -11.546 9.775 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.340 -9.582 11.235 1.00 25.00 H new ATOM 0 HB3 LYS A 91 28.900 -11.104 11.984 1.00 25.00 H new ATOM 0 HG2 LYS A 91 30.934 -11.098 13.349 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.561 -9.702 12.496 1.00 25.00 H new ATOM 0 HD2 LYS A 91 30.679 -8.968 14.643 1.00 25.00 H new ATOM 0 HD3 LYS A 91 29.660 -8.322 13.371 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.951 -10.030 13.784 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.994 -10.865 14.918 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 27.163 -9.060 15.645 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.559 -9.383 16.556 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 28.518 -8.045 15.511 1.00 25.00 H new ATOM 1377 N PRO A 92 31.210 -9.585 8.879 1.00 25.00 N ATOM 1378 CA PRO A 92 32.246 -8.663 8.406 1.00 25.00 C ATOM 1379 C PRO A 92 32.533 -7.628 9.506 1.00 25.00 C ATOM 1380 O PRO A 92 31.691 -7.410 10.379 1.00 25.00 O ATOM 1381 CB PRO A 92 31.616 -8.043 7.153 1.00 25.00 C ATOM 1382 CG PRO A 92 30.158 -8.124 7.386 1.00 25.00 C ATOM 1383 CD PRO A 92 29.924 -9.371 8.188 1.00 25.00 C ATOM 0 HA PRO A 92 33.206 -9.125 8.178 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.938 -7.011 7.017 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.904 -8.588 6.254 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.801 -7.245 7.923 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.616 -8.163 6.441 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.105 -9.245 8.896 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.666 -10.216 7.549 1.00 25.00 H new ATOM 1391 N PRO A 93 33.732 -7.021 9.509 1.00 25.00 N ATOM 1392 CA PRO A 93 34.047 -6.081 10.593 1.00 25.00 C ATOM 1393 C PRO A 93 33.326 -4.744 10.448 1.00 25.00 C ATOM 1394 O PRO A 93 32.648 -4.490 9.442 1.00 25.00 O ATOM 1395 CB PRO A 93 35.560 -5.906 10.456 1.00 25.00 C ATOM 1396 CG PRO A 93 35.797 -6.039 9.007 1.00 25.00 C ATOM 1397 CD PRO A 93 34.866 -7.147 8.572 1.00 25.00 C ATOM 0 HA PRO A 93 33.728 -6.451 11.567 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.886 -4.935 10.828 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.104 -6.663 11.022 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.580 -5.109 8.482 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.837 -6.288 8.796 1.00 25.00 H new ATOM 0 HD2 PRO A 93 34.549 -7.023 7.537 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.342 -8.125 8.645 1.00 25.00 H new ATOM 1405 N LEU A 94 33.483 -3.893 11.449 1.00 25.00 N ATOM 1406 CA LEU A 94 32.852 -2.579 11.474 1.00 25.00 C ATOM 1407 C LEU A 94 33.862 -1.471 11.813 1.00 25.00 C ATOM 1408 O LEU A 94 34.941 -1.740 12.333 1.00 25.00 O ATOM 1409 CB LEU A 94 31.722 -2.600 12.515 1.00 25.00 C ATOM 1410 CG LEU A 94 30.401 -3.205 12.037 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.427 -3.248 13.161 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.781 -2.401 10.909 1.00 25.00 C ATOM 0 H LEU A 94 34.053 -4.093 12.271 1.00 25.00 H new ATOM 0 HA LEU A 94 32.453 -2.361 10.483 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.064 -3.159 13.386 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.536 -1.578 12.845 1.00 25.00 H new ATOM 0 HG LEU A 94 30.624 -4.208 11.674 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.489 -3.680 12.813 1.00 25.00 H new ATOM 0 HD12 LEU A 94 29.830 -3.859 13.969 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.248 -2.237 13.526 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.845 -2.867 10.602 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.585 -1.385 11.251 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.467 -2.372 10.063 1.00 25.00 H new ATOM 1424 N PRO A 95 33.521 -0.204 11.503 1.00 25.00 N ATOM 1425 CA PRO A 95 34.380 0.937 11.836 1.00 25.00 C ATOM 1426 C PRO A 95 34.311 1.318 13.329 1.00 25.00 C ATOM 1427 O PRO A 95 33.854 0.540 14.154 1.00 25.00 O ATOM 1428 CB PRO A 95 33.804 2.043 10.941 1.00 25.00 C ATOM 1429 CG PRO A 95 32.367 1.752 10.928 1.00 25.00 C ATOM 1430 CD PRO A 95 32.291 0.249 10.824 1.00 25.00 C ATOM 0 HA PRO A 95 35.439 0.738 11.670 1.00 25.00 H new ATOM 0 HB2 PRO A 95 34.010 3.035 11.344 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.230 2.012 9.938 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.880 2.113 11.834 1.00 25.00 H new ATOM 0 HG3 PRO A 95 31.871 2.234 10.086 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.397 -0.143 11.309 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.261 -0.081 9.786 1.00 25.00 H new ATOM 1438 N GLU A 96 34.788 2.521 13.649 1.00 25.00 N ATOM 1439 CA GLU A 96 34.793 3.096 15.008 1.00 25.00 C ATOM 1440 C GLU A 96 35.632 2.312 16.025 1.00 25.00 C ATOM 1441 O GLU A 96 35.622 2.586 17.219 1.00 25.00 O ATOM 1442 CB GLU A 96 33.359 3.297 15.514 1.00 25.00 C ATOM 1443 CG GLU A 96 33.198 4.509 16.450 1.00 25.00 C ATOM 1444 CD GLU A 96 31.957 4.425 17.337 1.00 25.00 C ATOM 1445 OE1 GLU A 96 31.993 4.992 18.453 1.00 25.00 O ATOM 1446 OE2 GLU A 96 30.940 3.835 16.911 1.00 25.00 O ATOM 0 H GLU A 96 35.195 3.147 12.954 1.00 25.00 H new ATOM 0 HA GLU A 96 35.285 4.064 14.917 1.00 25.00 H new ATOM 0 HB2 GLU A 96 32.695 3.419 14.658 1.00 25.00 H new ATOM 0 HB3 GLU A 96 33.039 2.398 16.040 1.00 25.00 H new ATOM 0 HG2 GLU A 96 34.083 4.592 17.081 1.00 25.00 H new ATOM 0 HG3 GLU A 96 33.147 5.418 15.851 1.00 25.00 H new ATOM 1453 N GLY A 97 36.431 1.392 15.517 1.00 25.00 N ATOM 1454 CA GLY A 97 37.344 0.633 16.360 1.00 25.00 C ATOM 1455 C GLY A 97 36.858 -0.766 16.678 1.00 25.00 C ATOM 1456 O GLY A 97 37.493 -1.480 17.457 1.00 25.00 O ATOM 0 H GLY A 97 36.468 1.150 14.527 1.00 25.00 H new ATOM 0 HA2 GLY A 97 38.313 0.568 15.865 1.00 25.00 H new ATOM 0 HA3 GLY A 97 37.499 1.175 17.293 1.00 25.00 H new ATOM 1460 N GLU A 98 35.764 -1.179 16.056 1.00 25.00 N ATOM 1461 CA GLU A 98 35.289 -2.551 16.189 1.00 25.00 C ATOM 1462 C GLU A 98 36.354 -3.451 15.534 1.00 25.00 C ATOM 1463 O GLU A 98 37.037 -3.058 14.585 1.00 25.00 O ATOM 1464 CB GLU A 98 33.913 -2.694 15.529 1.00 25.00 C ATOM 1465 CG GLU A 98 33.126 -3.942 15.930 1.00 25.00 C ATOM 1466 CD GLU A 98 33.692 -5.207 15.315 1.00 25.00 C ATOM 1467 OE1 GLU A 98 33.782 -5.295 14.072 1.00 25.00 O ATOM 1468 OE2 GLU A 98 34.134 -6.088 16.086 1.00 25.00 O ATOM 0 H GLU A 98 35.189 -0.587 15.456 1.00 25.00 H new ATOM 0 HA GLU A 98 35.158 -2.841 17.231 1.00 25.00 H new ATOM 0 HB2 GLU A 98 33.317 -1.814 15.773 1.00 25.00 H new ATOM 0 HB3 GLU A 98 34.045 -2.699 14.447 1.00 25.00 H new ATOM 0 HG2 GLU A 98 33.129 -4.037 17.016 1.00 25.00 H new ATOM 0 HG3 GLU A 98 32.086 -3.826 15.623 1.00 25.00 H new ATOM 1475 N VAL A 99 36.579 -4.633 16.111 1.00 25.00 N ATOM 1476 CA VAL A 99 37.685 -5.513 15.730 1.00 25.00 C ATOM 1477 C VAL A 99 37.370 -6.604 14.683 1.00 25.00 C ATOM 1478 O VAL A 99 38.228 -7.045 13.940 1.00 25.00 O ATOM 1479 CB VAL A 99 38.339 -6.108 17.012 1.00 25.00 C ATOM 1480 CG1 VAL A 99 38.968 -4.971 17.863 1.00 25.00 C ATOM 1481 CG2 VAL A 99 37.312 -6.897 17.871 1.00 25.00 C ATOM 1482 OXT VAL A 99 36.169 -7.113 14.697 1.00 25.00 O ATOM 0 H VAL A 99 35.996 -5.008 16.859 1.00 25.00 H new ATOM 0 HA VAL A 99 38.391 -4.875 15.199 1.00 25.00 H new ATOM 0 HB VAL A 99 39.115 -6.804 16.694 1.00 25.00 H new ATOM 0 HG11 VAL A 99 39.423 -5.396 18.758 1.00 25.00 H new ATOM 0 HG12 VAL A 99 39.730 -4.457 17.277 1.00 25.00 H new ATOM 0 HG13 VAL A 99 38.193 -4.261 18.152 1.00 25.00 H new ATOM 0 HG21 VAL A 99 37.808 -7.296 18.756 1.00 25.00 H new ATOM 0 HG22 VAL A 99 36.505 -6.231 18.177 1.00 25.00 H new ATOM 0 HG23 VAL A 99 36.902 -7.719 17.284 1.00 25.00 H new TER 1493 VAL A 99