USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 966 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 44 THR OG1 : rot 140:sc= 0 USER MOD Set 1.2: A 91 GLN : amide:sc= 1.06 K(o=1.1,f=-0.59) USER MOD Set 2.1: A 42 TYR OH : rot 166:sc= 0 USER MOD Set 2.2: A 66 SER OG : rot -103:sc= 0.587 USER MOD Set 3.1: A 11 THR OG1 : rot -176:sc= 0.359 USER MOD Set 3.2: A 14 SER OG : rot 144:sc= 1.3 USER MOD Set 4.1: A 4 LYS NZ :NH3+ -157:sc= 0.322 (180deg=-0.134) USER MOD Set 4.2: A 6 TYR OH : rot 180:sc= 0.54 USER MOD Single : A 1 SER N :NH3+ 167:sc= 0.0207 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0179 USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 5 ASN : amide:sc= -1.85! C(o=-1.9!,f=-3!) USER MOD Single : A 7 MET CE :methyl -101:sc= -0.0491 (180deg=-2.06) USER MOD Single : A 9 LYS NZ :NH3+ -170:sc= -0.0119 (180deg=-0.128) USER MOD Single : A 12 SER OG : rot -3:sc= 1.14 USER MOD Single : A 13 SER OG : rot 122:sc= 1.01 USER MOD Single : A 15 THR OG1 : rot 20:sc= 1.11 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0406 USER MOD Single : A 23 SER OG : rot 77:sc= 1.2 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 1:sc= 1.29 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.598 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -164:sc= 1.01 (180deg=0.586) USER MOD Single : A 40 ASN : amide:sc= 0.644 K(o=0.64,f=-3.5!) USER MOD Single : A 41 GLN : amide:sc= 1.04 K(o=1,f=-6.8!) USER MOD Single : A 46 TYR OH : rot 30:sc= -0.906 USER MOD Single : A 47 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.16) USER MOD Single : A 50 ASN : amide:sc=-0.00281 X(o=-0.0028,f=0) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0.648 K(o=0.65,f=-2.4!) USER MOD Single : A 57 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.19) USER MOD Single : A 58 GLN :FLIP amide:sc= -0.419 F(o=-2.2!,f=-0.42) USER MOD Single : A 62 THR OG1 : rot -170:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.136 X(o=-0.14,f=-0.029) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= -0.163 USER MOD Single : A 89 CYS SG : rot -28:sc= -2.46! USER MOD Single : A 94 HIS : no HE2:sc= -2.06 K(o=-2.1,f=-2.9) USER MOD Single : A 99 TYR OH : rot 180:sc= -0.136 USER MOD Single : A 100 ASN : amide:sc= 0.0343 K(o=0.034,f=-3.2!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 105 ASN : amide:sc= -2.33! C(o=-2.3!,f=-11!) USER MOD Single : A 108 TYR OH : rot -154:sc= 1.35 USER MOD Single : A 109 CYS SG : rot 180:sc= -0.379 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot 20:sc= -0.71 USER MOD Single : A 115 GLN : amide:sc= -0.756 X(o=-0.76,f=-0.79) USER MOD Single : A 120 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 121 HIS : no HE2:sc= 0.237 K(o=0.24,f=-1.1) USER MOD Single : A 131 LYS NZ :NH3+ 167:sc= -0.0647 (180deg=-0.262) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.990 6.584 -25.627 1.00 0.00 N ATOM 2 CA SER A 1 2.153 7.579 -24.997 1.00 0.00 C ATOM 3 C SER A 1 2.625 7.862 -23.556 1.00 0.00 C ATOM 4 O SER A 1 2.973 8.997 -23.230 1.00 0.00 O ATOM 5 CB SER A 1 0.701 7.122 -25.046 1.00 0.00 C ATOM 6 OG SER A 1 0.306 6.838 -26.392 1.00 0.00 O ATOM 0 H1 SER A 1 2.534 6.249 -26.500 1.00 0.00 H new ATOM 0 H2 SER A 1 3.914 7.003 -25.857 1.00 0.00 H new ATOM 0 H3 SER A 1 3.126 5.783 -24.978 1.00 0.00 H new ATOM 0 HA SER A 1 2.233 8.520 -25.541 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.573 6.233 -24.429 1.00 0.00 H new ATOM 0 HB3 SER A 1 0.057 7.895 -24.628 1.00 0.00 H new ATOM 0 HG SER A 1 -0.629 6.544 -26.404 1.00 0.00 H new ATOM 14 N ASN A 2 2.669 6.842 -22.713 1.00 0.00 N ATOM 15 CA ASN A 2 3.138 7.010 -21.333 1.00 0.00 C ATOM 16 C ASN A 2 4.267 6.048 -21.083 1.00 0.00 C ATOM 17 O ASN A 2 4.427 5.069 -21.834 1.00 0.00 O ATOM 18 CB ASN A 2 2.013 6.785 -20.294 1.00 0.00 C ATOM 19 CG ASN A 2 1.431 5.377 -20.319 1.00 0.00 C ATOM 20 OD1 ASN A 2 1.912 4.479 -19.627 1.00 0.00 O ATOM 21 ND2 ASN A 2 0.389 5.180 -21.098 1.00 0.00 N ATOM 0 H ASN A 2 2.389 5.891 -22.952 1.00 0.00 H new ATOM 0 HA ASN A 2 3.477 8.039 -21.215 1.00 0.00 H new ATOM 0 HB2 ASN A 2 2.404 6.990 -19.297 1.00 0.00 H new ATOM 0 HB3 ASN A 2 1.213 7.503 -20.476 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -0.048 4.259 -21.143 1.00 0.00 H new ATOM 0 HD22 ASN A 2 0.018 5.948 -21.657 1.00 0.00 H new ATOM 28 N ALA A 3 5.038 6.288 -20.058 1.00 0.00 N ATOM 29 CA ALA A 3 6.159 5.449 -19.779 1.00 0.00 C ATOM 30 C ALA A 3 5.829 4.467 -18.683 1.00 0.00 C ATOM 31 O ALA A 3 5.862 3.253 -18.902 1.00 0.00 O ATOM 32 CB ALA A 3 7.385 6.276 -19.420 1.00 0.00 C ATOM 0 H ALA A 3 4.906 7.060 -19.404 1.00 0.00 H new ATOM 0 HA ALA A 3 6.392 4.884 -20.682 1.00 0.00 H new ATOM 0 HB1 ALA A 3 8.224 5.612 -19.212 1.00 0.00 H new ATOM 0 HB2 ALA A 3 7.639 6.931 -20.253 1.00 0.00 H new ATOM 0 HB3 ALA A 3 7.172 6.878 -18.537 1.00 0.00 H new ATOM 38 N LYS A 4 5.493 4.969 -17.500 1.00 0.00 N ATOM 39 CA LYS A 4 5.225 4.067 -16.392 1.00 0.00 C ATOM 40 C LYS A 4 3.956 4.387 -15.610 1.00 0.00 C ATOM 41 O LYS A 4 3.698 3.752 -14.570 1.00 0.00 O ATOM 42 CB LYS A 4 6.428 3.897 -15.437 1.00 0.00 C ATOM 43 CG LYS A 4 7.703 3.363 -16.094 1.00 0.00 C ATOM 44 CD LYS A 4 8.759 2.965 -15.064 1.00 0.00 C ATOM 45 CE LYS A 4 8.713 1.465 -14.681 1.00 0.00 C ATOM 46 NZ LYS A 4 7.404 0.994 -14.143 1.00 0.00 N ATOM 0 H LYS A 4 5.402 5.963 -17.289 1.00 0.00 H new ATOM 0 HA LYS A 4 5.052 3.109 -16.882 1.00 0.00 H new ATOM 0 HB2 LYS A 4 6.649 4.861 -14.980 1.00 0.00 H new ATOM 0 HB3 LYS A 4 6.141 3.221 -14.632 1.00 0.00 H new ATOM 0 HG2 LYS A 4 7.457 2.500 -16.712 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.114 4.124 -16.758 1.00 0.00 H new ATOM 0 HD2 LYS A 4 9.747 3.201 -15.459 1.00 0.00 H new ATOM 0 HD3 LYS A 4 8.623 3.566 -14.165 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.962 0.872 -15.561 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.486 1.271 -13.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 7.552 0.140 -13.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 6.982 1.740 -13.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 6.764 0.773 -14.932 1.00 0.00 H new ATOM 60 N ASN A 5 3.143 5.321 -16.075 1.00 0.00 N ATOM 61 CA ASN A 5 1.877 5.570 -15.375 1.00 0.00 C ATOM 62 C ASN A 5 0.824 4.650 -15.928 1.00 0.00 C ATOM 63 O ASN A 5 0.077 4.981 -16.857 1.00 0.00 O ATOM 64 CB ASN A 5 1.417 7.039 -15.412 1.00 0.00 C ATOM 65 CG ASN A 5 0.209 7.375 -14.506 1.00 0.00 C ATOM 66 OD1 ASN A 5 -0.679 6.564 -14.259 1.00 0.00 O ATOM 67 ND2 ASN A 5 0.168 8.603 -14.016 1.00 0.00 N ATOM 0 H ASN A 5 3.317 5.900 -16.896 1.00 0.00 H new ATOM 0 HA ASN A 5 2.043 5.360 -14.318 1.00 0.00 H new ATOM 0 HB2 ASN A 5 2.255 7.673 -15.122 1.00 0.00 H new ATOM 0 HB3 ASN A 5 1.163 7.297 -16.440 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -0.610 8.889 -13.422 1.00 0.00 H new ATOM 0 HD22 ASN A 5 0.915 9.263 -14.232 1.00 0.00 H new ATOM 74 N TYR A 6 0.849 3.469 -15.417 1.00 0.00 N ATOM 75 CA TYR A 6 -0.062 2.447 -15.759 1.00 0.00 C ATOM 76 C TYR A 6 -0.378 1.669 -14.523 1.00 0.00 C ATOM 77 O TYR A 6 0.422 1.668 -13.564 1.00 0.00 O ATOM 78 CB TYR A 6 0.489 1.528 -16.885 1.00 0.00 C ATOM 79 CG TYR A 6 1.898 0.987 -16.673 1.00 0.00 C ATOM 80 CD1 TYR A 6 2.169 0.015 -15.720 1.00 0.00 C ATOM 81 CD2 TYR A 6 2.953 1.452 -17.442 1.00 0.00 C ATOM 82 CE1 TYR A 6 3.444 -0.463 -15.537 1.00 0.00 C ATOM 83 CE2 TYR A 6 4.231 0.971 -17.263 1.00 0.00 C ATOM 84 CZ TYR A 6 4.470 0.020 -16.311 1.00 0.00 C ATOM 85 OH TYR A 6 5.757 -0.447 -16.118 1.00 0.00 O ATOM 0 H TYR A 6 1.536 3.182 -14.720 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.972 2.895 -16.157 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -0.190 0.683 -17.003 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.471 2.084 -17.822 1.00 0.00 H new ATOM 0 HD1 TYR A 6 1.364 -0.372 -15.112 1.00 0.00 H new ATOM 0 HD2 TYR A 6 2.770 2.205 -18.195 1.00 0.00 H new ATOM 0 HE1 TYR A 6 3.638 -1.216 -14.787 1.00 0.00 H new ATOM 0 HE2 TYR A 6 5.041 1.344 -17.872 1.00 0.00 H new ATOM 0 HH TYR A 6 6.364 -0.004 -16.748 1.00 0.00 H new ATOM 95 N MET A 7 -1.532 1.073 -14.521 1.00 0.00 N ATOM 96 CA MET A 7 -2.013 0.233 -13.451 1.00 0.00 C ATOM 97 C MET A 7 -3.380 -0.200 -13.887 1.00 0.00 C ATOM 98 O MET A 7 -4.359 0.519 -13.679 1.00 0.00 O ATOM 99 CB MET A 7 -2.089 1.002 -12.103 1.00 0.00 C ATOM 100 CG MET A 7 -2.133 0.122 -10.854 1.00 0.00 C ATOM 101 SD MET A 7 -3.614 -0.880 -10.700 1.00 0.00 S ATOM 102 CE MET A 7 -3.220 -1.790 -9.215 1.00 0.00 C ATOM 0 H MET A 7 -2.195 1.158 -15.292 1.00 0.00 H new ATOM 0 HA MET A 7 -1.343 -0.608 -13.275 1.00 0.00 H new ATOM 0 HB2 MET A 7 -1.226 1.664 -12.031 1.00 0.00 H new ATOM 0 HB3 MET A 7 -2.976 1.635 -12.114 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.264 -0.536 -10.858 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.047 0.759 -9.973 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.881 -2.791 -9.481 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.431 -1.272 -8.670 1.00 0.00 H new ATOM 0 HE3 MET A 7 -4.108 -1.863 -8.587 1.00 0.00 H new ATOM 112 N ASP A 8 -3.437 -1.300 -14.599 1.00 0.00 N ATOM 113 CA ASP A 8 -4.696 -1.766 -15.141 1.00 0.00 C ATOM 114 C ASP A 8 -5.413 -2.625 -14.139 1.00 0.00 C ATOM 115 O ASP A 8 -5.142 -3.823 -14.010 1.00 0.00 O ATOM 116 CB ASP A 8 -4.520 -2.500 -16.474 1.00 0.00 C ATOM 117 CG ASP A 8 -5.846 -2.902 -17.091 1.00 0.00 C ATOM 118 OD1 ASP A 8 -6.466 -2.064 -17.783 1.00 0.00 O ATOM 119 OD2 ASP A 8 -6.282 -4.069 -16.901 1.00 0.00 O ATOM 0 H ASP A 8 -2.633 -1.888 -14.817 1.00 0.00 H new ATOM 0 HA ASP A 8 -5.307 -0.887 -15.347 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -3.978 -1.860 -17.170 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -3.910 -3.390 -16.318 1.00 0.00 H new ATOM 124 N LYS A 9 -6.240 -1.970 -13.380 1.00 0.00 N ATOM 125 CA LYS A 9 -7.072 -2.535 -12.359 1.00 0.00 C ATOM 126 C LYS A 9 -7.852 -1.361 -11.817 1.00 0.00 C ATOM 127 O LYS A 9 -7.446 -0.218 -12.047 1.00 0.00 O ATOM 128 CB LYS A 9 -6.216 -3.190 -11.242 1.00 0.00 C ATOM 129 CG LYS A 9 -7.020 -3.892 -10.155 1.00 0.00 C ATOM 130 CD LYS A 9 -6.137 -4.534 -9.095 1.00 0.00 C ATOM 131 CE LYS A 9 -5.290 -5.677 -9.644 1.00 0.00 C ATOM 132 NZ LYS A 9 -6.112 -6.794 -10.164 1.00 0.00 N ATOM 0 H LYS A 9 -6.359 -0.960 -13.463 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.719 -3.323 -12.744 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.539 -3.912 -11.698 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.597 -2.421 -10.779 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.687 -3.173 -9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -7.649 -4.657 -10.610 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.482 -3.776 -8.667 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.763 -4.908 -8.285 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.650 -5.300 -10.441 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -4.634 -6.049 -8.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.500 -7.610 -10.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.822 -7.063 -9.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.592 -6.495 -11.037 1.00 0.00 H new ATOM 146 N GLY A 10 -8.941 -1.597 -11.155 1.00 0.00 N ATOM 147 CA GLY A 10 -9.713 -0.517 -10.630 1.00 0.00 C ATOM 148 C GLY A 10 -9.716 -0.544 -9.134 1.00 0.00 C ATOM 149 O GLY A 10 -10.679 -1.014 -8.522 1.00 0.00 O ATOM 0 H GLY A 10 -9.315 -2.527 -10.966 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -9.305 0.431 -10.980 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.736 -0.581 -11.001 1.00 0.00 H new ATOM 153 N THR A 11 -8.646 -0.072 -8.544 1.00 0.00 N ATOM 154 CA THR A 11 -8.499 -0.080 -7.115 1.00 0.00 C ATOM 155 C THR A 11 -9.309 1.041 -6.468 1.00 0.00 C ATOM 156 O THR A 11 -9.915 0.856 -5.408 1.00 0.00 O ATOM 157 CB THR A 11 -7.011 0.001 -6.729 1.00 0.00 C ATOM 158 OG1 THR A 11 -6.353 1.017 -7.516 1.00 0.00 O ATOM 159 CG2 THR A 11 -6.330 -1.343 -6.950 1.00 0.00 C ATOM 0 H THR A 11 -7.853 0.329 -9.044 1.00 0.00 H new ATOM 0 HA THR A 11 -8.896 -1.021 -6.735 1.00 0.00 H new ATOM 0 HB THR A 11 -6.940 0.261 -5.673 1.00 0.00 H new ATOM 0 HG1 THR A 11 -5.395 1.019 -7.312 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.279 -1.268 -6.672 1.00 0.00 H new ATOM 0 HG22 THR A 11 -6.815 -2.102 -6.336 1.00 0.00 H new ATOM 0 HG23 THR A 11 -6.409 -1.622 -8.001 1.00 0.00 H new ATOM 167 N SER A 12 -9.320 2.191 -7.108 1.00 0.00 N ATOM 168 CA SER A 12 -10.096 3.346 -6.673 1.00 0.00 C ATOM 169 C SER A 12 -10.307 4.304 -7.842 1.00 0.00 C ATOM 170 O SER A 12 -11.417 4.424 -8.368 1.00 0.00 O ATOM 171 CB SER A 12 -9.442 4.073 -5.470 1.00 0.00 C ATOM 172 OG SER A 12 -9.432 3.249 -4.303 1.00 0.00 O ATOM 0 H SER A 12 -8.783 2.358 -7.959 1.00 0.00 H new ATOM 0 HA SER A 12 -11.065 2.984 -6.330 1.00 0.00 H new ATOM 0 HB2 SER A 12 -8.421 4.356 -5.726 1.00 0.00 H new ATOM 0 HB3 SER A 12 -9.985 4.995 -5.261 1.00 0.00 H new ATOM 0 HG SER A 12 -9.888 2.403 -4.496 1.00 0.00 H new ATOM 178 N SER A 13 -9.243 4.939 -8.278 1.00 0.00 N ATOM 179 CA SER A 13 -9.309 5.872 -9.377 1.00 0.00 C ATOM 180 C SER A 13 -8.081 5.656 -10.252 1.00 0.00 C ATOM 181 O SER A 13 -7.443 6.597 -10.715 1.00 0.00 O ATOM 182 CB SER A 13 -9.326 7.303 -8.830 1.00 0.00 C ATOM 183 OG SER A 13 -10.291 7.453 -7.789 1.00 0.00 O ATOM 0 H SER A 13 -8.310 4.823 -7.881 1.00 0.00 H new ATOM 0 HA SER A 13 -10.215 5.715 -9.963 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.337 7.561 -8.451 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.549 8.000 -9.638 1.00 0.00 H new ATOM 0 HG SER A 13 -9.847 7.766 -6.974 1.00 0.00 H new ATOM 189 N SER A 14 -7.768 4.412 -10.484 1.00 0.00 N ATOM 190 CA SER A 14 -6.632 4.041 -11.262 1.00 0.00 C ATOM 191 C SER A 14 -6.929 4.172 -12.776 1.00 0.00 C ATOM 192 O SER A 14 -8.029 4.592 -13.165 1.00 0.00 O ATOM 193 CB SER A 14 -6.236 2.638 -10.838 1.00 0.00 C ATOM 194 OG SER A 14 -7.403 1.898 -10.510 1.00 0.00 O ATOM 0 H SER A 14 -8.306 3.621 -10.131 1.00 0.00 H new ATOM 0 HA SER A 14 -5.791 4.711 -11.085 1.00 0.00 H new ATOM 0 HB2 SER A 14 -5.692 2.143 -11.642 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.566 2.681 -9.979 1.00 0.00 H new ATOM 0 HG SER A 14 -7.288 0.965 -10.787 1.00 0.00 H new ATOM 200 N THR A 15 -5.947 3.835 -13.616 1.00 0.00 N ATOM 201 CA THR A 15 -6.020 3.967 -15.092 1.00 0.00 C ATOM 202 C THR A 15 -6.254 5.411 -15.595 1.00 0.00 C ATOM 203 O THR A 15 -6.579 5.609 -16.754 1.00 0.00 O ATOM 204 CB THR A 15 -7.007 2.953 -15.792 1.00 0.00 C ATOM 205 OG1 THR A 15 -8.317 2.957 -15.194 1.00 0.00 O ATOM 206 CG2 THR A 15 -6.446 1.546 -15.786 1.00 0.00 C ATOM 0 H THR A 15 -5.057 3.454 -13.293 1.00 0.00 H new ATOM 0 HA THR A 15 -5.014 3.687 -15.405 1.00 0.00 H new ATOM 0 HB THR A 15 -7.110 3.292 -16.823 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.442 3.786 -14.686 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.149 0.872 -16.275 1.00 0.00 H new ATOM 0 HG22 THR A 15 -5.496 1.531 -16.321 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.288 1.222 -14.757 1.00 0.00 H new ATOM 214 N VAL A 16 -6.039 6.415 -14.730 1.00 0.00 N ATOM 215 CA VAL A 16 -6.177 7.815 -15.153 1.00 0.00 C ATOM 216 C VAL A 16 -5.094 8.192 -16.166 1.00 0.00 C ATOM 217 O VAL A 16 -5.376 8.851 -17.146 1.00 0.00 O ATOM 218 CB VAL A 16 -6.216 8.826 -13.965 1.00 0.00 C ATOM 219 CG1 VAL A 16 -7.500 8.653 -13.176 1.00 0.00 C ATOM 220 CG2 VAL A 16 -5.008 8.661 -13.041 1.00 0.00 C ATOM 0 H VAL A 16 -5.774 6.287 -13.753 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.150 7.889 -15.638 1.00 0.00 H new ATOM 0 HB VAL A 16 -6.179 9.831 -14.384 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.517 9.363 -12.349 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.355 8.834 -13.828 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.552 7.638 -12.783 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -5.072 9.383 -12.227 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -4.999 7.651 -12.631 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.092 8.832 -13.606 1.00 0.00 H new ATOM 230 N VAL A 17 -3.872 7.727 -15.903 1.00 0.00 N ATOM 231 CA VAL A 17 -2.715 7.845 -16.798 1.00 0.00 C ATOM 232 C VAL A 17 -2.304 9.293 -17.159 1.00 0.00 C ATOM 233 O VAL A 17 -2.833 9.917 -18.087 1.00 0.00 O ATOM 234 CB VAL A 17 -2.879 6.983 -18.077 1.00 0.00 C ATOM 235 CG1 VAL A 17 -1.631 7.054 -18.945 1.00 0.00 C ATOM 236 CG2 VAL A 17 -3.186 5.539 -17.696 1.00 0.00 C ATOM 0 H VAL A 17 -3.651 7.242 -15.033 1.00 0.00 H new ATOM 0 HA VAL A 17 -1.887 7.451 -16.208 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.712 7.380 -18.657 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.772 6.441 -19.835 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.452 8.088 -19.241 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.774 6.684 -18.382 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.300 4.941 -18.600 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.368 5.139 -17.097 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -4.110 5.504 -17.119 1.00 0.00 H new ATOM 246 N LYS A 18 -1.372 9.811 -16.403 1.00 0.00 N ATOM 247 CA LYS A 18 -0.768 11.098 -16.668 1.00 0.00 C ATOM 248 C LYS A 18 0.724 10.957 -16.496 1.00 0.00 C ATOM 249 O LYS A 18 1.234 10.958 -15.365 1.00 0.00 O ATOM 250 CB LYS A 18 -1.314 12.219 -15.763 1.00 0.00 C ATOM 251 CG LYS A 18 -2.780 12.571 -16.005 1.00 0.00 C ATOM 252 CD LYS A 18 -3.243 13.744 -15.145 1.00 0.00 C ATOM 253 CE LYS A 18 -2.489 15.033 -15.479 1.00 0.00 C ATOM 254 NZ LYS A 18 -2.928 16.170 -14.642 1.00 0.00 N ATOM 0 H LYS A 18 -1.003 9.347 -15.573 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.018 11.393 -17.687 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -1.192 11.920 -14.722 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.710 13.114 -15.910 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -2.924 12.816 -17.057 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.400 11.700 -15.793 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.312 13.901 -15.291 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -3.098 13.501 -14.092 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -1.420 14.873 -15.340 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -2.640 15.278 -16.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.391 17.021 -14.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -3.943 16.341 -14.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.760 15.949 -13.640 1.00 0.00 H new ATOM 268 N ASP A 19 1.394 10.745 -17.597 1.00 0.00 N ATOM 269 CA ASP A 19 2.836 10.532 -17.650 1.00 0.00 C ATOM 270 C ASP A 19 3.259 10.562 -19.083 1.00 0.00 C ATOM 271 O ASP A 19 2.435 10.323 -19.976 1.00 0.00 O ATOM 272 CB ASP A 19 3.213 9.186 -17.006 1.00 0.00 C ATOM 273 CG ASP A 19 4.663 8.775 -17.167 1.00 0.00 C ATOM 274 OD1 ASP A 19 5.558 9.530 -16.745 1.00 0.00 O ATOM 275 OD2 ASP A 19 4.913 7.669 -17.687 1.00 0.00 O ATOM 0 H ASP A 19 0.949 10.713 -18.514 1.00 0.00 H new ATOM 0 HA ASP A 19 3.346 11.317 -17.092 1.00 0.00 H new ATOM 0 HB2 ASP A 19 2.982 9.234 -15.942 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.582 8.407 -17.435 1.00 0.00 H new ATOM 280 N GLY A 20 4.485 10.871 -19.304 1.00 0.00 N ATOM 281 CA GLY A 20 5.003 10.973 -20.611 1.00 0.00 C ATOM 282 C GLY A 20 5.990 12.080 -20.649 1.00 0.00 C ATOM 283 O GLY A 20 6.684 12.313 -19.632 1.00 0.00 O ATOM 0 H GLY A 20 5.164 11.062 -18.567 1.00 0.00 H new ATOM 0 HA2 GLY A 20 5.476 10.036 -20.904 1.00 0.00 H new ATOM 0 HA3 GLY A 20 4.199 11.160 -21.322 1.00 0.00 H new ATOM 287 N LYS A 21 6.037 12.779 -21.771 1.00 0.00 N ATOM 288 CA LYS A 21 6.913 13.918 -21.993 1.00 0.00 C ATOM 289 C LYS A 21 8.393 13.500 -21.904 1.00 0.00 C ATOM 290 O LYS A 21 8.980 13.081 -22.897 1.00 0.00 O ATOM 291 CB LYS A 21 6.534 15.070 -21.026 1.00 0.00 C ATOM 292 CG LYS A 21 7.311 16.365 -21.182 1.00 0.00 C ATOM 293 CD LYS A 21 6.717 17.469 -20.304 1.00 0.00 C ATOM 294 CE LYS A 21 6.764 17.119 -18.818 1.00 0.00 C ATOM 295 NZ LYS A 21 6.106 18.146 -17.984 1.00 0.00 N ATOM 0 H LYS A 21 5.449 12.563 -22.576 1.00 0.00 H new ATOM 0 HA LYS A 21 6.775 14.297 -23.006 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.474 15.290 -21.155 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.664 14.715 -20.004 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.354 16.202 -20.912 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.297 16.678 -22.226 1.00 0.00 H new ATOM 0 HD2 LYS A 21 7.263 18.397 -20.473 1.00 0.00 H new ATOM 0 HD3 LYS A 21 5.683 17.648 -20.600 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.279 16.156 -18.657 1.00 0.00 H new ATOM 0 HE3 LYS A 21 7.802 17.009 -18.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.161 17.868 -16.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.585 19.060 -18.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.108 18.234 -18.264 1.00 0.00 H new ATOM 309 N THR A 22 8.942 13.546 -20.715 1.00 0.00 N ATOM 310 CA THR A 22 10.292 13.135 -20.431 1.00 0.00 C ATOM 311 C THR A 22 10.410 12.814 -18.956 1.00 0.00 C ATOM 312 O THR A 22 10.890 13.618 -18.154 1.00 0.00 O ATOM 313 CB THR A 22 11.358 14.178 -20.875 1.00 0.00 C ATOM 314 OG1 THR A 22 10.746 15.472 -21.074 1.00 0.00 O ATOM 315 CG2 THR A 22 12.056 13.735 -22.148 1.00 0.00 C ATOM 0 H THR A 22 8.443 13.882 -19.891 1.00 0.00 H new ATOM 0 HA THR A 22 10.502 12.243 -21.021 1.00 0.00 H new ATOM 0 HB THR A 22 12.102 14.255 -20.082 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.429 16.118 -21.351 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.796 14.482 -22.436 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.552 12.780 -21.977 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.322 13.625 -22.946 1.00 0.00 H new ATOM 323 N SER A 23 9.847 11.691 -18.598 1.00 0.00 N ATOM 324 CA SER A 23 9.823 11.249 -17.230 1.00 0.00 C ATOM 325 C SER A 23 10.638 9.960 -17.046 1.00 0.00 C ATOM 326 O SER A 23 11.201 9.706 -15.978 1.00 0.00 O ATOM 327 CB SER A 23 8.374 11.034 -16.821 1.00 0.00 C ATOM 328 OG SER A 23 7.604 12.222 -17.042 1.00 0.00 O ATOM 0 H SER A 23 9.390 11.054 -19.251 1.00 0.00 H new ATOM 0 HA SER A 23 10.280 12.008 -16.595 1.00 0.00 H new ATOM 0 HB2 SER A 23 7.949 10.208 -17.391 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.326 10.754 -15.769 1.00 0.00 H new ATOM 0 HG SER A 23 7.408 12.312 -17.998 1.00 0.00 H new ATOM 334 N SER A 24 10.665 9.125 -18.064 1.00 0.00 N ATOM 335 CA SER A 24 11.444 7.901 -18.019 1.00 0.00 C ATOM 336 C SER A 24 11.987 7.563 -19.405 1.00 0.00 C ATOM 337 O SER A 24 12.327 6.420 -19.683 1.00 0.00 O ATOM 338 CB SER A 24 10.591 6.749 -17.462 1.00 0.00 C ATOM 339 OG SER A 24 10.156 7.045 -16.137 1.00 0.00 O ATOM 0 H SER A 24 10.156 9.271 -18.936 1.00 0.00 H new ATOM 0 HA SER A 24 12.294 8.048 -17.353 1.00 0.00 H new ATOM 0 HB2 SER A 24 9.727 6.584 -18.106 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.171 5.826 -17.463 1.00 0.00 H new ATOM 0 HG SER A 24 9.613 6.303 -15.797 1.00 0.00 H new ATOM 345 N ALA A 25 12.140 8.587 -20.243 1.00 0.00 N ATOM 346 CA ALA A 25 12.631 8.406 -21.607 1.00 0.00 C ATOM 347 C ALA A 25 14.068 7.880 -21.595 1.00 0.00 C ATOM 348 O ALA A 25 14.405 6.920 -22.294 1.00 0.00 O ATOM 349 CB ALA A 25 12.539 9.714 -22.384 1.00 0.00 C ATOM 0 H ALA A 25 11.930 9.555 -19.999 1.00 0.00 H new ATOM 0 HA ALA A 25 12.003 7.668 -22.106 1.00 0.00 H new ATOM 0 HB1 ALA A 25 12.909 9.562 -23.398 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.500 10.042 -22.422 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.142 10.475 -21.888 1.00 0.00 H new ATOM 355 N SER A 26 14.886 8.469 -20.762 1.00 0.00 N ATOM 356 CA SER A 26 16.264 8.060 -20.620 1.00 0.00 C ATOM 357 C SER A 26 16.423 7.229 -19.340 1.00 0.00 C ATOM 358 O SER A 26 17.540 6.919 -18.926 1.00 0.00 O ATOM 359 CB SER A 26 17.150 9.304 -20.565 1.00 0.00 C ATOM 360 OG SER A 26 16.941 10.126 -21.722 1.00 0.00 O ATOM 0 H SER A 26 14.617 9.248 -20.161 1.00 0.00 H new ATOM 0 HA SER A 26 16.562 7.448 -21.471 1.00 0.00 H new ATOM 0 HB2 SER A 26 16.929 9.874 -19.663 1.00 0.00 H new ATOM 0 HB3 SER A 26 18.198 9.008 -20.507 1.00 0.00 H new ATOM 0 HG SER A 26 17.515 10.918 -21.668 1.00 0.00 H new ATOM 366 N THR A 27 15.270 6.838 -18.770 1.00 0.00 N ATOM 367 CA THR A 27 15.116 6.107 -17.495 1.00 0.00 C ATOM 368 C THR A 27 15.581 6.953 -16.282 1.00 0.00 C ATOM 369 O THR A 27 16.380 7.876 -16.451 1.00 0.00 O ATOM 370 CB THR A 27 15.745 4.658 -17.494 1.00 0.00 C ATOM 371 OG1 THR A 27 17.163 4.682 -17.700 1.00 0.00 O ATOM 372 CG2 THR A 27 15.096 3.790 -18.565 1.00 0.00 C ATOM 0 H THR A 27 14.370 7.033 -19.208 1.00 0.00 H new ATOM 0 HA THR A 27 14.044 5.943 -17.388 1.00 0.00 H new ATOM 0 HB THR A 27 15.553 4.234 -16.508 1.00 0.00 H new ATOM 0 HG1 THR A 27 17.465 5.610 -17.786 1.00 0.00 H new ATOM 0 HG21 THR A 27 15.543 2.796 -18.548 1.00 0.00 H new ATOM 0 HG22 THR A 27 14.027 3.710 -18.370 1.00 0.00 H new ATOM 0 HG23 THR A 27 15.253 4.242 -19.544 1.00 0.00 H new ATOM 380 N PRO A 28 15.019 6.697 -15.058 1.00 0.00 N ATOM 381 CA PRO A 28 15.372 7.431 -13.822 1.00 0.00 C ATOM 382 C PRO A 28 16.864 7.669 -13.636 1.00 0.00 C ATOM 383 O PRO A 28 17.282 8.792 -13.349 1.00 0.00 O ATOM 384 CB PRO A 28 14.863 6.509 -12.718 1.00 0.00 C ATOM 385 CG PRO A 28 13.652 5.884 -13.310 1.00 0.00 C ATOM 386 CD PRO A 28 13.944 5.710 -14.788 1.00 0.00 C ATOM 0 HA PRO A 28 14.939 8.431 -13.833 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.608 5.761 -12.447 1.00 0.00 H new ATOM 0 HB3 PRO A 28 14.624 7.064 -11.811 1.00 0.00 H new ATOM 0 HG2 PRO A 28 13.440 4.924 -12.840 1.00 0.00 H new ATOM 0 HG3 PRO A 28 12.775 6.514 -13.158 1.00 0.00 H new ATOM 0 HD2 PRO A 28 14.268 4.694 -15.014 1.00 0.00 H new ATOM 0 HD3 PRO A 28 13.060 5.905 -15.396 1.00 0.00 H new ATOM 394 N ALA A 29 17.651 6.606 -13.788 1.00 0.00 N ATOM 395 CA ALA A 29 19.103 6.645 -13.584 1.00 0.00 C ATOM 396 C ALA A 29 19.422 7.222 -12.205 1.00 0.00 C ATOM 397 O ALA A 29 20.059 8.268 -12.071 1.00 0.00 O ATOM 398 CB ALA A 29 19.816 7.416 -14.706 1.00 0.00 C ATOM 0 H ALA A 29 17.300 5.687 -14.058 1.00 0.00 H new ATOM 0 HA ALA A 29 19.483 5.624 -13.624 1.00 0.00 H new ATOM 0 HB1 ALA A 29 20.890 7.422 -14.518 1.00 0.00 H new ATOM 0 HB2 ALA A 29 19.618 6.932 -15.663 1.00 0.00 H new ATOM 0 HB3 ALA A 29 19.447 8.441 -14.734 1.00 0.00 H new ATOM 404 N THR A 30 18.886 6.556 -11.187 1.00 0.00 N ATOM 405 CA THR A 30 19.009 6.960 -9.781 1.00 0.00 C ATOM 406 C THR A 30 18.177 8.270 -9.498 1.00 0.00 C ATOM 407 O THR A 30 18.260 8.874 -8.418 1.00 0.00 O ATOM 408 CB THR A 30 20.515 7.126 -9.365 1.00 0.00 C ATOM 409 OG1 THR A 30 21.263 5.978 -9.827 1.00 0.00 O ATOM 410 CG2 THR A 30 20.674 7.202 -7.846 1.00 0.00 C ATOM 0 H THR A 30 18.342 5.702 -11.314 1.00 0.00 H new ATOM 0 HA THR A 30 18.591 6.165 -9.163 1.00 0.00 H new ATOM 0 HB THR A 30 20.882 8.051 -9.810 1.00 0.00 H new ATOM 0 HG1 THR A 30 22.204 6.076 -9.572 1.00 0.00 H new ATOM 0 HG21 THR A 30 21.729 7.317 -7.596 1.00 0.00 H new ATOM 0 HG22 THR A 30 20.116 8.057 -7.464 1.00 0.00 H new ATOM 0 HG23 THR A 30 20.291 6.287 -7.394 1.00 0.00 H new ATOM 418 N ARG A 31 17.367 8.689 -10.459 1.00 0.00 N ATOM 419 CA ARG A 31 16.516 9.851 -10.275 1.00 0.00 C ATOM 420 C ARG A 31 15.102 9.653 -10.882 1.00 0.00 C ATOM 421 O ARG A 31 14.832 10.066 -12.014 1.00 0.00 O ATOM 422 CB ARG A 31 17.193 11.133 -10.821 1.00 0.00 C ATOM 423 CG ARG A 31 16.346 12.407 -10.734 1.00 0.00 C ATOM 424 CD ARG A 31 15.959 12.750 -9.305 1.00 0.00 C ATOM 425 NE ARG A 31 17.116 13.090 -8.479 1.00 0.00 N ATOM 426 CZ ARG A 31 17.055 13.498 -7.206 1.00 0.00 C ATOM 427 NH1 ARG A 31 15.892 13.547 -6.572 1.00 0.00 N ATOM 428 NH2 ARG A 31 18.159 13.856 -6.572 1.00 0.00 N ATOM 0 H ARG A 31 17.282 8.242 -11.372 1.00 0.00 H new ATOM 0 HA ARG A 31 16.378 9.975 -9.201 1.00 0.00 H new ATOM 0 HB2 ARG A 31 18.121 11.295 -10.274 1.00 0.00 H new ATOM 0 HB3 ARG A 31 17.463 10.966 -11.864 1.00 0.00 H new ATOM 0 HG2 ARG A 31 16.901 13.239 -11.167 1.00 0.00 H new ATOM 0 HG3 ARG A 31 15.443 12.281 -11.332 1.00 0.00 H new ATOM 0 HD2 ARG A 31 15.262 13.588 -9.312 1.00 0.00 H new ATOM 0 HD3 ARG A 31 15.435 11.904 -8.861 1.00 0.00 H new ATOM 0 HE ARG A 31 18.039 13.010 -8.905 1.00 0.00 H new ATOM 0 HH11 ARG A 31 15.036 13.273 -7.054 1.00 0.00 H new ATOM 0 HH12 ARG A 31 15.853 13.859 -5.602 1.00 0.00 H new ATOM 0 HH21 ARG A 31 19.058 13.821 -7.053 1.00 0.00 H new ATOM 0 HH22 ARG A 31 18.112 14.167 -5.602 1.00 0.00 H new ATOM 442 N PRO A 32 14.227 8.896 -10.195 1.00 0.00 N ATOM 443 CA PRO A 32 12.813 8.827 -10.549 1.00 0.00 C ATOM 444 C PRO A 32 12.168 10.207 -10.398 1.00 0.00 C ATOM 445 O PRO A 32 12.462 10.941 -9.444 1.00 0.00 O ATOM 446 CB PRO A 32 12.225 7.856 -9.506 1.00 0.00 C ATOM 447 CG PRO A 32 13.235 7.832 -8.412 1.00 0.00 C ATOM 448 CD PRO A 32 14.543 7.972 -9.109 1.00 0.00 C ATOM 0 HA PRO A 32 12.645 8.505 -11.577 1.00 0.00 H new ATOM 0 HB2 PRO A 32 11.256 8.200 -9.145 1.00 0.00 H new ATOM 0 HB3 PRO A 32 12.073 6.863 -9.929 1.00 0.00 H new ATOM 0 HG2 PRO A 32 13.073 8.645 -7.705 1.00 0.00 H new ATOM 0 HG3 PRO A 32 13.185 6.902 -7.846 1.00 0.00 H new ATOM 0 HD2 PRO A 32 15.314 8.370 -8.449 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.907 7.015 -9.484 1.00 0.00 H new ATOM 456 N VAL A 33 11.292 10.554 -11.304 1.00 0.00 N ATOM 457 CA VAL A 33 10.662 11.872 -11.291 1.00 0.00 C ATOM 458 C VAL A 33 9.446 11.898 -10.367 1.00 0.00 C ATOM 459 O VAL A 33 8.739 12.897 -10.268 1.00 0.00 O ATOM 460 CB VAL A 33 10.261 12.351 -12.712 1.00 0.00 C ATOM 461 CG1 VAL A 33 11.473 12.379 -13.631 1.00 0.00 C ATOM 462 CG2 VAL A 33 9.152 11.489 -13.301 1.00 0.00 C ATOM 0 H VAL A 33 10.990 9.949 -12.067 1.00 0.00 H new ATOM 0 HA VAL A 33 11.411 12.565 -10.907 1.00 0.00 H new ATOM 0 HB VAL A 33 9.873 13.366 -12.623 1.00 0.00 H new ATOM 0 HG11 VAL A 33 11.170 12.717 -14.622 1.00 0.00 H new ATOM 0 HG12 VAL A 33 12.220 13.062 -13.227 1.00 0.00 H new ATOM 0 HG13 VAL A 33 11.898 11.378 -13.704 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.897 11.854 -14.296 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.492 10.456 -13.369 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.272 11.540 -12.660 1.00 0.00 H new ATOM 472 N THR A 34 9.233 10.807 -9.681 1.00 0.00 N ATOM 473 CA THR A 34 8.158 10.669 -8.746 1.00 0.00 C ATOM 474 C THR A 34 8.554 11.227 -7.378 1.00 0.00 C ATOM 475 O THR A 34 7.778 11.201 -6.429 1.00 0.00 O ATOM 476 CB THR A 34 7.801 9.190 -8.642 1.00 0.00 C ATOM 477 OG1 THR A 34 9.031 8.431 -8.637 1.00 0.00 O ATOM 478 CG2 THR A 34 6.943 8.766 -9.826 1.00 0.00 C ATOM 0 H THR A 34 9.816 9.974 -9.761 1.00 0.00 H new ATOM 0 HA THR A 34 7.293 11.236 -9.091 1.00 0.00 H new ATOM 0 HB THR A 34 7.235 9.010 -7.728 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.825 7.475 -8.569 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.697 7.708 -9.737 1.00 0.00 H new ATOM 0 HG22 THR A 34 6.024 9.352 -9.838 1.00 0.00 H new ATOM 0 HG23 THR A 34 7.493 8.934 -10.752 1.00 0.00 H new ATOM 486 N GLY A 35 9.772 11.718 -7.291 1.00 0.00 N ATOM 487 CA GLY A 35 10.252 12.300 -6.077 1.00 0.00 C ATOM 488 C GLY A 35 10.652 11.252 -5.078 1.00 0.00 C ATOM 489 O GLY A 35 11.272 10.247 -5.431 1.00 0.00 O ATOM 0 H GLY A 35 10.444 11.721 -8.058 1.00 0.00 H new ATOM 0 HA2 GLY A 35 11.107 12.941 -6.294 1.00 0.00 H new ATOM 0 HA3 GLY A 35 9.478 12.936 -5.647 1.00 0.00 H new ATOM 493 N SER A 36 10.251 11.454 -3.858 1.00 0.00 N ATOM 494 CA SER A 36 10.589 10.577 -2.757 1.00 0.00 C ATOM 495 C SER A 36 9.522 9.483 -2.577 1.00 0.00 C ATOM 496 O SER A 36 9.532 8.740 -1.597 1.00 0.00 O ATOM 497 CB SER A 36 10.667 11.433 -1.504 1.00 0.00 C ATOM 498 OG SER A 36 11.468 12.594 -1.749 1.00 0.00 O ATOM 0 H SER A 36 9.668 12.246 -3.587 1.00 0.00 H new ATOM 0 HA SER A 36 11.539 10.080 -2.953 1.00 0.00 H new ATOM 0 HB2 SER A 36 9.665 11.732 -1.196 1.00 0.00 H new ATOM 0 HB3 SER A 36 11.093 10.854 -0.685 1.00 0.00 H new ATOM 0 HG SER A 36 11.510 13.140 -0.936 1.00 0.00 H new ATOM 504 N TRP A 37 8.627 9.382 -3.526 1.00 0.00 N ATOM 505 CA TRP A 37 7.532 8.445 -3.436 1.00 0.00 C ATOM 506 C TRP A 37 7.925 7.092 -4.030 1.00 0.00 C ATOM 507 O TRP A 37 8.639 7.024 -5.036 1.00 0.00 O ATOM 508 CB TRP A 37 6.295 9.005 -4.143 1.00 0.00 C ATOM 509 CG TRP A 37 5.789 10.319 -3.577 1.00 0.00 C ATOM 510 CD1 TRP A 37 6.325 11.563 -3.768 1.00 0.00 C ATOM 511 CD2 TRP A 37 4.631 10.517 -2.760 1.00 0.00 C ATOM 512 NE1 TRP A 37 5.579 12.504 -3.113 1.00 0.00 N ATOM 513 CE2 TRP A 37 4.539 11.894 -2.490 1.00 0.00 C ATOM 514 CE3 TRP A 37 3.670 9.671 -2.228 1.00 0.00 C ATOM 515 CZ2 TRP A 37 3.524 12.436 -1.715 1.00 0.00 C ATOM 516 CZ3 TRP A 37 2.666 10.213 -1.459 1.00 0.00 C ATOM 517 CH2 TRP A 37 2.600 11.583 -1.210 1.00 0.00 C ATOM 0 H TRP A 37 8.634 9.942 -4.378 1.00 0.00 H new ATOM 0 HA TRP A 37 7.293 8.295 -2.383 1.00 0.00 H new ATOM 0 HB2 TRP A 37 6.527 9.144 -5.199 1.00 0.00 H new ATOM 0 HB3 TRP A 37 5.495 8.267 -4.087 1.00 0.00 H new ATOM 0 HD1 TRP A 37 7.209 11.772 -4.352 1.00 0.00 H new ATOM 0 HE1 TRP A 37 5.773 13.505 -3.096 1.00 0.00 H new ATOM 0 HE3 TRP A 37 3.709 8.608 -2.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 3.472 13.497 -1.522 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 1.913 9.563 -1.039 1.00 0.00 H new ATOM 0 HH2 TRP A 37 1.796 11.972 -0.602 1.00 0.00 H new ATOM 528 N LYS A 38 7.500 6.046 -3.385 1.00 0.00 N ATOM 529 CA LYS A 38 7.732 4.679 -3.803 1.00 0.00 C ATOM 530 C LYS A 38 6.365 4.084 -4.154 1.00 0.00 C ATOM 531 O LYS A 38 5.356 4.507 -3.589 1.00 0.00 O ATOM 532 CB LYS A 38 8.367 3.901 -2.636 1.00 0.00 C ATOM 533 CG LYS A 38 8.846 2.493 -2.982 1.00 0.00 C ATOM 534 CD LYS A 38 9.293 1.720 -1.740 1.00 0.00 C ATOM 535 CE LYS A 38 10.432 2.397 -0.997 1.00 0.00 C ATOM 536 NZ LYS A 38 10.805 1.655 0.234 1.00 0.00 N ATOM 0 H LYS A 38 6.962 6.115 -2.521 1.00 0.00 H new ATOM 0 HA LYS A 38 8.403 4.626 -4.660 1.00 0.00 H new ATOM 0 HB2 LYS A 38 9.213 4.473 -2.256 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.640 3.832 -1.827 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.043 1.948 -3.479 1.00 0.00 H new ATOM 0 HG3 LYS A 38 9.674 2.555 -3.688 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.444 1.605 -1.066 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.604 0.718 -2.035 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.299 2.473 -1.653 1.00 0.00 H new ATOM 0 HE3 LYS A 38 10.141 3.414 -0.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 11.585 2.148 0.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.984 1.604 0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 11.107 0.692 -0.019 1.00 0.00 H new ATOM 550 N LYS A 39 6.318 3.134 -5.059 1.00 0.00 N ATOM 551 CA LYS A 39 5.048 2.588 -5.502 1.00 0.00 C ATOM 552 C LYS A 39 4.640 1.342 -4.708 1.00 0.00 C ATOM 553 O LYS A 39 5.485 0.540 -4.280 1.00 0.00 O ATOM 554 CB LYS A 39 5.080 2.263 -7.006 1.00 0.00 C ATOM 555 CG LYS A 39 3.738 1.794 -7.548 1.00 0.00 C ATOM 556 CD LYS A 39 3.791 1.443 -9.015 1.00 0.00 C ATOM 557 CE LYS A 39 2.457 0.878 -9.470 1.00 0.00 C ATOM 558 NZ LYS A 39 2.124 -0.379 -8.760 1.00 0.00 N ATOM 0 H LYS A 39 7.138 2.722 -5.504 1.00 0.00 H new ATOM 0 HA LYS A 39 4.299 3.359 -5.319 1.00 0.00 H new ATOM 0 HB2 LYS A 39 5.397 3.149 -7.556 1.00 0.00 H new ATOM 0 HB3 LYS A 39 5.828 1.491 -7.188 1.00 0.00 H new ATOM 0 HG2 LYS A 39 3.407 0.923 -6.982 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.995 2.576 -7.393 1.00 0.00 H new ATOM 0 HD2 LYS A 39 4.036 2.330 -9.599 1.00 0.00 H new ATOM 0 HD3 LYS A 39 4.582 0.715 -9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.672 1.614 -9.296 1.00 0.00 H new ATOM 0 HE3 LYS A 39 2.487 0.693 -10.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 1.365 -0.875 -9.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 2.967 -0.987 -8.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 1.806 -0.159 -7.795 1.00 0.00 H new ATOM 572 N ASN A 40 3.350 1.224 -4.498 1.00 0.00 N ATOM 573 CA ASN A 40 2.707 0.089 -3.865 1.00 0.00 C ATOM 574 C ASN A 40 1.939 -0.712 -4.942 1.00 0.00 C ATOM 575 O ASN A 40 1.554 -0.154 -5.996 1.00 0.00 O ATOM 576 CB ASN A 40 1.728 0.605 -2.784 1.00 0.00 C ATOM 577 CG ASN A 40 0.923 -0.476 -2.107 1.00 0.00 C ATOM 578 OD1 ASN A 40 -0.151 -0.816 -2.559 1.00 0.00 O ATOM 579 ND2 ASN A 40 1.431 -1.025 -1.047 1.00 0.00 N ATOM 0 H ASN A 40 2.687 1.948 -4.775 1.00 0.00 H new ATOM 0 HA ASN A 40 3.448 -0.558 -3.396 1.00 0.00 H new ATOM 0 HB2 ASN A 40 2.294 1.148 -2.027 1.00 0.00 H new ATOM 0 HB3 ASN A 40 1.043 1.319 -3.242 1.00 0.00 H new ATOM 0 HD21 ASN A 40 0.925 -1.768 -0.565 1.00 0.00 H new ATOM 0 HD22 ASN A 40 2.336 -0.714 -0.695 1.00 0.00 H new ATOM 586 N GLN A 41 1.711 -1.990 -4.679 1.00 0.00 N ATOM 587 CA GLN A 41 1.025 -2.917 -5.590 1.00 0.00 C ATOM 588 C GLN A 41 -0.430 -2.508 -5.889 1.00 0.00 C ATOM 589 O GLN A 41 -0.982 -2.888 -6.911 1.00 0.00 O ATOM 590 CB GLN A 41 1.069 -4.393 -5.076 1.00 0.00 C ATOM 591 CG GLN A 41 0.466 -4.647 -3.673 1.00 0.00 C ATOM 592 CD GLN A 41 1.420 -4.349 -2.508 1.00 0.00 C ATOM 593 OE1 GLN A 41 2.315 -3.516 -2.604 1.00 0.00 O ATOM 594 NE2 GLN A 41 1.222 -5.006 -1.398 1.00 0.00 N ATOM 0 H GLN A 41 2.002 -2.430 -3.806 1.00 0.00 H new ATOM 0 HA GLN A 41 1.582 -2.858 -6.525 1.00 0.00 H new ATOM 0 HB2 GLN A 41 0.542 -5.022 -5.794 1.00 0.00 H new ATOM 0 HB3 GLN A 41 2.108 -4.722 -5.067 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -0.429 -4.035 -3.559 1.00 0.00 H new ATOM 0 HG3 GLN A 41 0.150 -5.688 -3.610 1.00 0.00 H new ATOM 0 HE21 GLN A 41 0.472 -5.695 -1.340 1.00 0.00 H new ATOM 0 HE22 GLN A 41 1.817 -4.831 -0.589 1.00 0.00 H new ATOM 603 N TYR A 42 -1.045 -1.734 -5.011 1.00 0.00 N ATOM 604 CA TYR A 42 -2.431 -1.301 -5.226 1.00 0.00 C ATOM 605 C TYR A 42 -2.496 -0.060 -6.117 1.00 0.00 C ATOM 606 O TYR A 42 -3.583 0.425 -6.456 1.00 0.00 O ATOM 607 CB TYR A 42 -3.142 -1.015 -3.900 1.00 0.00 C ATOM 608 CG TYR A 42 -3.189 -2.180 -2.931 1.00 0.00 C ATOM 609 CD1 TYR A 42 -3.695 -3.420 -3.308 1.00 0.00 C ATOM 610 CD2 TYR A 42 -2.757 -2.024 -1.623 1.00 0.00 C ATOM 611 CE1 TYR A 42 -3.765 -4.464 -2.404 1.00 0.00 C ATOM 612 CE2 TYR A 42 -2.816 -3.058 -0.723 1.00 0.00 C ATOM 613 CZ TYR A 42 -3.320 -4.273 -1.112 1.00 0.00 C ATOM 614 OH TYR A 42 -3.390 -5.299 -0.197 1.00 0.00 O ATOM 0 H TYR A 42 -0.620 -1.391 -4.150 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.942 -2.123 -5.728 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.644 -0.177 -3.412 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -4.163 -0.699 -4.114 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -4.038 -3.569 -4.321 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -2.366 -1.069 -1.306 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -4.165 -5.421 -2.707 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -2.467 -2.916 0.289 1.00 0.00 H new ATOM 0 HH TYR A 42 -2.836 -5.082 0.581 1.00 0.00 H new ATOM 624 N GLY A 43 -1.336 0.458 -6.489 1.00 0.00 N ATOM 625 CA GLY A 43 -1.292 1.632 -7.332 1.00 0.00 C ATOM 626 C GLY A 43 -1.059 2.869 -6.517 1.00 0.00 C ATOM 627 O GLY A 43 -0.886 3.952 -7.051 1.00 0.00 O ATOM 0 H GLY A 43 -0.425 0.086 -6.222 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -0.498 1.524 -8.071 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.229 1.725 -7.882 1.00 0.00 H new ATOM 631 N THR A 44 -1.073 2.689 -5.224 1.00 0.00 N ATOM 632 CA THR A 44 -0.829 3.735 -4.288 1.00 0.00 C ATOM 633 C THR A 44 0.667 4.081 -4.296 1.00 0.00 C ATOM 634 O THR A 44 1.510 3.211 -4.517 1.00 0.00 O ATOM 635 CB THR A 44 -1.227 3.227 -2.888 1.00 0.00 C ATOM 636 OG1 THR A 44 -2.532 2.632 -2.965 1.00 0.00 O ATOM 637 CG2 THR A 44 -1.252 4.360 -1.877 1.00 0.00 C ATOM 0 H THR A 44 -1.260 1.786 -4.789 1.00 0.00 H new ATOM 0 HA THR A 44 -1.406 4.623 -4.548 1.00 0.00 H new ATOM 0 HB THR A 44 -0.489 2.495 -2.560 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.556 1.823 -2.413 1.00 0.00 H new ATOM 0 HG21 THR A 44 -1.536 3.969 -0.900 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.262 4.813 -1.813 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.975 5.112 -2.191 1.00 0.00 H new ATOM 645 N TRP A 45 0.979 5.324 -4.118 1.00 0.00 N ATOM 646 CA TRP A 45 2.352 5.757 -4.003 1.00 0.00 C ATOM 647 C TRP A 45 2.546 6.293 -2.613 1.00 0.00 C ATOM 648 O TRP A 45 1.663 6.956 -2.102 1.00 0.00 O ATOM 649 CB TRP A 45 2.681 6.818 -5.051 1.00 0.00 C ATOM 650 CG TRP A 45 2.693 6.296 -6.464 1.00 0.00 C ATOM 651 CD1 TRP A 45 1.613 6.020 -7.252 1.00 0.00 C ATOM 652 CD2 TRP A 45 3.850 6.009 -7.258 1.00 0.00 C ATOM 653 NE1 TRP A 45 2.028 5.556 -8.474 1.00 0.00 N ATOM 654 CE2 TRP A 45 3.394 5.546 -8.507 1.00 0.00 C ATOM 655 CE3 TRP A 45 5.227 6.092 -7.033 1.00 0.00 C ATOM 656 CZ2 TRP A 45 4.264 5.169 -9.526 1.00 0.00 C ATOM 657 CZ3 TRP A 45 6.089 5.718 -8.045 1.00 0.00 C ATOM 658 CH2 TRP A 45 5.603 5.262 -9.277 1.00 0.00 C ATOM 0 H TRP A 45 0.294 6.077 -4.047 1.00 0.00 H new ATOM 0 HA TRP A 45 3.027 4.920 -4.180 1.00 0.00 H new ATOM 0 HB2 TRP A 45 1.952 7.625 -4.978 1.00 0.00 H new ATOM 0 HB3 TRP A 45 3.657 7.248 -4.825 1.00 0.00 H new ATOM 0 HD1 TRP A 45 0.582 6.148 -6.956 1.00 0.00 H new ATOM 0 HE1 TRP A 45 1.415 5.265 -9.236 1.00 0.00 H new ATOM 0 HE3 TRP A 45 5.610 6.442 -6.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 3.894 4.816 -10.477 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 7.155 5.778 -7.884 1.00 0.00 H new ATOM 0 HH2 TRP A 45 6.304 4.977 -10.048 1.00 0.00 H new ATOM 669 N TYR A 46 3.654 5.993 -1.997 1.00 0.00 N ATOM 670 CA TYR A 46 3.891 6.380 -0.614 1.00 0.00 C ATOM 671 C TYR A 46 5.307 6.878 -0.407 1.00 0.00 C ATOM 672 O TYR A 46 6.224 6.451 -1.092 1.00 0.00 O ATOM 673 CB TYR A 46 3.592 5.198 0.338 1.00 0.00 C ATOM 674 CG TYR A 46 4.377 3.934 0.036 1.00 0.00 C ATOM 675 CD1 TYR A 46 3.888 2.997 -0.858 1.00 0.00 C ATOM 676 CD2 TYR A 46 5.605 3.686 0.632 1.00 0.00 C ATOM 677 CE1 TYR A 46 4.599 1.860 -1.153 1.00 0.00 C ATOM 678 CE2 TYR A 46 6.315 2.543 0.338 1.00 0.00 C ATOM 679 CZ TYR A 46 5.802 1.637 -0.555 1.00 0.00 C ATOM 680 OH TYR A 46 6.510 0.505 -0.875 1.00 0.00 O ATOM 0 H TYR A 46 4.422 5.476 -2.427 1.00 0.00 H new ATOM 0 HA TYR A 46 3.213 7.202 -0.382 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.806 5.508 1.361 1.00 0.00 H new ATOM 0 HB3 TYR A 46 2.527 4.970 0.290 1.00 0.00 H new ATOM 0 HD1 TYR A 46 2.932 3.163 -1.331 1.00 0.00 H new ATOM 0 HD2 TYR A 46 6.009 4.398 1.336 1.00 0.00 H new ATOM 0 HE1 TYR A 46 4.205 1.143 -1.858 1.00 0.00 H new ATOM 0 HE2 TYR A 46 7.270 2.361 0.808 1.00 0.00 H new ATOM 0 HH TYR A 46 6.311 0.245 -1.798 1.00 0.00 H new ATOM 690 N LYS A 47 5.469 7.781 0.514 1.00 0.00 N ATOM 691 CA LYS A 47 6.766 8.287 0.870 1.00 0.00 C ATOM 692 C LYS A 47 6.927 8.242 2.388 1.00 0.00 C ATOM 693 O LYS A 47 5.950 8.493 3.125 1.00 0.00 O ATOM 694 CB LYS A 47 6.970 9.741 0.383 1.00 0.00 C ATOM 695 CG LYS A 47 5.977 10.747 0.958 1.00 0.00 C ATOM 696 CD LYS A 47 6.408 12.178 0.690 1.00 0.00 C ATOM 697 CE LYS A 47 5.404 13.171 1.259 1.00 0.00 C ATOM 698 NZ LYS A 47 5.874 14.569 1.157 1.00 0.00 N ATOM 0 H LYS A 47 4.701 8.192 1.045 1.00 0.00 H new ATOM 0 HA LYS A 47 7.514 7.659 0.385 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.980 10.059 0.641 1.00 0.00 H new ATOM 0 HB3 LYS A 47 6.898 9.760 -0.704 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.992 10.576 0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.882 10.591 2.033 1.00 0.00 H new ATOM 0 HD2 LYS A 47 7.388 12.354 1.132 1.00 0.00 H new ATOM 0 HD3 LYS A 47 6.510 12.335 -0.384 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.457 13.070 0.729 1.00 0.00 H new ATOM 0 HE3 LYS A 47 5.212 12.931 2.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.149 15.208 1.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 6.755 14.679 1.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.049 14.805 0.159 1.00 0.00 H new ATOM 712 N PRO A 48 8.115 7.880 2.890 1.00 0.00 N ATOM 713 CA PRO A 48 8.404 7.963 4.309 1.00 0.00 C ATOM 714 C PRO A 48 8.635 9.423 4.694 1.00 0.00 C ATOM 715 O PRO A 48 9.510 10.105 4.109 1.00 0.00 O ATOM 716 CB PRO A 48 9.704 7.156 4.485 1.00 0.00 C ATOM 717 CG PRO A 48 9.966 6.513 3.163 1.00 0.00 C ATOM 718 CD PRO A 48 9.251 7.335 2.138 1.00 0.00 C ATOM 0 HA PRO A 48 7.594 7.582 4.931 1.00 0.00 H new ATOM 0 HB2 PRO A 48 10.531 7.805 4.775 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.596 6.407 5.270 1.00 0.00 H new ATOM 0 HG2 PRO A 48 11.035 6.478 2.954 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.606 5.484 3.154 1.00 0.00 H new ATOM 0 HD2 PRO A 48 9.887 8.125 1.738 1.00 0.00 H new ATOM 0 HD3 PRO A 48 8.923 6.731 1.292 1.00 0.00 H new ATOM 726 N GLU A 49 7.845 9.905 5.624 1.00 0.00 N ATOM 727 CA GLU A 49 7.914 11.271 6.071 1.00 0.00 C ATOM 728 C GLU A 49 7.121 11.399 7.360 1.00 0.00 C ATOM 729 O GLU A 49 5.933 11.070 7.397 1.00 0.00 O ATOM 730 CB GLU A 49 7.340 12.202 4.988 1.00 0.00 C ATOM 731 CG GLU A 49 7.480 13.677 5.291 1.00 0.00 C ATOM 732 CD GLU A 49 6.994 14.540 4.166 1.00 0.00 C ATOM 733 OE1 GLU A 49 7.734 14.713 3.157 1.00 0.00 O ATOM 734 OE2 GLU A 49 5.876 15.077 4.243 1.00 0.00 O ATOM 0 H GLU A 49 7.129 9.352 6.095 1.00 0.00 H new ATOM 0 HA GLU A 49 8.950 11.557 6.253 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.839 11.989 4.042 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.284 11.971 4.851 1.00 0.00 H new ATOM 0 HG2 GLU A 49 6.920 13.914 6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.526 13.906 5.495 1.00 0.00 H new ATOM 741 N ASN A 50 7.765 11.845 8.407 1.00 0.00 N ATOM 742 CA ASN A 50 7.098 11.977 9.682 1.00 0.00 C ATOM 743 C ASN A 50 6.575 13.368 9.850 1.00 0.00 C ATOM 744 O ASN A 50 7.327 14.345 9.749 1.00 0.00 O ATOM 745 CB ASN A 50 8.006 11.635 10.880 1.00 0.00 C ATOM 746 CG ASN A 50 8.516 10.213 10.882 1.00 0.00 C ATOM 747 OD1 ASN A 50 9.590 9.933 10.371 1.00 0.00 O ATOM 748 ND2 ASN A 50 7.767 9.303 11.458 1.00 0.00 N ATOM 0 H ASN A 50 8.746 12.123 8.406 1.00 0.00 H new ATOM 0 HA ASN A 50 6.280 11.257 9.674 1.00 0.00 H new ATOM 0 HB2 ASN A 50 8.858 12.315 10.882 1.00 0.00 H new ATOM 0 HB3 ASN A 50 7.454 11.813 11.803 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.077 8.332 11.488 1.00 0.00 H new ATOM 0 HD22 ASN A 50 6.875 9.567 11.876 1.00 0.00 H new ATOM 755 N ALA A 51 5.309 13.462 10.087 1.00 0.00 N ATOM 756 CA ALA A 51 4.656 14.713 10.339 1.00 0.00 C ATOM 757 C ALA A 51 3.502 14.436 11.263 1.00 0.00 C ATOM 758 O ALA A 51 3.215 13.259 11.558 1.00 0.00 O ATOM 759 CB ALA A 51 4.199 15.375 9.044 1.00 0.00 C ATOM 0 H ALA A 51 4.682 12.658 10.112 1.00 0.00 H new ATOM 0 HA ALA A 51 5.347 15.417 10.803 1.00 0.00 H new ATOM 0 HB1 ALA A 51 3.708 16.321 9.272 1.00 0.00 H new ATOM 0 HB2 ALA A 51 5.063 15.559 8.405 1.00 0.00 H new ATOM 0 HB3 ALA A 51 3.499 14.719 8.527 1.00 0.00 H new ATOM 765 N THR A 52 2.829 15.450 11.700 1.00 0.00 N ATOM 766 CA THR A 52 1.803 15.269 12.663 1.00 0.00 C ATOM 767 C THR A 52 0.437 15.655 12.076 1.00 0.00 C ATOM 768 O THR A 52 0.340 16.483 11.160 1.00 0.00 O ATOM 769 CB THR A 52 2.138 16.123 13.903 1.00 0.00 C ATOM 770 OG1 THR A 52 3.519 15.896 14.250 1.00 0.00 O ATOM 771 CG2 THR A 52 1.264 15.758 15.092 1.00 0.00 C ATOM 0 H THR A 52 2.975 16.414 11.402 1.00 0.00 H new ATOM 0 HA THR A 52 1.746 14.220 12.952 1.00 0.00 H new ATOM 0 HB THR A 52 1.956 17.170 13.662 1.00 0.00 H new ATOM 0 HG1 THR A 52 3.751 16.433 15.036 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.531 16.382 15.945 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.217 15.921 14.837 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.417 14.709 15.347 1.00 0.00 H new ATOM 779 N PHE A 53 -0.575 15.000 12.531 1.00 0.00 N ATOM 780 CA PHE A 53 -1.914 15.297 12.165 1.00 0.00 C ATOM 781 C PHE A 53 -2.740 15.378 13.421 1.00 0.00 C ATOM 782 O PHE A 53 -2.763 14.444 14.222 1.00 0.00 O ATOM 783 CB PHE A 53 -2.472 14.223 11.218 1.00 0.00 C ATOM 784 CG PHE A 53 -3.924 14.403 10.853 1.00 0.00 C ATOM 785 CD1 PHE A 53 -4.316 15.387 9.963 1.00 0.00 C ATOM 786 CD2 PHE A 53 -4.895 13.573 11.399 1.00 0.00 C ATOM 787 CE1 PHE A 53 -5.645 15.543 9.627 1.00 0.00 C ATOM 788 CE2 PHE A 53 -6.223 13.726 11.066 1.00 0.00 C ATOM 789 CZ PHE A 53 -6.600 14.710 10.180 1.00 0.00 C ATOM 0 H PHE A 53 -0.490 14.222 13.186 1.00 0.00 H new ATOM 0 HA PHE A 53 -1.949 16.249 11.635 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -1.879 14.219 10.304 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -2.346 13.246 11.684 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -3.574 16.040 9.527 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -4.605 12.798 12.093 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -5.939 16.316 8.932 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -6.968 13.075 11.500 1.00 0.00 H new ATOM 0 HZ PHE A 53 -7.641 14.831 9.917 1.00 0.00 H new ATOM 799 N VAL A 54 -3.363 16.484 13.617 1.00 0.00 N ATOM 800 CA VAL A 54 -4.236 16.671 14.728 1.00 0.00 C ATOM 801 C VAL A 54 -5.637 16.585 14.184 1.00 0.00 C ATOM 802 O VAL A 54 -6.045 17.410 13.365 1.00 0.00 O ATOM 803 CB VAL A 54 -4.014 18.043 15.427 1.00 0.00 C ATOM 804 CG1 VAL A 54 -4.943 18.201 16.627 1.00 0.00 C ATOM 805 CG2 VAL A 54 -2.559 18.199 15.861 1.00 0.00 C ATOM 0 H VAL A 54 -3.283 17.296 13.006 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.044 15.911 15.486 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.248 18.827 14.707 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.768 19.168 17.098 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.980 18.141 16.295 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.746 17.406 17.347 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.426 19.165 16.347 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.300 17.403 16.559 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.910 18.141 14.987 1.00 0.00 H new ATOM 815 N ASN A 55 -6.337 15.566 14.562 1.00 0.00 N ATOM 816 CA ASN A 55 -7.665 15.368 14.041 1.00 0.00 C ATOM 817 C ASN A 55 -8.631 16.340 14.689 1.00 0.00 C ATOM 818 O ASN A 55 -8.568 16.576 15.895 1.00 0.00 O ATOM 819 CB ASN A 55 -8.146 13.932 14.238 1.00 0.00 C ATOM 820 CG ASN A 55 -9.432 13.684 13.478 1.00 0.00 C ATOM 821 OD1 ASN A 55 -9.658 14.271 12.443 1.00 0.00 O ATOM 822 ND2 ASN A 55 -10.271 12.833 13.979 1.00 0.00 N ATOM 0 H ASN A 55 -6.021 14.858 15.225 1.00 0.00 H new ATOM 0 HA ASN A 55 -7.630 15.557 12.968 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -7.378 13.237 13.898 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -8.303 13.739 15.299 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -11.151 12.642 13.500 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -10.052 12.355 14.853 1.00 0.00 H new ATOM 829 N GLY A 56 -9.501 16.883 13.902 1.00 0.00 N ATOM 830 CA GLY A 56 -10.449 17.845 14.350 1.00 0.00 C ATOM 831 C GLY A 56 -11.464 18.017 13.282 1.00 0.00 C ATOM 832 O GLY A 56 -11.319 17.399 12.241 1.00 0.00 O ATOM 0 H GLY A 56 -9.573 16.664 12.908 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.921 17.513 15.275 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -9.957 18.794 14.565 1.00 0.00 H new ATOM 836 N ASN A 57 -12.510 18.796 13.544 1.00 0.00 N ATOM 837 CA ASN A 57 -13.593 19.087 12.605 1.00 0.00 C ATOM 838 C ASN A 57 -14.566 17.944 12.565 1.00 0.00 C ATOM 839 O ASN A 57 -15.776 18.140 12.667 1.00 0.00 O ATOM 840 CB ASN A 57 -13.079 19.484 11.202 1.00 0.00 C ATOM 841 CG ASN A 57 -14.167 19.751 10.173 1.00 0.00 C ATOM 842 OD1 ASN A 57 -15.280 20.201 10.482 1.00 0.00 O ATOM 843 ND2 ASN A 57 -13.832 19.511 8.948 1.00 0.00 N ATOM 0 H ASN A 57 -12.632 19.258 14.445 1.00 0.00 H new ATOM 0 HA ASN A 57 -14.124 19.966 12.970 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -12.462 20.377 11.297 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -12.434 18.689 10.829 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -14.494 19.692 8.193 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.906 19.141 8.736 1.00 0.00 H new ATOM 850 N GLN A 58 -14.055 16.751 12.485 1.00 0.00 N ATOM 851 CA GLN A 58 -14.866 15.594 12.478 1.00 0.00 C ATOM 852 C GLN A 58 -14.062 14.373 12.913 1.00 0.00 C ATOM 853 O GLN A 58 -12.839 14.363 12.800 1.00 0.00 O ATOM 854 CB GLN A 58 -15.411 15.341 11.080 1.00 0.00 C ATOM 855 CG GLN A 58 -14.338 15.056 10.027 1.00 0.00 C ATOM 856 CD GLN A 58 -14.907 14.606 8.700 1.00 0.00 C ATOM 857 OE1 GLN A 58 -14.167 13.803 7.991 1.00 0.00 O flip ATOM 858 NE2 GLN A 58 -16.004 14.977 8.314 1.00 0.00 N flip ATOM 0 H GLN A 58 -13.054 16.564 12.423 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.689 15.758 13.174 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -16.099 14.496 11.118 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -15.990 16.210 10.766 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.742 15.956 9.873 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -13.663 14.288 10.404 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -16.562 15.607 8.891 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -16.363 14.657 7.414 1.00 0.00 H new ATOM 867 N PRO A 59 -14.721 13.362 13.479 1.00 0.00 N ATOM 868 CA PRO A 59 -14.105 12.070 13.669 1.00 0.00 C ATOM 869 C PRO A 59 -13.994 11.409 12.294 1.00 0.00 C ATOM 870 O PRO A 59 -14.979 11.370 11.529 1.00 0.00 O ATOM 871 CB PRO A 59 -15.100 11.301 14.561 1.00 0.00 C ATOM 872 CG PRO A 59 -16.055 12.330 15.059 1.00 0.00 C ATOM 873 CD PRO A 59 -16.086 13.404 14.017 1.00 0.00 C ATOM 0 HA PRO A 59 -13.112 12.106 14.118 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -15.617 10.525 13.996 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.588 10.807 15.387 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -17.046 11.902 15.208 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -15.732 12.729 16.021 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -16.832 13.202 13.248 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -16.324 14.378 14.445 1.00 0.00 H new ATOM 881 N ILE A 60 -12.849 10.903 11.965 1.00 0.00 N ATOM 882 CA ILE A 60 -12.642 10.373 10.642 1.00 0.00 C ATOM 883 C ILE A 60 -12.560 8.868 10.703 1.00 0.00 C ATOM 884 O ILE A 60 -11.767 8.326 11.466 1.00 0.00 O ATOM 885 CB ILE A 60 -11.345 10.929 9.988 1.00 0.00 C ATOM 886 CG1 ILE A 60 -11.347 12.467 9.991 1.00 0.00 C ATOM 887 CG2 ILE A 60 -11.212 10.409 8.559 1.00 0.00 C ATOM 888 CD1 ILE A 60 -10.110 13.094 9.374 1.00 0.00 C ATOM 0 H ILE A 60 -12.042 10.842 12.586 1.00 0.00 H new ATOM 0 HA ILE A 60 -13.489 10.683 10.029 1.00 0.00 H new ATOM 0 HB ILE A 60 -10.492 10.585 10.573 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -12.226 12.819 9.451 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -11.443 12.817 11.019 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -10.300 10.805 8.111 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -11.167 9.320 8.571 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -12.073 10.730 7.973 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -10.193 14.180 9.417 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.226 12.775 9.927 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -10.021 12.777 8.335 1.00 0.00 H new ATOM 900 N VAL A 61 -13.392 8.196 9.951 1.00 0.00 N ATOM 901 CA VAL A 61 -13.316 6.761 9.895 1.00 0.00 C ATOM 902 C VAL A 61 -12.120 6.383 9.010 1.00 0.00 C ATOM 903 O VAL A 61 -11.960 6.897 7.887 1.00 0.00 O ATOM 904 CB VAL A 61 -14.654 6.098 9.412 1.00 0.00 C ATOM 905 CG1 VAL A 61 -15.032 6.488 7.991 1.00 0.00 C ATOM 906 CG2 VAL A 61 -14.617 4.585 9.591 1.00 0.00 C ATOM 0 H VAL A 61 -14.122 8.614 9.375 1.00 0.00 H new ATOM 0 HA VAL A 61 -13.166 6.369 10.901 1.00 0.00 H new ATOM 0 HB VAL A 61 -15.444 6.493 10.051 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -15.966 5.998 7.715 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -15.159 7.569 7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -14.243 6.177 7.306 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -15.558 4.155 9.248 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -13.794 4.170 9.009 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -14.472 4.347 10.645 1.00 0.00 H new ATOM 916 N THR A 62 -11.271 5.554 9.521 1.00 0.00 N ATOM 917 CA THR A 62 -10.061 5.228 8.862 1.00 0.00 C ATOM 918 C THR A 62 -10.112 3.821 8.265 1.00 0.00 C ATOM 919 O THR A 62 -11.040 3.037 8.537 1.00 0.00 O ATOM 920 CB THR A 62 -8.859 5.413 9.822 1.00 0.00 C ATOM 921 OG1 THR A 62 -9.071 4.693 11.044 1.00 0.00 O ATOM 922 CG2 THR A 62 -8.670 6.880 10.162 1.00 0.00 C ATOM 0 H THR A 62 -11.404 5.083 10.416 1.00 0.00 H new ATOM 0 HA THR A 62 -9.926 5.914 8.026 1.00 0.00 H new ATOM 0 HB THR A 62 -7.973 5.030 9.316 1.00 0.00 H new ATOM 0 HG1 THR A 62 -8.384 4.945 11.696 1.00 0.00 H new ATOM 0 HG21 THR A 62 -7.821 6.991 10.837 1.00 0.00 H new ATOM 0 HG22 THR A 62 -8.483 7.444 9.248 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.570 7.260 10.645 1.00 0.00 H new ATOM 930 N ARG A 63 -9.151 3.516 7.435 1.00 0.00 N ATOM 931 CA ARG A 63 -9.101 2.250 6.753 1.00 0.00 C ATOM 932 C ARG A 63 -7.887 1.497 7.232 1.00 0.00 C ATOM 933 O ARG A 63 -6.855 2.099 7.493 1.00 0.00 O ATOM 934 CB ARG A 63 -9.026 2.477 5.246 1.00 0.00 C ATOM 935 CG ARG A 63 -10.153 3.346 4.697 1.00 0.00 C ATOM 936 CD ARG A 63 -11.523 2.715 4.884 1.00 0.00 C ATOM 937 NE ARG A 63 -12.591 3.625 4.443 1.00 0.00 N ATOM 938 CZ ARG A 63 -13.755 3.250 3.881 1.00 0.00 C ATOM 939 NH1 ARG A 63 -13.990 1.980 3.588 1.00 0.00 N ATOM 940 NH2 ARG A 63 -14.685 4.157 3.610 1.00 0.00 N ATOM 0 H ARG A 63 -8.377 4.141 7.212 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.999 1.671 6.967 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.070 2.943 5.005 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -9.046 1.511 4.741 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -10.133 4.316 5.193 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -9.983 3.527 3.636 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -11.578 1.784 4.319 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -11.669 2.460 5.934 1.00 0.00 H new ATOM 0 HE ARG A 63 -12.436 4.625 4.574 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -13.284 1.271 3.788 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -14.877 1.710 3.162 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -14.518 5.139 3.828 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -15.567 3.872 3.184 1.00 0.00 H new ATOM 954 N ILE A 64 -7.992 0.207 7.353 1.00 0.00 N ATOM 955 CA ILE A 64 -6.902 -0.567 7.904 1.00 0.00 C ATOM 956 C ILE A 64 -6.251 -1.475 6.847 1.00 0.00 C ATOM 957 O ILE A 64 -6.938 -2.108 6.043 1.00 0.00 O ATOM 958 CB ILE A 64 -7.376 -1.430 9.120 1.00 0.00 C ATOM 959 CG1 ILE A 64 -8.075 -0.546 10.172 1.00 0.00 C ATOM 960 CG2 ILE A 64 -6.189 -2.158 9.759 1.00 0.00 C ATOM 961 CD1 ILE A 64 -8.628 -1.315 11.360 1.00 0.00 C ATOM 0 H ILE A 64 -8.812 -0.335 7.082 1.00 0.00 H new ATOM 0 HA ILE A 64 -6.155 0.148 8.247 1.00 0.00 H new ATOM 0 HB ILE A 64 -8.087 -2.170 8.753 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -7.366 0.199 10.533 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -8.890 -0.004 9.692 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -6.538 -2.753 10.603 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -5.724 -2.812 9.022 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -5.459 -1.427 10.108 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -9.103 -0.621 12.053 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -9.363 -2.042 11.013 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -7.815 -1.835 11.867 1.00 0.00 H new ATOM 973 N GLY A 65 -4.931 -1.473 6.833 1.00 0.00 N ATOM 974 CA GLY A 65 -4.127 -2.384 6.033 1.00 0.00 C ATOM 975 C GLY A 65 -3.962 -2.027 4.569 1.00 0.00 C ATOM 976 O GLY A 65 -2.991 -2.453 3.935 1.00 0.00 O ATOM 0 H GLY A 65 -4.374 -0.824 7.389 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.136 -2.450 6.483 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.572 -3.377 6.095 1.00 0.00 H new ATOM 980 N SER A 66 -4.859 -1.264 4.017 1.00 0.00 N ATOM 981 CA SER A 66 -4.776 -0.898 2.618 1.00 0.00 C ATOM 982 C SER A 66 -5.530 0.402 2.371 1.00 0.00 C ATOM 983 O SER A 66 -6.597 0.603 2.942 1.00 0.00 O ATOM 984 CB SER A 66 -5.369 -2.022 1.742 1.00 0.00 C ATOM 985 OG SER A 66 -4.682 -3.265 1.936 1.00 0.00 O ATOM 0 H SER A 66 -5.664 -0.877 4.510 1.00 0.00 H new ATOM 0 HA SER A 66 -3.728 -0.756 2.354 1.00 0.00 H new ATOM 0 HB2 SER A 66 -6.425 -2.149 1.979 1.00 0.00 H new ATOM 0 HB3 SER A 66 -5.311 -1.734 0.692 1.00 0.00 H new ATOM 0 HG SER A 66 -4.077 -3.425 1.182 1.00 0.00 H new ATOM 991 N PRO A 67 -4.966 1.323 1.580 1.00 0.00 N ATOM 992 CA PRO A 67 -5.647 2.541 1.209 1.00 0.00 C ATOM 993 C PRO A 67 -6.470 2.377 -0.091 1.00 0.00 C ATOM 994 O PRO A 67 -5.936 2.035 -1.150 1.00 0.00 O ATOM 995 CB PRO A 67 -4.501 3.537 1.018 1.00 0.00 C ATOM 996 CG PRO A 67 -3.309 2.706 0.633 1.00 0.00 C ATOM 997 CD PRO A 67 -3.604 1.271 1.016 1.00 0.00 C ATOM 0 HA PRO A 67 -6.374 2.857 1.957 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -4.739 4.265 0.243 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.310 4.097 1.934 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -3.118 2.784 -0.437 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -2.414 3.062 1.144 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -3.555 0.609 0.151 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -2.885 0.897 1.744 1.00 0.00 H new ATOM 1005 N PHE A 68 -7.753 2.624 0.023 1.00 0.00 N ATOM 1006 CA PHE A 68 -8.743 2.576 -1.056 1.00 0.00 C ATOM 1007 C PHE A 68 -9.922 3.325 -0.514 1.00 0.00 C ATOM 1008 O PHE A 68 -9.958 3.611 0.689 1.00 0.00 O ATOM 1009 CB PHE A 68 -9.293 1.151 -1.367 1.00 0.00 C ATOM 1010 CG PHE A 68 -8.331 0.066 -1.720 1.00 0.00 C ATOM 1011 CD1 PHE A 68 -7.737 0.021 -2.962 1.00 0.00 C ATOM 1012 CD2 PHE A 68 -8.055 -0.938 -0.811 1.00 0.00 C ATOM 1013 CE1 PHE A 68 -6.878 -1.005 -3.286 1.00 0.00 C ATOM 1014 CE2 PHE A 68 -7.206 -1.965 -1.136 1.00 0.00 C ATOM 1015 CZ PHE A 68 -6.617 -1.997 -2.371 1.00 0.00 C ATOM 0 H PHE A 68 -8.170 2.880 0.918 1.00 0.00 H new ATOM 0 HA PHE A 68 -8.275 2.961 -1.962 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -9.858 0.819 -0.496 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.001 1.244 -2.190 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.946 0.795 -3.686 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -8.513 -0.914 0.167 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.409 -1.030 -4.259 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -7.003 -2.747 -0.419 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.946 -2.803 -2.627 1.00 0.00 H new ATOM 1025 N LEU A 69 -10.890 3.609 -1.340 1.00 0.00 N ATOM 1026 CA LEU A 69 -12.125 4.205 -0.850 1.00 0.00 C ATOM 1027 C LEU A 69 -13.052 3.125 -0.300 1.00 0.00 C ATOM 1028 O LEU A 69 -13.862 3.373 0.580 1.00 0.00 O ATOM 1029 CB LEU A 69 -12.839 5.057 -1.921 1.00 0.00 C ATOM 1030 CG LEU A 69 -12.285 6.479 -2.188 1.00 0.00 C ATOM 1031 CD1 LEU A 69 -12.338 7.324 -0.930 1.00 0.00 C ATOM 1032 CD2 LEU A 69 -10.874 6.455 -2.763 1.00 0.00 C ATOM 0 H LEU A 69 -10.860 3.444 -2.346 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.857 4.886 -0.042 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.816 4.505 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.886 5.152 -1.633 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.929 6.933 -2.942 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.944 8.318 -1.142 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -13.371 7.408 -0.591 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.738 6.854 -0.151 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.532 7.476 -2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.203 5.959 -2.061 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -10.875 5.912 -3.708 1.00 0.00 H new ATOM 1044 N ASN A 70 -12.891 1.917 -0.806 1.00 0.00 N ATOM 1045 CA ASN A 70 -13.688 0.768 -0.366 1.00 0.00 C ATOM 1046 C ASN A 70 -12.791 -0.152 0.486 1.00 0.00 C ATOM 1047 O ASN A 70 -13.017 -1.352 0.619 1.00 0.00 O ATOM 1048 CB ASN A 70 -14.247 0.037 -1.614 1.00 0.00 C ATOM 1049 CG ASN A 70 -15.329 -1.008 -1.322 1.00 0.00 C ATOM 1050 OD1 ASN A 70 -16.520 -0.678 -1.229 1.00 0.00 O ATOM 1051 ND2 ASN A 70 -14.960 -2.263 -1.256 1.00 0.00 N ATOM 0 H ASN A 70 -12.209 1.696 -1.531 1.00 0.00 H new ATOM 0 HA ASN A 70 -14.534 1.083 0.245 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -14.656 0.780 -2.299 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.421 -0.452 -2.130 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.659 -2.994 -1.125 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -13.973 -2.509 -1.335 1.00 0.00 H new ATOM 1058 N ALA A 71 -11.778 0.446 1.080 1.00 0.00 N ATOM 1059 CA ALA A 71 -10.801 -0.265 1.912 1.00 0.00 C ATOM 1060 C ALA A 71 -11.440 -0.769 3.220 1.00 0.00 C ATOM 1061 O ALA A 71 -12.469 -0.232 3.645 1.00 0.00 O ATOM 1062 CB ALA A 71 -9.647 0.661 2.226 1.00 0.00 C ATOM 0 H ALA A 71 -11.599 1.447 1.004 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.442 -1.134 1.360 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.918 0.137 2.844 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -9.173 0.980 1.298 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -10.017 1.534 2.763 1.00 0.00 H new ATOM 1068 N PRO A 72 -10.844 -1.808 3.866 1.00 0.00 N ATOM 1069 CA PRO A 72 -11.356 -2.378 5.130 1.00 0.00 C ATOM 1070 C PRO A 72 -11.552 -1.334 6.242 1.00 0.00 C ATOM 1071 O PRO A 72 -10.669 -0.498 6.509 1.00 0.00 O ATOM 1072 CB PRO A 72 -10.276 -3.382 5.534 1.00 0.00 C ATOM 1073 CG PRO A 72 -9.640 -3.776 4.254 1.00 0.00 C ATOM 1074 CD PRO A 72 -9.634 -2.539 3.408 1.00 0.00 C ATOM 0 HA PRO A 72 -12.345 -2.814 4.989 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -9.553 -2.934 6.216 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -10.706 -4.243 6.046 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -8.627 -4.144 4.417 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -10.197 -4.579 3.771 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -8.728 -1.952 3.559 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -9.686 -2.778 2.346 1.00 0.00 H new ATOM 1082 N VAL A 73 -12.698 -1.416 6.877 1.00 0.00 N ATOM 1083 CA VAL A 73 -13.115 -0.525 7.946 1.00 0.00 C ATOM 1084 C VAL A 73 -12.881 -1.169 9.303 1.00 0.00 C ATOM 1085 O VAL A 73 -12.439 -2.317 9.383 1.00 0.00 O ATOM 1086 CB VAL A 73 -14.597 -0.064 7.819 1.00 0.00 C ATOM 1087 CG1 VAL A 73 -14.793 0.769 6.572 1.00 0.00 C ATOM 1088 CG2 VAL A 73 -15.553 -1.248 7.812 1.00 0.00 C ATOM 0 H VAL A 73 -13.394 -2.129 6.659 1.00 0.00 H new ATOM 0 HA VAL A 73 -12.499 0.369 7.855 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.824 0.547 8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -15.835 1.081 6.503 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.153 1.650 6.619 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -14.532 0.177 5.695 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -16.578 -0.888 7.722 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.321 -1.898 6.968 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.445 -1.808 8.741 1.00 0.00 H new ATOM 1098 N GLY A 74 -13.148 -0.430 10.354 1.00 0.00 N ATOM 1099 CA GLY A 74 -12.935 -0.931 11.694 1.00 0.00 C ATOM 1100 C GLY A 74 -11.966 -0.080 12.457 1.00 0.00 C ATOM 1101 O GLY A 74 -11.599 -0.383 13.592 1.00 0.00 O ATOM 0 H GLY A 74 -13.513 0.521 10.308 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -13.886 -0.965 12.225 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.561 -1.954 11.645 1.00 0.00 H new ATOM 1105 N GLY A 75 -11.559 0.988 11.846 1.00 0.00 N ATOM 1106 CA GLY A 75 -10.740 1.946 12.499 1.00 0.00 C ATOM 1107 C GLY A 75 -11.435 3.265 12.459 1.00 0.00 C ATOM 1108 O GLY A 75 -11.886 3.677 11.405 1.00 0.00 O ATOM 0 H GLY A 75 -11.789 1.216 10.879 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.554 1.646 13.530 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -9.770 2.014 12.007 1.00 0.00 H new ATOM 1112 N ASN A 76 -11.645 3.872 13.581 1.00 0.00 N ATOM 1113 CA ASN A 76 -12.242 5.185 13.581 1.00 0.00 C ATOM 1114 C ASN A 76 -11.397 6.129 14.410 1.00 0.00 C ATOM 1115 O ASN A 76 -11.079 5.831 15.561 1.00 0.00 O ATOM 1116 CB ASN A 76 -13.689 5.139 14.074 1.00 0.00 C ATOM 1117 CG ASN A 76 -14.432 6.436 13.819 1.00 0.00 C ATOM 1118 OD1 ASN A 76 -15.022 6.626 12.765 1.00 0.00 O ATOM 1119 ND2 ASN A 76 -14.423 7.322 14.766 1.00 0.00 N ATOM 0 H ASN A 76 -11.419 3.495 14.501 1.00 0.00 H new ATOM 0 HA ASN A 76 -12.272 5.558 12.557 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -14.212 4.321 13.579 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -13.699 4.923 15.142 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -14.917 8.206 14.642 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.922 7.135 15.635 1.00 0.00 H new ATOM 1126 N LEU A 77 -11.022 7.236 13.838 1.00 0.00 N ATOM 1127 CA LEU A 77 -10.167 8.195 14.497 1.00 0.00 C ATOM 1128 C LEU A 77 -11.006 9.322 15.114 1.00 0.00 C ATOM 1129 O LEU A 77 -11.665 10.077 14.388 1.00 0.00 O ATOM 1130 CB LEU A 77 -9.177 8.775 13.475 1.00 0.00 C ATOM 1131 CG LEU A 77 -8.118 9.737 14.010 1.00 0.00 C ATOM 1132 CD1 LEU A 77 -7.199 9.028 14.987 1.00 0.00 C ATOM 1133 CD2 LEU A 77 -7.317 10.335 12.865 1.00 0.00 C ATOM 0 H LEU A 77 -11.300 7.506 12.894 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.618 7.698 15.296 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.666 7.944 12.988 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -9.749 9.293 12.705 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.623 10.546 14.538 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.451 9.729 15.357 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.783 8.645 15.824 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.701 8.200 14.483 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.567 11.018 13.264 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.823 9.537 12.311 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -7.986 10.879 12.198 1.00 0.00 H new ATOM 1145 N PRO A 78 -11.018 9.444 16.453 1.00 0.00 N ATOM 1146 CA PRO A 78 -11.757 10.507 17.136 1.00 0.00 C ATOM 1147 C PRO A 78 -11.064 11.861 16.964 1.00 0.00 C ATOM 1148 O PRO A 78 -9.877 11.926 16.600 1.00 0.00 O ATOM 1149 CB PRO A 78 -11.731 10.078 18.607 1.00 0.00 C ATOM 1150 CG PRO A 78 -10.510 9.235 18.737 1.00 0.00 C ATOM 1151 CD PRO A 78 -10.322 8.552 17.411 1.00 0.00 C ATOM 0 HA PRO A 78 -12.765 10.633 16.742 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -11.687 10.942 19.270 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -12.628 9.518 18.872 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -9.642 9.845 18.986 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -10.626 8.504 19.537 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -9.266 8.444 17.163 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -10.753 7.551 17.412 1.00 0.00 H new ATOM 1159 N ALA A 79 -11.796 12.925 17.167 1.00 0.00 N ATOM 1160 CA ALA A 79 -11.242 14.258 17.062 1.00 0.00 C ATOM 1161 C ALA A 79 -10.413 14.563 18.303 1.00 0.00 C ATOM 1162 O ALA A 79 -10.644 13.980 19.366 1.00 0.00 O ATOM 1163 CB ALA A 79 -12.344 15.282 16.873 1.00 0.00 C ATOM 0 H ALA A 79 -12.787 12.898 17.408 1.00 0.00 H new ATOM 0 HA ALA A 79 -10.594 14.310 16.187 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -11.906 16.277 16.796 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -12.897 15.057 15.961 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -13.022 15.248 17.726 1.00 0.00 H new ATOM 1169 N GLY A 80 -9.447 15.442 18.171 1.00 0.00 N ATOM 1170 CA GLY A 80 -8.583 15.775 19.281 1.00 0.00 C ATOM 1171 C GLY A 80 -7.447 14.790 19.402 1.00 0.00 C ATOM 1172 O GLY A 80 -6.723 14.771 20.392 1.00 0.00 O ATOM 0 H GLY A 80 -9.239 15.940 17.306 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.184 16.780 19.146 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.161 15.783 20.205 1.00 0.00 H new ATOM 1176 N ALA A 81 -7.306 13.960 18.398 1.00 0.00 N ATOM 1177 CA ALA A 81 -6.276 12.958 18.378 1.00 0.00 C ATOM 1178 C ALA A 81 -5.051 13.483 17.669 1.00 0.00 C ATOM 1179 O ALA A 81 -5.143 13.973 16.540 1.00 0.00 O ATOM 1180 CB ALA A 81 -6.780 11.698 17.695 1.00 0.00 C ATOM 0 H ALA A 81 -7.904 13.962 17.572 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.007 12.713 19.406 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.990 10.948 17.687 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.643 11.311 18.237 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -7.070 11.931 16.670 1.00 0.00 H new ATOM 1186 N THR A 82 -3.930 13.404 18.327 1.00 0.00 N ATOM 1187 CA THR A 82 -2.687 13.809 17.747 1.00 0.00 C ATOM 1188 C THR A 82 -1.977 12.571 17.191 1.00 0.00 C ATOM 1189 O THR A 82 -1.519 11.700 17.947 1.00 0.00 O ATOM 1190 CB THR A 82 -1.815 14.525 18.798 1.00 0.00 C ATOM 1191 OG1 THR A 82 -2.561 15.630 19.339 1.00 0.00 O ATOM 1192 CG2 THR A 82 -0.523 15.046 18.187 1.00 0.00 C ATOM 0 H THR A 82 -3.855 13.056 19.283 1.00 0.00 H new ATOM 0 HA THR A 82 -2.867 14.513 16.934 1.00 0.00 H new ATOM 0 HB THR A 82 -1.556 13.811 19.580 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.018 16.094 20.011 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.068 15.545 18.955 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.047 14.213 17.775 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.756 15.754 17.392 1.00 0.00 H new ATOM 1200 N ILE A 83 -1.931 12.477 15.891 1.00 0.00 N ATOM 1201 CA ILE A 83 -1.364 11.340 15.213 1.00 0.00 C ATOM 1202 C ILE A 83 -0.046 11.710 14.559 1.00 0.00 C ATOM 1203 O ILE A 83 0.003 12.605 13.720 1.00 0.00 O ATOM 1204 CB ILE A 83 -2.340 10.805 14.121 1.00 0.00 C ATOM 1205 CG1 ILE A 83 -3.682 10.372 14.738 1.00 0.00 C ATOM 1206 CG2 ILE A 83 -1.716 9.659 13.323 1.00 0.00 C ATOM 1207 CD1 ILE A 83 -3.570 9.261 15.770 1.00 0.00 C ATOM 0 H ILE A 83 -2.290 13.196 15.263 1.00 0.00 H new ATOM 0 HA ILE A 83 -1.194 10.562 15.957 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.533 11.625 13.430 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -4.150 11.239 15.205 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -4.346 10.043 13.939 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.424 9.311 12.571 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -0.808 10.010 12.832 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -1.470 8.838 13.997 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.561 9.019 16.153 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.134 8.376 15.306 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.934 9.591 16.592 1.00 0.00 H new ATOM 1219 N VAL A 84 1.015 11.062 14.958 1.00 0.00 N ATOM 1220 CA VAL A 84 2.273 11.260 14.304 1.00 0.00 C ATOM 1221 C VAL A 84 2.498 10.100 13.322 1.00 0.00 C ATOM 1222 O VAL A 84 2.715 8.942 13.714 1.00 0.00 O ATOM 1223 CB VAL A 84 3.466 11.463 15.310 1.00 0.00 C ATOM 1224 CG1 VAL A 84 3.644 10.287 16.271 1.00 0.00 C ATOM 1225 CG2 VAL A 84 4.763 11.777 14.571 1.00 0.00 C ATOM 0 H VAL A 84 1.030 10.396 15.730 1.00 0.00 H new ATOM 0 HA VAL A 84 2.241 12.195 13.745 1.00 0.00 H new ATOM 0 HB VAL A 84 3.207 12.324 15.926 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.482 10.487 16.939 1.00 0.00 H new ATOM 0 HG12 VAL A 84 2.735 10.156 16.858 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.842 9.379 15.702 1.00 0.00 H new ATOM 0 HG21 VAL A 84 5.569 11.912 15.292 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.009 10.953 13.902 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.639 12.691 13.990 1.00 0.00 H new ATOM 1235 N TYR A 85 2.384 10.402 12.062 1.00 0.00 N ATOM 1236 CA TYR A 85 2.462 9.393 11.025 1.00 0.00 C ATOM 1237 C TYR A 85 3.842 9.343 10.411 1.00 0.00 C ATOM 1238 O TYR A 85 4.639 10.270 10.593 1.00 0.00 O ATOM 1239 CB TYR A 85 1.379 9.620 9.950 1.00 0.00 C ATOM 1240 CG TYR A 85 1.396 10.994 9.294 1.00 0.00 C ATOM 1241 CD1 TYR A 85 2.207 11.258 8.198 1.00 0.00 C ATOM 1242 CD2 TYR A 85 0.585 12.019 9.765 1.00 0.00 C ATOM 1243 CE1 TYR A 85 2.208 12.499 7.597 1.00 0.00 C ATOM 1244 CE2 TYR A 85 0.580 13.259 9.159 1.00 0.00 C ATOM 1245 CZ TYR A 85 1.392 13.493 8.078 1.00 0.00 C ATOM 1246 OH TYR A 85 1.384 14.724 7.468 1.00 0.00 O ATOM 0 H TYR A 85 2.235 11.350 11.716 1.00 0.00 H new ATOM 0 HA TYR A 85 2.274 8.424 11.488 1.00 0.00 H new ATOM 0 HB2 TYR A 85 1.495 8.863 9.174 1.00 0.00 H new ATOM 0 HB3 TYR A 85 0.400 9.464 10.404 1.00 0.00 H new ATOM 0 HD1 TYR A 85 2.847 10.479 7.810 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -0.052 11.843 10.619 1.00 0.00 H new ATOM 0 HE1 TYR A 85 2.850 12.689 6.749 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -0.061 14.043 9.535 1.00 0.00 H new ATOM 0 HH TYR A 85 0.752 15.314 7.930 1.00 0.00 H new ATOM 1256 N ASP A 86 4.128 8.267 9.705 1.00 0.00 N ATOM 1257 CA ASP A 86 5.436 8.096 9.065 1.00 0.00 C ATOM 1258 C ASP A 86 5.298 7.825 7.583 1.00 0.00 C ATOM 1259 O ASP A 86 6.285 7.858 6.835 1.00 0.00 O ATOM 1260 CB ASP A 86 6.229 6.936 9.705 1.00 0.00 C ATOM 1261 CG ASP A 86 5.601 5.566 9.495 1.00 0.00 C ATOM 1262 OD1 ASP A 86 4.705 5.186 10.269 1.00 0.00 O ATOM 1263 OD2 ASP A 86 6.017 4.826 8.572 1.00 0.00 O ATOM 0 H ASP A 86 3.480 7.494 9.555 1.00 0.00 H new ATOM 0 HA ASP A 86 5.976 9.031 9.213 1.00 0.00 H new ATOM 0 HB2 ASP A 86 7.238 6.929 9.293 1.00 0.00 H new ATOM 0 HB3 ASP A 86 6.323 7.121 10.775 1.00 0.00 H new ATOM 1268 N GLU A 87 4.104 7.562 7.146 1.00 0.00 N ATOM 1269 CA GLU A 87 3.890 7.196 5.782 1.00 0.00 C ATOM 1270 C GLU A 87 2.849 8.091 5.170 1.00 0.00 C ATOM 1271 O GLU A 87 1.753 8.241 5.707 1.00 0.00 O ATOM 1272 CB GLU A 87 3.466 5.737 5.734 1.00 0.00 C ATOM 1273 CG GLU A 87 3.370 5.113 4.360 1.00 0.00 C ATOM 1274 CD GLU A 87 3.169 3.622 4.465 1.00 0.00 C ATOM 1275 OE1 GLU A 87 4.152 2.901 4.770 1.00 0.00 O ATOM 1276 OE2 GLU A 87 2.055 3.137 4.298 1.00 0.00 O ATOM 0 H GLU A 87 3.260 7.595 7.718 1.00 0.00 H new ATOM 0 HA GLU A 87 4.807 7.317 5.206 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.173 5.155 6.325 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.494 5.647 6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.541 5.559 3.810 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.278 5.324 3.795 1.00 0.00 H new ATOM 1283 N VAL A 88 3.207 8.724 4.098 1.00 0.00 N ATOM 1284 CA VAL A 88 2.302 9.573 3.374 1.00 0.00 C ATOM 1285 C VAL A 88 2.048 8.902 2.047 1.00 0.00 C ATOM 1286 O VAL A 88 2.994 8.650 1.311 1.00 0.00 O ATOM 1287 CB VAL A 88 2.922 10.974 3.123 1.00 0.00 C ATOM 1288 CG1 VAL A 88 1.925 11.902 2.464 1.00 0.00 C ATOM 1289 CG2 VAL A 88 3.438 11.580 4.412 1.00 0.00 C ATOM 0 H VAL A 88 4.142 8.669 3.694 1.00 0.00 H new ATOM 0 HA VAL A 88 1.385 9.715 3.946 1.00 0.00 H new ATOM 0 HB VAL A 88 3.765 10.844 2.445 1.00 0.00 H new ATOM 0 HG11 VAL A 88 2.387 12.876 2.301 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.615 11.482 1.507 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.054 12.018 3.109 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.867 12.561 4.207 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.616 11.684 5.120 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.203 10.931 4.838 1.00 0.00 H new ATOM 1299 N CYS A 89 0.818 8.587 1.745 1.00 0.00 N ATOM 1300 CA CYS A 89 0.527 7.881 0.524 1.00 0.00 C ATOM 1301 C CYS A 89 -0.601 8.530 -0.266 1.00 0.00 C ATOM 1302 O CYS A 89 -1.453 9.200 0.293 1.00 0.00 O ATOM 1303 CB CYS A 89 0.221 6.412 0.822 1.00 0.00 C ATOM 1304 SG CYS A 89 -1.159 6.148 1.935 1.00 0.00 S ATOM 0 H CYS A 89 0.005 8.805 2.322 1.00 0.00 H new ATOM 0 HA CYS A 89 1.415 7.934 -0.106 1.00 0.00 H new ATOM 0 HB2 CYS A 89 0.016 5.899 -0.118 1.00 0.00 H new ATOM 0 HB3 CYS A 89 1.110 5.949 1.250 1.00 0.00 H new ATOM 0 HG CYS A 89 -1.272 7.166 2.735 1.00 0.00 H new ATOM 1310 N ILE A 90 -0.577 8.354 -1.563 1.00 0.00 N ATOM 1311 CA ILE A 90 -1.610 8.862 -2.429 1.00 0.00 C ATOM 1312 C ILE A 90 -2.389 7.714 -3.037 1.00 0.00 C ATOM 1313 O ILE A 90 -1.836 6.898 -3.788 1.00 0.00 O ATOM 1314 CB ILE A 90 -1.055 9.752 -3.597 1.00 0.00 C ATOM 1315 CG1 ILE A 90 -0.325 10.986 -3.060 1.00 0.00 C ATOM 1316 CG2 ILE A 90 -2.193 10.188 -4.537 1.00 0.00 C ATOM 1317 CD1 ILE A 90 0.298 11.855 -4.145 1.00 0.00 C ATOM 0 H ILE A 90 0.165 7.851 -2.050 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.249 9.486 -1.804 1.00 0.00 H new ATOM 0 HB ILE A 90 -0.342 9.147 -4.157 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.027 11.589 -2.484 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.457 10.663 -2.373 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.786 10.804 -5.339 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.671 9.306 -4.963 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.929 10.763 -3.975 1.00 0.00 H new ATOM 0 HD11 ILE A 90 0.796 12.709 -3.686 1.00 0.00 H new ATOM 0 HD12 ILE A 90 1.025 11.269 -4.707 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.481 12.210 -4.819 1.00 0.00 H new ATOM 1329 N GLN A 91 -3.627 7.622 -2.665 1.00 0.00 N ATOM 1330 CA GLN A 91 -4.559 6.747 -3.307 1.00 0.00 C ATOM 1331 C GLN A 91 -5.511 7.689 -3.981 1.00 0.00 C ATOM 1332 O GLN A 91 -6.250 8.411 -3.294 1.00 0.00 O ATOM 1333 CB GLN A 91 -5.265 5.809 -2.303 1.00 0.00 C ATOM 1334 CG GLN A 91 -6.357 4.925 -2.911 1.00 0.00 C ATOM 1335 CD GLN A 91 -5.847 4.058 -4.059 1.00 0.00 C ATOM 1336 OE1 GLN A 91 -5.856 4.475 -5.217 1.00 0.00 O ATOM 1337 NE2 GLN A 91 -5.426 2.858 -3.757 1.00 0.00 N ATOM 0 H GLN A 91 -4.025 8.160 -1.896 1.00 0.00 H new ATOM 0 HA GLN A 91 -4.083 6.063 -4.009 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -4.516 5.169 -1.837 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -5.706 6.413 -1.510 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -6.773 4.283 -2.134 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -7.169 5.556 -3.272 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -5.432 2.545 -2.786 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -5.091 2.235 -4.492 1.00 0.00 H new ATOM 1346 N ALA A 92 -5.497 7.667 -5.303 1.00 0.00 N ATOM 1347 CA ALA A 92 -6.098 8.705 -6.143 1.00 0.00 C ATOM 1348 C ALA A 92 -7.516 9.062 -5.731 1.00 0.00 C ATOM 1349 O ALA A 92 -8.463 8.272 -5.870 1.00 0.00 O ATOM 1350 CB ALA A 92 -6.032 8.295 -7.602 1.00 0.00 C ATOM 0 H ALA A 92 -5.061 6.916 -5.838 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.513 9.613 -6.000 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -6.481 9.073 -8.219 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.991 8.156 -7.894 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.576 7.361 -7.742 1.00 0.00 H new ATOM 1356 N GLY A 93 -7.624 10.262 -5.190 1.00 0.00 N ATOM 1357 CA GLY A 93 -8.847 10.768 -4.664 1.00 0.00 C ATOM 1358 C GLY A 93 -8.572 11.469 -3.356 1.00 0.00 C ATOM 1359 O GLY A 93 -9.157 12.499 -3.046 1.00 0.00 O ATOM 0 H GLY A 93 -6.842 10.912 -5.110 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -9.303 11.460 -5.372 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -9.556 9.954 -4.512 1.00 0.00 H new ATOM 1363 N HIS A 94 -7.642 10.922 -2.590 1.00 0.00 N ATOM 1364 CA HIS A 94 -7.265 11.483 -1.293 1.00 0.00 C ATOM 1365 C HIS A 94 -5.818 11.200 -1.015 1.00 0.00 C ATOM 1366 O HIS A 94 -5.199 10.370 -1.681 1.00 0.00 O ATOM 1367 CB HIS A 94 -8.098 10.882 -0.129 1.00 0.00 C ATOM 1368 CG HIS A 94 -9.549 11.220 -0.145 1.00 0.00 C ATOM 1369 ND1 HIS A 94 -10.530 10.315 -0.459 1.00 0.00 N ATOM 1370 CD2 HIS A 94 -10.183 12.374 0.113 1.00 0.00 C ATOM 1371 CE1 HIS A 94 -11.701 10.909 -0.396 1.00 0.00 C ATOM 1372 NE2 HIS A 94 -11.521 12.156 -0.057 1.00 0.00 N ATOM 0 H HIS A 94 -7.126 10.080 -2.844 1.00 0.00 H new ATOM 0 HA HIS A 94 -7.455 12.555 -1.347 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -7.994 9.797 -0.152 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -7.672 11.223 0.815 1.00 0.00 H new ATOM 0 HD1 HIS A 94 -10.376 9.337 -0.703 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -9.720 13.306 0.402 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -12.655 10.442 -0.592 1.00 0.00 H new ATOM 1381 N ILE A 95 -5.283 11.881 -0.057 1.00 0.00 N ATOM 1382 CA ILE A 95 -3.974 11.576 0.411 1.00 0.00 C ATOM 1383 C ILE A 95 -4.200 10.836 1.714 1.00 0.00 C ATOM 1384 O ILE A 95 -5.086 11.194 2.477 1.00 0.00 O ATOM 1385 CB ILE A 95 -3.088 12.859 0.596 1.00 0.00 C ATOM 1386 CG1 ILE A 95 -1.623 12.497 0.872 1.00 0.00 C ATOM 1387 CG2 ILE A 95 -3.624 13.764 1.699 1.00 0.00 C ATOM 1388 CD1 ILE A 95 -0.696 13.701 0.896 1.00 0.00 C ATOM 0 H ILE A 95 -5.738 12.659 0.420 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.416 10.975 -0.307 1.00 0.00 H new ATOM 0 HB ILE A 95 -3.135 13.409 -0.344 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.559 11.980 1.829 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.279 11.799 0.109 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.982 14.640 1.795 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.637 14.081 1.449 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.637 13.219 2.643 1.00 0.00 H new ATOM 0 HD11 ILE A 95 0.323 13.371 1.096 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.731 14.206 -0.069 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.015 14.390 1.678 1.00 0.00 H new ATOM 1400 N TRP A 96 -3.504 9.788 1.922 1.00 0.00 N ATOM 1401 CA TRP A 96 -3.749 8.967 3.064 1.00 0.00 C ATOM 1402 C TRP A 96 -2.523 8.921 3.917 1.00 0.00 C ATOM 1403 O TRP A 96 -1.403 8.782 3.406 1.00 0.00 O ATOM 1404 CB TRP A 96 -4.154 7.543 2.631 1.00 0.00 C ATOM 1405 CG TRP A 96 -5.380 7.482 1.757 1.00 0.00 C ATOM 1406 CD1 TRP A 96 -5.466 7.838 0.446 1.00 0.00 C ATOM 1407 CD2 TRP A 96 -6.680 7.019 2.126 1.00 0.00 C ATOM 1408 NE1 TRP A 96 -6.741 7.653 -0.019 1.00 0.00 N ATOM 1409 CE2 TRP A 96 -7.506 7.145 0.989 1.00 0.00 C ATOM 1410 CE3 TRP A 96 -7.229 6.516 3.304 1.00 0.00 C ATOM 1411 CZ2 TRP A 96 -8.848 6.790 1.002 1.00 0.00 C ATOM 1412 CZ3 TRP A 96 -8.559 6.161 3.314 1.00 0.00 C ATOM 1413 CH2 TRP A 96 -9.357 6.299 2.172 1.00 0.00 C ATOM 0 H TRP A 96 -2.749 9.466 1.316 1.00 0.00 H new ATOM 0 HA TRP A 96 -4.571 9.394 3.638 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -3.320 7.088 2.097 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.328 6.941 3.523 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -4.644 8.214 -0.145 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -7.065 7.861 -0.964 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.623 6.407 4.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -9.466 6.897 0.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -8.995 5.768 4.221 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -10.397 6.011 2.216 1.00 0.00 H new ATOM 1424 N ILE A 97 -2.702 9.063 5.188 1.00 0.00 N ATOM 1425 CA ILE A 97 -1.589 8.977 6.092 1.00 0.00 C ATOM 1426 C ILE A 97 -1.571 7.606 6.732 1.00 0.00 C ATOM 1427 O ILE A 97 -2.613 7.101 7.168 1.00 0.00 O ATOM 1428 CB ILE A 97 -1.587 10.087 7.187 1.00 0.00 C ATOM 1429 CG1 ILE A 97 -2.852 10.023 8.058 1.00 0.00 C ATOM 1430 CG2 ILE A 97 -1.454 11.461 6.534 1.00 0.00 C ATOM 1431 CD1 ILE A 97 -2.823 10.930 9.272 1.00 0.00 C ATOM 0 H ILE A 97 -3.604 9.239 5.630 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.685 9.136 5.504 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.731 9.917 7.841 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -3.714 10.285 7.445 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.998 8.995 8.391 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.453 12.232 7.305 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.521 11.508 5.973 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -2.293 11.625 5.858 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.753 10.822 9.829 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -1.983 10.656 9.911 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -2.711 11.965 8.950 1.00 0.00 H new ATOM 1443 N GLY A 98 -0.422 7.001 6.738 1.00 0.00 N ATOM 1444 CA GLY A 98 -0.266 5.702 7.302 1.00 0.00 C ATOM 1445 C GLY A 98 0.407 5.769 8.639 1.00 0.00 C ATOM 1446 O GLY A 98 1.498 6.358 8.777 1.00 0.00 O ATOM 0 H GLY A 98 0.434 7.398 6.350 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.242 5.228 7.407 1.00 0.00 H new ATOM 0 HA3 GLY A 98 0.320 5.078 6.628 1.00 0.00 H new ATOM 1450 N TYR A 99 -0.237 5.215 9.619 1.00 0.00 N ATOM 1451 CA TYR A 99 0.279 5.167 10.958 1.00 0.00 C ATOM 1452 C TYR A 99 0.010 3.794 11.531 1.00 0.00 C ATOM 1453 O TYR A 99 -0.778 3.033 10.967 1.00 0.00 O ATOM 1454 CB TYR A 99 -0.337 6.285 11.837 1.00 0.00 C ATOM 1455 CG TYR A 99 -1.858 6.283 11.958 1.00 0.00 C ATOM 1456 CD1 TYR A 99 -2.657 6.921 11.012 1.00 0.00 C ATOM 1457 CD2 TYR A 99 -2.489 5.673 13.038 1.00 0.00 C ATOM 1458 CE1 TYR A 99 -4.032 6.947 11.139 1.00 0.00 C ATOM 1459 CE2 TYR A 99 -3.863 5.692 13.167 1.00 0.00 C ATOM 1460 CZ TYR A 99 -4.629 6.331 12.217 1.00 0.00 C ATOM 1461 OH TYR A 99 -6.005 6.358 12.353 1.00 0.00 O ATOM 0 H TYR A 99 -1.151 4.775 9.513 1.00 0.00 H new ATOM 0 HA TYR A 99 1.355 5.343 10.942 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.087 6.207 12.838 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.026 7.249 11.434 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.193 7.404 10.164 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.893 5.176 13.789 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.636 7.448 10.397 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.335 5.208 14.009 1.00 0.00 H new ATOM 0 HH TYR A 99 -6.263 5.876 13.167 1.00 0.00 H new ATOM 1471 N ASN A 100 0.656 3.455 12.603 1.00 0.00 N ATOM 1472 CA ASN A 100 0.461 2.152 13.202 1.00 0.00 C ATOM 1473 C ASN A 100 -0.108 2.287 14.598 1.00 0.00 C ATOM 1474 O ASN A 100 0.276 3.186 15.359 1.00 0.00 O ATOM 1475 CB ASN A 100 1.760 1.298 13.191 1.00 0.00 C ATOM 1476 CG ASN A 100 2.935 1.875 13.995 1.00 0.00 C ATOM 1477 OD1 ASN A 100 3.082 3.090 14.154 1.00 0.00 O ATOM 1478 ND2 ASN A 100 3.796 1.009 14.469 1.00 0.00 N ATOM 0 H ASN A 100 1.324 4.054 13.088 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.264 1.615 12.590 1.00 0.00 H new ATOM 0 HB2 ASN A 100 1.527 0.307 13.581 1.00 0.00 H new ATOM 0 HB3 ASN A 100 2.079 1.166 12.157 1.00 0.00 H new ATOM 0 HD21 ASN A 100 4.614 1.333 14.985 1.00 0.00 H new ATOM 0 HD22 ASN A 100 3.648 0.010 14.322 1.00 0.00 H new ATOM 1485 N ALA A 101 -1.063 1.448 14.913 1.00 0.00 N ATOM 1486 CA ALA A 101 -1.677 1.445 16.225 1.00 0.00 C ATOM 1487 C ALA A 101 -0.922 0.478 17.121 1.00 0.00 C ATOM 1488 O ALA A 101 -0.056 -0.250 16.636 1.00 0.00 O ATOM 1489 CB ALA A 101 -3.146 1.055 16.120 1.00 0.00 C ATOM 0 H ALA A 101 -1.438 0.749 14.272 1.00 0.00 H new ATOM 0 HA ALA A 101 -1.628 2.445 16.657 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.595 1.057 17.113 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.668 1.771 15.485 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.228 0.058 15.687 1.00 0.00 H new ATOM 1495 N TYR A 102 -1.275 0.420 18.406 1.00 0.00 N ATOM 1496 CA TYR A 102 -0.569 -0.456 19.367 1.00 0.00 C ATOM 1497 C TYR A 102 -0.788 -1.943 19.062 1.00 0.00 C ATOM 1498 O TYR A 102 -0.115 -2.814 19.613 1.00 0.00 O ATOM 1499 CB TYR A 102 -0.952 -0.140 20.832 1.00 0.00 C ATOM 1500 CG TYR A 102 -2.392 -0.454 21.226 1.00 0.00 C ATOM 1501 CD1 TYR A 102 -2.739 -1.716 21.695 1.00 0.00 C ATOM 1502 CD2 TYR A 102 -3.389 0.507 21.148 1.00 0.00 C ATOM 1503 CE1 TYR A 102 -4.028 -2.008 22.069 1.00 0.00 C ATOM 1504 CE2 TYR A 102 -4.689 0.218 21.522 1.00 0.00 C ATOM 1505 CZ TYR A 102 -4.999 -1.042 21.981 1.00 0.00 C ATOM 1506 OH TYR A 102 -6.291 -1.338 22.361 1.00 0.00 O ATOM 0 H TYR A 102 -2.038 0.961 18.812 1.00 0.00 H new ATOM 0 HA TYR A 102 0.493 -0.244 19.246 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -0.286 -0.698 21.490 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -0.768 0.919 21.015 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.980 -2.481 21.767 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -3.147 1.497 20.790 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -4.277 -2.995 22.431 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -5.455 0.976 21.454 1.00 0.00 H new ATOM 0 HH TYR A 102 -6.857 -0.547 22.239 1.00 0.00 H new ATOM 1516 N ASN A 103 -1.735 -2.224 18.187 1.00 0.00 N ATOM 1517 CA ASN A 103 -2.022 -3.587 17.777 1.00 0.00 C ATOM 1518 C ASN A 103 -1.005 -4.012 16.704 1.00 0.00 C ATOM 1519 O ASN A 103 -0.870 -5.189 16.373 1.00 0.00 O ATOM 1520 CB ASN A 103 -3.465 -3.687 17.238 1.00 0.00 C ATOM 1521 CG ASN A 103 -3.897 -5.113 16.906 1.00 0.00 C ATOM 1522 OD1 ASN A 103 -3.466 -6.080 17.545 1.00 0.00 O ATOM 1523 ND2 ASN A 103 -4.755 -5.257 15.926 1.00 0.00 N ATOM 0 H ASN A 103 -2.324 -1.520 17.743 1.00 0.00 H new ATOM 0 HA ASN A 103 -1.937 -4.256 18.633 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -4.150 -3.272 17.978 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -3.553 -3.072 16.342 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -5.086 -6.187 15.671 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -5.091 -4.439 15.418 1.00 0.00 H new ATOM 1530 N GLY A 104 -0.273 -3.037 16.180 1.00 0.00 N ATOM 1531 CA GLY A 104 0.732 -3.307 15.168 1.00 0.00 C ATOM 1532 C GLY A 104 0.154 -3.282 13.779 1.00 0.00 C ATOM 1533 O GLY A 104 0.812 -3.644 12.808 1.00 0.00 O ATOM 0 H GLY A 104 -0.359 -2.055 16.441 1.00 0.00 H new ATOM 0 HA2 GLY A 104 1.529 -2.567 15.242 1.00 0.00 H new ATOM 0 HA3 GLY A 104 1.183 -4.282 15.356 1.00 0.00 H new ATOM 1537 N ASN A 105 -1.069 -2.851 13.689 1.00 0.00 N ATOM 1538 CA ASN A 105 -1.773 -2.778 12.435 1.00 0.00 C ATOM 1539 C ASN A 105 -1.585 -1.413 11.810 1.00 0.00 C ATOM 1540 O ASN A 105 -1.444 -0.396 12.515 1.00 0.00 O ATOM 1541 CB ASN A 105 -3.273 -3.131 12.596 1.00 0.00 C ATOM 1542 CG ASN A 105 -4.017 -2.271 13.618 1.00 0.00 C ATOM 1543 OD1 ASN A 105 -3.440 -1.788 14.594 1.00 0.00 O ATOM 1544 ND2 ASN A 105 -5.300 -2.119 13.433 1.00 0.00 N ATOM 0 H ASN A 105 -1.615 -2.536 14.491 1.00 0.00 H new ATOM 0 HA ASN A 105 -1.348 -3.524 11.763 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.764 -3.030 11.628 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -3.358 -4.177 12.889 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -5.853 -1.588 14.106 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -5.750 -2.531 12.615 1.00 0.00 H new ATOM 1551 N ARG A 106 -1.564 -1.391 10.504 1.00 0.00 N ATOM 1552 CA ARG A 106 -1.300 -0.196 9.746 1.00 0.00 C ATOM 1553 C ARG A 106 -2.629 0.444 9.376 1.00 0.00 C ATOM 1554 O ARG A 106 -3.425 -0.142 8.647 1.00 0.00 O ATOM 1555 CB ARG A 106 -0.516 -0.586 8.489 1.00 0.00 C ATOM 1556 CG ARG A 106 0.182 0.549 7.758 1.00 0.00 C ATOM 1557 CD ARG A 106 1.230 1.210 8.643 1.00 0.00 C ATOM 1558 NE ARG A 106 2.224 1.949 7.859 1.00 0.00 N ATOM 1559 CZ ARG A 106 3.153 2.773 8.358 1.00 0.00 C ATOM 1560 NH1 ARG A 106 3.126 3.128 9.638 1.00 0.00 N ATOM 1561 NH2 ARG A 106 4.101 3.250 7.570 1.00 0.00 N ATOM 0 H ARG A 106 -1.732 -2.215 9.927 1.00 0.00 H new ATOM 0 HA ARG A 106 -0.713 0.518 10.324 1.00 0.00 H new ATOM 0 HB2 ARG A 106 0.233 -1.327 8.768 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.201 -1.072 7.794 1.00 0.00 H new ATOM 0 HG2 ARG A 106 0.655 0.166 6.853 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.553 1.290 7.445 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.740 1.890 9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.732 0.449 9.240 1.00 0.00 H new ATOM 0 HE ARG A 106 2.206 1.825 6.847 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.392 2.772 10.251 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.839 3.757 10.008 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.123 2.990 6.584 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.810 3.878 7.948 1.00 0.00 H new ATOM 1575 N VAL A 107 -2.873 1.611 9.888 1.00 0.00 N ATOM 1576 CA VAL A 107 -4.123 2.291 9.672 1.00 0.00 C ATOM 1577 C VAL A 107 -3.884 3.524 8.791 1.00 0.00 C ATOM 1578 O VAL A 107 -2.862 4.210 8.939 1.00 0.00 O ATOM 1579 CB VAL A 107 -4.769 2.710 11.027 1.00 0.00 C ATOM 1580 CG1 VAL A 107 -6.158 3.271 10.819 1.00 0.00 C ATOM 1581 CG2 VAL A 107 -4.811 1.539 12.006 1.00 0.00 C ATOM 0 H VAL A 107 -2.212 2.125 10.470 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.812 1.613 9.169 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.144 3.492 11.457 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.584 3.555 11.781 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -6.103 4.148 10.174 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -6.789 2.515 10.352 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.267 1.863 12.942 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.399 0.727 11.578 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.797 1.189 12.199 1.00 0.00 H new ATOM 1591 N TYR A 108 -4.795 3.768 7.874 1.00 0.00 N ATOM 1592 CA TYR A 108 -4.715 4.867 6.938 1.00 0.00 C ATOM 1593 C TYR A 108 -5.889 5.820 7.116 1.00 0.00 C ATOM 1594 O TYR A 108 -7.048 5.391 7.194 1.00 0.00 O ATOM 1595 CB TYR A 108 -4.703 4.346 5.495 1.00 0.00 C ATOM 1596 CG TYR A 108 -3.456 3.585 5.113 1.00 0.00 C ATOM 1597 CD1 TYR A 108 -3.354 2.209 5.300 1.00 0.00 C ATOM 1598 CD2 TYR A 108 -2.382 4.247 4.555 1.00 0.00 C ATOM 1599 CE1 TYR A 108 -2.207 1.527 4.938 1.00 0.00 C ATOM 1600 CE2 TYR A 108 -1.238 3.577 4.193 1.00 0.00 C ATOM 1601 CZ TYR A 108 -1.151 2.224 4.384 1.00 0.00 C ATOM 1602 OH TYR A 108 -0.008 1.560 4.009 1.00 0.00 O ATOM 0 H TYR A 108 -5.630 3.195 7.756 1.00 0.00 H new ATOM 0 HA TYR A 108 -3.788 5.404 7.138 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -5.567 3.698 5.349 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -4.820 5.191 4.816 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -4.182 1.667 5.733 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.441 5.314 4.399 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -2.137 0.460 5.087 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -0.409 4.117 3.759 1.00 0.00 H new ATOM 0 HH TYR A 108 0.754 2.176 4.041 1.00 0.00 H new ATOM 1612 N CYS A 109 -5.593 7.093 7.177 1.00 0.00 N ATOM 1613 CA CYS A 109 -6.612 8.118 7.310 1.00 0.00 C ATOM 1614 C CYS A 109 -6.675 8.938 6.017 1.00 0.00 C ATOM 1615 O CYS A 109 -5.633 9.350 5.508 1.00 0.00 O ATOM 1616 CB CYS A 109 -6.311 9.016 8.525 1.00 0.00 C ATOM 1617 SG CYS A 109 -7.550 10.292 8.860 1.00 0.00 S ATOM 0 H CYS A 109 -4.640 7.455 7.136 1.00 0.00 H new ATOM 0 HA CYS A 109 -7.583 7.651 7.476 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -6.213 8.385 9.408 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -5.346 9.499 8.370 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.192 10.981 9.902 1.00 0.00 H new ATOM 1623 N PRO A 110 -7.903 9.168 5.461 1.00 0.00 N ATOM 1624 CA PRO A 110 -8.094 9.883 4.178 1.00 0.00 C ATOM 1625 C PRO A 110 -7.801 11.385 4.231 1.00 0.00 C ATOM 1626 O PRO A 110 -7.755 12.012 3.190 1.00 0.00 O ATOM 1627 CB PRO A 110 -9.572 9.653 3.849 1.00 0.00 C ATOM 1628 CG PRO A 110 -10.222 9.397 5.163 1.00 0.00 C ATOM 1629 CD PRO A 110 -9.191 8.712 6.025 1.00 0.00 C ATOM 0 HA PRO A 110 -7.394 9.505 3.433 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -10.007 10.522 3.356 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -9.699 8.807 3.174 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -10.552 10.330 5.621 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -11.106 8.770 5.043 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -9.292 8.996 7.072 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -9.287 7.627 5.978 1.00 0.00 H new ATOM 1637 N VAL A 111 -7.693 11.927 5.462 1.00 0.00 N ATOM 1638 CA VAL A 111 -7.317 13.344 5.816 1.00 0.00 C ATOM 1639 C VAL A 111 -7.859 14.521 4.930 1.00 0.00 C ATOM 1640 O VAL A 111 -8.547 15.410 5.443 1.00 0.00 O ATOM 1641 CB VAL A 111 -5.804 13.518 6.148 1.00 0.00 C ATOM 1642 CG1 VAL A 111 -5.437 12.699 7.360 1.00 0.00 C ATOM 1643 CG2 VAL A 111 -4.911 13.139 4.984 1.00 0.00 C ATOM 0 H VAL A 111 -7.873 11.368 6.296 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.902 13.465 6.728 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.643 14.576 6.356 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.378 12.830 7.580 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -6.029 13.028 8.214 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -5.639 11.646 7.163 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.867 13.278 5.266 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -5.080 12.095 4.721 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.142 13.771 4.127 1.00 0.00 H new ATOM 1653 N ARG A 112 -7.529 14.544 3.649 1.00 0.00 N ATOM 1654 CA ARG A 112 -7.959 15.594 2.741 1.00 0.00 C ATOM 1655 C ARG A 112 -7.971 15.066 1.315 1.00 0.00 C ATOM 1656 O ARG A 112 -7.286 14.073 0.997 1.00 0.00 O ATOM 1657 CB ARG A 112 -7.035 16.828 2.810 1.00 0.00 C ATOM 1658 CG ARG A 112 -5.609 16.578 2.355 1.00 0.00 C ATOM 1659 CD ARG A 112 -4.770 17.841 2.409 1.00 0.00 C ATOM 1660 NE ARG A 112 -3.362 17.577 2.058 1.00 0.00 N ATOM 1661 CZ ARG A 112 -2.348 18.453 2.250 1.00 0.00 C ATOM 1662 NH1 ARG A 112 -2.594 19.667 2.724 1.00 0.00 N ATOM 1663 NH2 ARG A 112 -1.086 18.102 1.970 1.00 0.00 N ATOM 0 H ARG A 112 -6.951 13.829 3.207 1.00 0.00 H new ATOM 0 HA ARG A 112 -8.961 15.899 3.044 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -7.464 17.621 2.197 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -7.016 17.194 3.837 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.155 15.813 2.985 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.615 16.189 1.337 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -5.183 18.582 1.724 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -4.821 18.269 3.410 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.137 16.673 1.642 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -3.550 19.944 2.945 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.827 20.324 2.867 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.884 17.169 1.610 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.327 18.767 2.117 1.00 0.00 H new ATOM 1677 N THR A 113 -8.754 15.695 0.474 1.00 0.00 N ATOM 1678 CA THR A 113 -8.785 15.380 -0.932 1.00 0.00 C ATOM 1679 C THR A 113 -7.423 15.710 -1.556 1.00 0.00 C ATOM 1680 O THR A 113 -6.813 16.740 -1.216 1.00 0.00 O ATOM 1681 CB THR A 113 -9.878 16.212 -1.623 1.00 0.00 C ATOM 1682 OG1 THR A 113 -11.109 16.060 -0.906 1.00 0.00 O ATOM 1683 CG2 THR A 113 -10.077 15.766 -3.068 1.00 0.00 C ATOM 0 H THR A 113 -9.391 16.444 0.747 1.00 0.00 H new ATOM 0 HA THR A 113 -9.001 14.320 -1.062 1.00 0.00 H new ATOM 0 HB THR A 113 -9.568 17.257 -1.626 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.809 16.590 -1.342 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.856 16.372 -3.532 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.145 15.890 -3.619 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.373 14.717 -3.088 1.00 0.00 H new ATOM 1691 N CYS A 114 -6.934 14.824 -2.398 1.00 0.00 N ATOM 1692 CA CYS A 114 -5.701 15.014 -3.119 1.00 0.00 C ATOM 1693 C CYS A 114 -5.748 14.310 -4.442 1.00 0.00 C ATOM 1694 O CYS A 114 -6.094 13.126 -4.537 1.00 0.00 O ATOM 1695 CB CYS A 114 -4.452 14.622 -2.317 1.00 0.00 C ATOM 1696 SG CYS A 114 -4.039 15.787 -0.996 1.00 0.00 S ATOM 0 H CYS A 114 -7.394 13.937 -2.602 1.00 0.00 H new ATOM 0 HA CYS A 114 -5.609 16.086 -3.295 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -4.605 13.634 -1.883 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -3.604 14.543 -2.998 1.00 0.00 H new ATOM 0 HG CYS A 114 -5.086 16.500 -0.703 1.00 0.00 H new ATOM 1702 N GLN A 115 -5.441 15.056 -5.444 1.00 0.00 N ATOM 1703 CA GLN A 115 -5.432 14.613 -6.796 1.00 0.00 C ATOM 1704 C GLN A 115 -4.031 14.789 -7.310 1.00 0.00 C ATOM 1705 O GLN A 115 -3.249 15.500 -6.697 1.00 0.00 O ATOM 1706 CB GLN A 115 -6.383 15.478 -7.615 1.00 0.00 C ATOM 1707 CG GLN A 115 -7.822 15.486 -7.119 1.00 0.00 C ATOM 1708 CD GLN A 115 -8.491 14.119 -7.160 1.00 0.00 C ATOM 1709 OE1 GLN A 115 -9.365 13.826 -6.351 1.00 0.00 O ATOM 1710 NE2 GLN A 115 -8.128 13.294 -8.116 1.00 0.00 N ATOM 0 H GLN A 115 -5.177 16.036 -5.340 1.00 0.00 H new ATOM 0 HA GLN A 115 -5.748 13.572 -6.870 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -6.009 16.502 -7.619 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -6.371 15.130 -8.648 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -7.842 15.860 -6.095 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.402 16.183 -7.724 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -7.398 13.566 -8.774 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -8.576 12.382 -8.200 1.00 0.00 H new ATOM 1719 N GLY A 116 -3.687 14.142 -8.367 1.00 0.00 N ATOM 1720 CA GLY A 116 -2.378 14.344 -8.906 1.00 0.00 C ATOM 1721 C GLY A 116 -1.566 13.094 -8.902 1.00 0.00 C ATOM 1722 O GLY A 116 -2.103 12.000 -8.698 1.00 0.00 O ATOM 0 H GLY A 116 -4.276 13.480 -8.872 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -2.461 14.717 -9.927 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -1.863 15.111 -8.327 1.00 0.00 H new ATOM 1726 N VAL A 117 -0.290 13.250 -9.130 1.00 0.00 N ATOM 1727 CA VAL A 117 0.650 12.157 -9.162 1.00 0.00 C ATOM 1728 C VAL A 117 1.933 12.622 -8.498 1.00 0.00 C ATOM 1729 O VAL A 117 2.245 13.817 -8.552 1.00 0.00 O ATOM 1730 CB VAL A 117 0.964 11.638 -10.621 1.00 0.00 C ATOM 1731 CG1 VAL A 117 -0.255 10.993 -11.266 1.00 0.00 C ATOM 1732 CG2 VAL A 117 1.501 12.753 -11.514 1.00 0.00 C ATOM 0 H VAL A 117 0.137 14.160 -9.303 1.00 0.00 H new ATOM 0 HA VAL A 117 0.202 11.316 -8.632 1.00 0.00 H new ATOM 0 HB VAL A 117 1.739 10.878 -10.519 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.002 10.649 -12.268 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -0.579 10.144 -10.664 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.062 11.723 -11.329 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.705 12.356 -12.509 1.00 0.00 H new ATOM 0 HG22 VAL A 117 0.761 13.550 -11.586 1.00 0.00 H new ATOM 0 HG23 VAL A 117 2.422 13.150 -11.086 1.00 0.00 H new ATOM 1742 N PRO A 118 2.655 11.719 -7.824 1.00 0.00 N ATOM 1743 CA PRO A 118 3.924 12.038 -7.158 1.00 0.00 C ATOM 1744 C PRO A 118 4.901 12.817 -8.063 1.00 0.00 C ATOM 1745 O PRO A 118 5.063 12.485 -9.242 1.00 0.00 O ATOM 1746 CB PRO A 118 4.494 10.665 -6.855 1.00 0.00 C ATOM 1747 CG PRO A 118 3.303 9.824 -6.642 1.00 0.00 C ATOM 1748 CD PRO A 118 2.287 10.301 -7.629 1.00 0.00 C ATOM 0 HA PRO A 118 3.774 12.677 -6.288 1.00 0.00 H new ATOM 0 HB2 PRO A 118 5.102 10.294 -7.680 1.00 0.00 H new ATOM 0 HB3 PRO A 118 5.133 10.684 -5.972 1.00 0.00 H new ATOM 0 HG2 PRO A 118 3.535 8.770 -6.798 1.00 0.00 H new ATOM 0 HG3 PRO A 118 2.933 9.921 -5.621 1.00 0.00 H new ATOM 0 HD2 PRO A 118 2.335 9.739 -8.562 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.272 10.196 -7.246 1.00 0.00 H new ATOM 1756 N PRO A 119 5.556 13.865 -7.533 1.00 0.00 N ATOM 1757 CA PRO A 119 5.386 14.316 -6.154 1.00 0.00 C ATOM 1758 C PRO A 119 4.246 15.344 -5.987 1.00 0.00 C ATOM 1759 O PRO A 119 3.705 15.516 -4.879 1.00 0.00 O ATOM 1760 CB PRO A 119 6.743 14.987 -5.837 1.00 0.00 C ATOM 1761 CG PRO A 119 7.531 14.984 -7.124 1.00 0.00 C ATOM 1762 CD PRO A 119 6.567 14.656 -8.225 1.00 0.00 C ATOM 0 HA PRO A 119 5.119 13.490 -5.495 1.00 0.00 H new ATOM 0 HB2 PRO A 119 6.598 16.004 -5.473 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.273 14.442 -5.056 1.00 0.00 H new ATOM 0 HG2 PRO A 119 7.996 15.955 -7.294 1.00 0.00 H new ATOM 0 HG3 PRO A 119 8.335 14.249 -7.083 1.00 0.00 H new ATOM 0 HD2 PRO A 119 6.143 15.554 -8.674 1.00 0.00 H new ATOM 0 HD3 PRO A 119 7.044 14.093 -9.028 1.00 0.00 H new ATOM 1770 N ASN A 120 3.856 15.980 -7.084 1.00 0.00 N ATOM 1771 CA ASN A 120 2.898 17.083 -7.031 1.00 0.00 C ATOM 1772 C ASN A 120 1.473 16.615 -6.854 1.00 0.00 C ATOM 1773 O ASN A 120 0.814 16.126 -7.789 1.00 0.00 O ATOM 1774 CB ASN A 120 3.012 18.007 -8.244 1.00 0.00 C ATOM 1775 CG ASN A 120 4.341 18.740 -8.317 1.00 0.00 C ATOM 1776 OD1 ASN A 120 4.967 19.049 -7.293 1.00 0.00 O ATOM 1777 ND2 ASN A 120 4.785 19.011 -9.513 1.00 0.00 N ATOM 0 H ASN A 120 4.186 15.753 -8.022 1.00 0.00 H new ATOM 0 HA ASN A 120 3.164 17.656 -6.143 1.00 0.00 H new ATOM 0 HB2 ASN A 120 2.878 17.421 -9.153 1.00 0.00 H new ATOM 0 HB3 ASN A 120 2.203 18.737 -8.213 1.00 0.00 H new ATOM 0 HD21 ASN A 120 5.676 19.493 -9.629 1.00 0.00 H new ATOM 0 HD22 ASN A 120 4.241 18.741 -10.332 1.00 0.00 H new ATOM 1784 N HIS A 121 1.026 16.744 -5.646 1.00 0.00 N ATOM 1785 CA HIS A 121 -0.310 16.406 -5.245 1.00 0.00 C ATOM 1786 C HIS A 121 -1.128 17.674 -5.051 1.00 0.00 C ATOM 1787 O HIS A 121 -0.687 18.611 -4.385 1.00 0.00 O ATOM 1788 CB HIS A 121 -0.303 15.515 -3.979 1.00 0.00 C ATOM 1789 CG HIS A 121 0.461 16.076 -2.806 1.00 0.00 C ATOM 1790 ND1 HIS A 121 1.813 15.860 -2.611 1.00 0.00 N ATOM 1791 CD2 HIS A 121 0.057 16.851 -1.776 1.00 0.00 C ATOM 1792 CE1 HIS A 121 2.193 16.476 -1.513 1.00 0.00 C ATOM 1793 NE2 HIS A 121 1.151 17.090 -0.987 1.00 0.00 N ATOM 0 H HIS A 121 1.599 17.100 -4.881 1.00 0.00 H new ATOM 0 HA HIS A 121 -0.782 15.821 -6.035 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -1.334 15.340 -3.671 1.00 0.00 H new ATOM 0 HB3 HIS A 121 0.121 14.545 -4.239 1.00 0.00 H new ATOM 0 HD1 HIS A 121 2.418 15.311 -3.221 1.00 0.00 H new ATOM 0 HD2 HIS A 121 -0.945 17.216 -1.606 1.00 0.00 H new ATOM 0 HE1 HIS A 121 3.194 16.479 -1.108 1.00 0.00 H new ATOM 1802 N ILE A 122 -2.278 17.691 -5.627 1.00 0.00 N ATOM 1803 CA ILE A 122 -3.185 18.812 -5.582 1.00 0.00 C ATOM 1804 C ILE A 122 -4.205 18.563 -4.467 1.00 0.00 C ATOM 1805 O ILE A 122 -5.034 17.660 -4.590 1.00 0.00 O ATOM 1806 CB ILE A 122 -3.950 18.912 -6.927 1.00 0.00 C ATOM 1807 CG1 ILE A 122 -2.961 18.934 -8.103 1.00 0.00 C ATOM 1808 CG2 ILE A 122 -4.839 20.153 -6.946 1.00 0.00 C ATOM 1809 CD1 ILE A 122 -3.618 18.872 -9.467 1.00 0.00 C ATOM 0 H ILE A 122 -2.637 16.902 -6.165 1.00 0.00 H new ATOM 0 HA ILE A 122 -2.628 19.731 -5.403 1.00 0.00 H new ATOM 0 HB ILE A 122 -4.588 18.034 -7.030 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -2.361 19.842 -8.042 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -2.276 18.092 -8.003 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -5.368 20.207 -7.897 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.561 20.096 -6.132 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -4.223 21.044 -6.822 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -2.851 18.892 -10.241 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -4.195 17.951 -9.551 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -4.281 19.728 -9.591 1.00 0.00 H new ATOM 1821 N PRO A 123 -4.131 19.295 -3.352 1.00 0.00 N ATOM 1822 CA PRO A 123 -5.060 19.132 -2.245 1.00 0.00 C ATOM 1823 C PRO A 123 -6.403 19.816 -2.502 1.00 0.00 C ATOM 1824 O PRO A 123 -6.520 20.675 -3.391 1.00 0.00 O ATOM 1825 CB PRO A 123 -4.347 19.801 -1.053 1.00 0.00 C ATOM 1826 CG PRO A 123 -3.006 20.219 -1.566 1.00 0.00 C ATOM 1827 CD PRO A 123 -3.139 20.327 -3.056 1.00 0.00 C ATOM 0 HA PRO A 123 -5.296 18.081 -2.080 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -4.912 20.659 -0.690 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -4.248 19.108 -0.217 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -2.704 21.173 -1.133 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -2.242 19.490 -1.296 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -3.476 21.317 -3.364 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -2.193 20.140 -3.564 1.00 0.00 H new ATOM 1835 N GLY A 124 -7.399 19.404 -1.748 1.00 0.00 N ATOM 1836 CA GLY A 124 -8.713 19.982 -1.814 1.00 0.00 C ATOM 1837 C GLY A 124 -9.256 20.237 -0.424 1.00 0.00 C ATOM 1838 O GLY A 124 -8.596 20.885 0.388 1.00 0.00 O ATOM 0 H GLY A 124 -7.313 18.650 -1.066 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -8.677 20.917 -2.373 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -9.383 19.313 -2.355 1.00 0.00 H new ATOM 1842 N VAL A 125 -10.419 19.692 -0.128 1.00 0.00 N ATOM 1843 CA VAL A 125 -11.050 19.878 1.173 1.00 0.00 C ATOM 1844 C VAL A 125 -10.386 18.988 2.233 1.00 0.00 C ATOM 1845 O VAL A 125 -10.240 17.774 2.037 1.00 0.00 O ATOM 1846 CB VAL A 125 -12.574 19.577 1.112 1.00 0.00 C ATOM 1847 CG1 VAL A 125 -13.236 19.778 2.471 1.00 0.00 C ATOM 1848 CG2 VAL A 125 -13.248 20.455 0.073 1.00 0.00 C ATOM 0 H VAL A 125 -10.954 19.111 -0.774 1.00 0.00 H new ATOM 0 HA VAL A 125 -10.917 20.923 1.453 1.00 0.00 H new ATOM 0 HB VAL A 125 -12.692 18.531 0.827 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -14.301 19.559 2.393 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -12.780 19.108 3.200 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -13.100 20.811 2.793 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -14.314 20.231 0.044 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -13.105 21.503 0.334 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -12.810 20.262 -0.906 1.00 0.00 H new ATOM 1858 N ALA A 126 -9.918 19.613 3.293 1.00 0.00 N ATOM 1859 CA ALA A 126 -9.334 18.915 4.416 1.00 0.00 C ATOM 1860 C ALA A 126 -10.384 18.676 5.490 1.00 0.00 C ATOM 1861 O ALA A 126 -11.365 19.437 5.598 1.00 0.00 O ATOM 1862 CB ALA A 126 -8.149 19.683 4.978 1.00 0.00 C ATOM 0 H ALA A 126 -9.933 20.627 3.399 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.968 17.949 4.068 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -7.728 19.136 5.822 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.390 19.797 4.204 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.478 20.667 5.311 1.00 0.00 H new ATOM 1868 N TRP A 127 -10.213 17.618 6.251 1.00 0.00 N ATOM 1869 CA TRP A 127 -11.128 17.295 7.335 1.00 0.00 C ATOM 1870 C TRP A 127 -10.381 17.147 8.650 1.00 0.00 C ATOM 1871 O TRP A 127 -10.820 16.434 9.539 1.00 0.00 O ATOM 1872 CB TRP A 127 -11.888 16.009 7.010 1.00 0.00 C ATOM 1873 CG TRP A 127 -12.680 16.120 5.759 1.00 0.00 C ATOM 1874 CD1 TRP A 127 -13.805 16.851 5.578 1.00 0.00 C ATOM 1875 CD2 TRP A 127 -12.406 15.486 4.516 1.00 0.00 C ATOM 1876 NE1 TRP A 127 -14.241 16.730 4.288 1.00 0.00 N ATOM 1877 CE2 TRP A 127 -13.397 15.896 3.613 1.00 0.00 C ATOM 1878 CE3 TRP A 127 -11.410 14.622 4.078 1.00 0.00 C ATOM 1879 CZ2 TRP A 127 -13.423 15.467 2.299 1.00 0.00 C ATOM 1880 CZ3 TRP A 127 -11.438 14.193 2.778 1.00 0.00 C ATOM 1881 CH2 TRP A 127 -12.436 14.618 1.899 1.00 0.00 C ATOM 0 H TRP A 127 -9.443 16.958 6.141 1.00 0.00 H new ATOM 0 HA TRP A 127 -11.840 18.114 7.440 1.00 0.00 H new ATOM 0 HB2 TRP A 127 -11.180 15.186 6.917 1.00 0.00 H new ATOM 0 HB3 TRP A 127 -12.554 15.765 7.838 1.00 0.00 H new ATOM 0 HD1 TRP A 127 -14.288 17.443 6.341 1.00 0.00 H new ATOM 0 HE1 TRP A 127 -15.063 17.188 3.894 1.00 0.00 H new ATOM 0 HE3 TRP A 127 -10.630 14.295 4.749 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 -14.195 15.792 1.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 -10.675 13.514 2.427 1.00 0.00 H new ATOM 0 HH2 TRP A 127 -12.425 14.265 0.878 1.00 0.00 H new ATOM 1892 N GLY A 128 -9.291 17.862 8.780 1.00 0.00 N ATOM 1893 CA GLY A 128 -8.498 17.795 9.973 1.00 0.00 C ATOM 1894 C GLY A 128 -7.464 18.879 9.985 1.00 0.00 C ATOM 1895 O GLY A 128 -7.469 19.745 9.097 1.00 0.00 O ATOM 0 H GLY A 128 -8.935 18.499 8.068 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -9.141 17.889 10.848 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -8.012 16.822 10.038 1.00 0.00 H new ATOM 1899 N VAL A 129 -6.579 18.849 10.960 1.00 0.00 N ATOM 1900 CA VAL A 129 -5.548 19.852 11.089 1.00 0.00 C ATOM 1901 C VAL A 129 -4.172 19.217 10.881 1.00 0.00 C ATOM 1902 O VAL A 129 -3.746 18.351 11.649 1.00 0.00 O ATOM 1903 CB VAL A 129 -5.595 20.540 12.487 1.00 0.00 C ATOM 1904 CG1 VAL A 129 -4.555 21.651 12.595 1.00 0.00 C ATOM 1905 CG2 VAL A 129 -6.990 21.078 12.783 1.00 0.00 C ATOM 0 H VAL A 129 -6.556 18.129 11.683 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.725 20.611 10.327 1.00 0.00 H new ATOM 0 HB VAL A 129 -5.354 19.784 13.234 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -4.614 22.110 13.582 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -3.559 21.233 12.449 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.748 22.405 11.832 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -6.996 21.553 13.764 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -7.267 21.810 12.024 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -7.706 20.257 12.773 1.00 0.00 H new ATOM 1915 N PHE A 130 -3.504 19.621 9.841 1.00 0.00 N ATOM 1916 CA PHE A 130 -2.176 19.134 9.552 1.00 0.00 C ATOM 1917 C PHE A 130 -1.171 19.927 10.341 1.00 0.00 C ATOM 1918 O PHE A 130 -1.191 21.169 10.325 1.00 0.00 O ATOM 1919 CB PHE A 130 -1.875 19.220 8.056 1.00 0.00 C ATOM 1920 CG PHE A 130 -2.768 18.350 7.234 1.00 0.00 C ATOM 1921 CD1 PHE A 130 -2.422 17.039 6.979 1.00 0.00 C ATOM 1922 CD2 PHE A 130 -3.962 18.835 6.734 1.00 0.00 C ATOM 1923 CE1 PHE A 130 -3.246 16.230 6.237 1.00 0.00 C ATOM 1924 CE2 PHE A 130 -4.790 18.031 5.996 1.00 0.00 C ATOM 1925 CZ PHE A 130 -4.433 16.727 5.746 1.00 0.00 C ATOM 0 H PHE A 130 -3.859 20.298 9.165 1.00 0.00 H new ATOM 0 HA PHE A 130 -2.114 18.085 9.841 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -1.981 20.254 7.728 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -0.837 18.935 7.882 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -1.494 16.646 7.367 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -4.245 19.859 6.927 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -2.964 15.206 6.039 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -5.721 18.421 5.611 1.00 0.00 H new ATOM 0 HZ PHE A 130 -5.084 16.092 5.164 1.00 0.00 H new ATOM 1935 N LYS A 131 -0.300 19.243 11.013 1.00 0.00 N ATOM 1936 CA LYS A 131 0.651 19.869 11.863 1.00 0.00 C ATOM 1937 C LYS A 131 2.042 19.411 11.427 1.00 0.00 C ATOM 1938 O LYS A 131 2.503 18.352 11.851 1.00 0.00 O ATOM 1939 CB LYS A 131 0.302 19.511 13.333 1.00 0.00 C ATOM 1940 CG LYS A 131 0.945 20.371 14.427 1.00 0.00 C ATOM 1941 CD LYS A 131 2.416 20.083 14.659 1.00 0.00 C ATOM 1942 CE LYS A 131 3.000 21.021 15.712 1.00 0.00 C ATOM 1943 NZ LYS A 131 2.273 20.945 17.004 1.00 0.00 N ATOM 1944 OXT LYS A 131 2.661 20.115 10.603 1.00 0.00 O ATOM 0 H LYS A 131 -0.232 18.226 10.984 1.00 0.00 H new ATOM 0 HA LYS A 131 0.633 20.957 11.792 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -0.780 19.568 13.448 1.00 0.00 H new ATOM 0 HB3 LYS A 131 0.586 18.473 13.506 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.829 21.422 14.162 1.00 0.00 H new ATOM 0 HG3 LYS A 131 0.404 20.216 15.361 1.00 0.00 H new ATOM 0 HD2 LYS A 131 2.541 19.049 14.979 1.00 0.00 H new ATOM 0 HD3 LYS A 131 2.964 20.195 13.723 1.00 0.00 H new ATOM 0 HE2 LYS A 131 4.049 20.773 15.874 1.00 0.00 H new ATOM 0 HE3 LYS A 131 2.968 22.045 15.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 2.828 21.422 17.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 1.348 21.411 16.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 2.133 19.948 17.266 1.00 0.00 H new TER 1958 LYS A 131