USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 972 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 34 TYR OH : rot 79:sc= 0.579 USER MOD Set 1.2: A 53 HIS : no HE2:sc= -0.365 K(o=0.21,f=-3.1) USER MOD Set 2.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 3 SER OG : rot 180:sc= -0.0636 USER MOD Single : A 1 MET N :NH3+ -160:sc= 1.23 (180deg=0.688) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= -0.629 K(o=-0.63,f=-1.1) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -3.6! K(o=-3.6!,f=-0.37) USER MOD Single : A 16 TYR OH : rot 80:sc= -0.212 USER MOD Single : A 17 ASN : amide:sc= -1.85! K(o=-1.8!,f=-0.079) USER MOD Single : A 25 MET CE :methyl -155:sc= -1.01 (180deg=-1.91) USER MOD Single : A 32 CYS SG : rot -140:sc= -0.627! USER MOD Single : A 33 GLN : amide:sc= 0.0398 X(o=0.04,f=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.875 K(o=-0.88,f=-5.9!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.195 K(o=0.2,f=-3.6!) USER MOD Single : A 79 HIS : no HE2:sc= -0.644 K(o=-0.64,f=-3.9!) USER MOD Single : A 81 THR OG1 : rot -95:sc= -1.03 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.244 X(o=0.24,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 77:sc= 0.115 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -1.91! K(o=-1.9!,f=-0.066) USER MOD Single : A 108 LYS NZ :NH3+ -163:sc= 0.276 (180deg=0.177) USER MOD Single : A 112 LYS NZ :NH3+ 163:sc= -0.035 (180deg=-0.296) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 GLN : amide:sc=-0.00562 X(o=-0.0056,f=-0.14) USER MOD Single : A 122 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0976) USER MOD Single : A 123 SER OG : rot 43:sc= 0.133 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.030 0.523 2.319 1.00 0.00 N ATOM 2 CA MET A 1 1.916 -0.922 2.627 1.00 0.00 C ATOM 3 C MET A 1 1.588 -1.710 1.340 1.00 0.00 C ATOM 4 O MET A 1 0.901 -1.201 0.447 1.00 0.00 O ATOM 5 CB MET A 1 0.846 -1.167 3.737 1.00 0.00 C ATOM 6 CG MET A 1 -0.612 -0.895 3.319 1.00 0.00 C ATOM 7 SD MET A 1 -0.892 0.806 2.779 1.00 0.00 S ATOM 8 CE MET A 1 -2.631 0.776 2.348 1.00 0.00 C ATOM 0 H1 MET A 1 2.567 0.997 3.073 1.00 0.00 H new ATOM 0 H2 MET A 1 2.524 0.647 1.412 1.00 0.00 H new ATOM 0 H3 MET A 1 1.080 0.940 2.256 1.00 0.00 H new ATOM 0 HA MET A 1 2.871 -1.280 3.011 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.924 -2.202 4.071 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.084 -0.537 4.594 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.885 -1.575 2.512 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.271 -1.116 4.159 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.936 1.762 1.999 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.797 0.044 1.558 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.219 0.504 3.225 1.00 0.00 H new ATOM 20 N ASN A 2 2.105 -2.943 1.252 1.00 0.00 N ATOM 21 CA ASN A 2 1.901 -3.838 0.095 1.00 0.00 C ATOM 22 C ASN A 2 0.630 -4.697 0.303 1.00 0.00 C ATOM 23 O ASN A 2 0.703 -5.876 0.690 1.00 0.00 O ATOM 24 CB ASN A 2 3.157 -4.723 -0.122 1.00 0.00 C ATOM 25 CG ASN A 2 4.405 -3.936 -0.530 1.00 0.00 C ATOM 26 OD1 ASN A 2 5.156 -3.442 0.317 1.00 0.00 O ATOM 27 ND2 ASN A 2 4.640 -3.829 -1.833 1.00 0.00 N ATOM 0 H ASN A 2 2.682 -3.355 1.986 1.00 0.00 H new ATOM 0 HA ASN A 2 1.755 -3.238 -0.803 1.00 0.00 H new ATOM 0 HB2 ASN A 2 3.368 -5.269 0.797 1.00 0.00 H new ATOM 0 HB3 ASN A 2 2.939 -5.464 -0.891 1.00 0.00 H new ATOM 0 HD21 ASN A 2 5.463 -3.326 -2.163 1.00 0.00 H new ATOM 0 HD22 ASN A 2 3.997 -4.250 -2.503 1.00 0.00 H new ATOM 34 N SER A 3 -0.537 -4.063 0.094 1.00 0.00 N ATOM 35 CA SER A 3 -1.854 -4.684 0.301 1.00 0.00 C ATOM 36 C SER A 3 -2.141 -5.773 -0.746 1.00 0.00 C ATOM 37 O SER A 3 -2.647 -6.837 -0.394 1.00 0.00 O ATOM 38 CB SER A 3 -2.963 -3.607 0.280 1.00 0.00 C ATOM 39 OG SER A 3 -2.778 -2.667 1.327 1.00 0.00 O ATOM 0 H SER A 3 -0.591 -3.096 -0.226 1.00 0.00 H new ATOM 0 HA SER A 3 -1.844 -5.165 1.279 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.957 -3.092 -0.681 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.939 -4.082 0.381 1.00 0.00 H new ATOM 0 HG SER A 3 -3.490 -1.995 1.293 1.00 0.00 H new ATOM 45 N GLU A 4 -1.775 -5.508 -2.025 1.00 0.00 N ATOM 46 CA GLU A 4 -2.005 -6.459 -3.150 1.00 0.00 C ATOM 47 C GLU A 4 -1.153 -7.735 -3.017 1.00 0.00 C ATOM 48 O GLU A 4 -1.350 -8.694 -3.765 1.00 0.00 O ATOM 49 CB GLU A 4 -1.753 -5.808 -4.546 1.00 0.00 C ATOM 50 CG GLU A 4 -0.283 -5.438 -4.870 1.00 0.00 C ATOM 51 CD GLU A 4 0.212 -4.182 -4.141 1.00 0.00 C ATOM 52 OE1 GLU A 4 -0.093 -3.063 -4.603 1.00 0.00 O ATOM 53 OE2 GLU A 4 0.893 -4.304 -3.095 1.00 0.00 O ATOM 0 H GLU A 4 -1.317 -4.641 -2.307 1.00 0.00 H new ATOM 0 HA GLU A 4 -3.058 -6.733 -3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.112 -6.493 -5.314 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -2.358 -4.904 -4.617 1.00 0.00 H new ATOM 0 HG2 GLU A 4 0.360 -6.278 -4.606 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -0.184 -5.286 -5.945 1.00 0.00 H new ATOM 60 N ILE A 5 -0.183 -7.710 -2.093 1.00 0.00 N ATOM 61 CA ILE A 5 0.657 -8.868 -1.767 1.00 0.00 C ATOM 62 C ILE A 5 0.020 -9.671 -0.624 1.00 0.00 C ATOM 63 O ILE A 5 0.124 -10.892 -0.586 1.00 0.00 O ATOM 64 CB ILE A 5 2.105 -8.411 -1.383 1.00 0.00 C ATOM 65 CG1 ILE A 5 2.689 -7.463 -2.478 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.038 -9.620 -1.147 1.00 0.00 C ATOM 67 CD1 ILE A 5 2.720 -8.032 -3.885 1.00 0.00 C ATOM 0 H ILE A 5 0.042 -6.878 -1.547 1.00 0.00 H new ATOM 0 HA ILE A 5 0.729 -9.508 -2.647 1.00 0.00 H new ATOM 0 HB ILE A 5 2.042 -7.859 -0.445 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.102 -6.544 -2.489 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.705 -7.189 -2.193 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.034 -9.265 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE A 5 2.643 -10.231 -0.335 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.096 -10.218 -2.056 1.00 0.00 H new ATOM 0 HD11 ILE A 5 3.143 -7.294 -4.567 1.00 0.00 H new ATOM 0 HD12 ILE A 5 3.333 -8.933 -3.900 1.00 0.00 H new ATOM 0 HD13 ILE A 5 1.706 -8.278 -4.200 1.00 0.00 H new ATOM 79 N GLU A 6 -0.665 -8.972 0.296 1.00 0.00 N ATOM 80 CA GLU A 6 -1.421 -9.627 1.387 1.00 0.00 C ATOM 81 C GLU A 6 -2.789 -10.152 0.914 1.00 0.00 C ATOM 82 O GLU A 6 -3.390 -10.973 1.611 1.00 0.00 O ATOM 83 CB GLU A 6 -1.631 -8.684 2.597 1.00 0.00 C ATOM 84 CG GLU A 6 -0.347 -8.284 3.343 1.00 0.00 C ATOM 85 CD GLU A 6 -0.648 -7.707 4.734 1.00 0.00 C ATOM 86 OE1 GLU A 6 -1.154 -6.569 4.827 1.00 0.00 O ATOM 87 OE2 GLU A 6 -0.452 -8.415 5.740 1.00 0.00 O ATOM 0 H GLU A 6 -0.713 -7.953 0.310 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.810 -10.473 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.128 -7.778 2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.307 -9.168 3.302 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.300 -9.155 3.444 1.00 0.00 H new ATOM 0 HG3 GLU A 6 0.200 -7.547 2.755 1.00 0.00 H new ATOM 94 N LEU A 7 -3.288 -9.667 -0.243 1.00 0.00 N ATOM 95 CA LEU A 7 -4.579 -10.135 -0.805 1.00 0.00 C ATOM 96 C LEU A 7 -4.517 -11.651 -1.156 1.00 0.00 C ATOM 97 O LEU A 7 -5.382 -12.395 -0.690 1.00 0.00 O ATOM 98 CB LEU A 7 -5.046 -9.299 -2.036 1.00 0.00 C ATOM 99 CG LEU A 7 -5.358 -7.793 -1.785 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.777 -7.077 -3.088 1.00 0.00 C ATOM 101 CD2 LEU A 7 -6.416 -7.609 -0.676 1.00 0.00 C ATOM 0 H LEU A 7 -2.822 -8.955 -0.806 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.327 -9.986 -0.026 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.274 -9.363 -2.803 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.941 -9.768 -2.445 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.437 -7.326 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.987 -6.029 -2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -4.969 -7.145 -3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.671 -7.551 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.608 -6.546 -0.529 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.340 -8.107 -0.969 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.048 -8.043 0.254 1.00 0.00 H new ATOM 113 N PRO A 8 -3.491 -12.160 -1.952 1.00 0.00 N ATOM 114 CA PRO A 8 -3.331 -13.613 -2.183 1.00 0.00 C ATOM 115 C PRO A 8 -3.088 -14.379 -0.871 1.00 0.00 C ATOM 116 O PRO A 8 -3.758 -15.366 -0.603 1.00 0.00 O ATOM 117 CB PRO A 8 -2.117 -13.719 -3.158 1.00 0.00 C ATOM 118 CG PRO A 8 -1.389 -12.424 -3.014 1.00 0.00 C ATOM 119 CD PRO A 8 -2.458 -11.397 -2.713 1.00 0.00 C ATOM 0 HA PRO A 8 -4.231 -14.065 -2.600 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.476 -14.562 -2.900 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.448 -13.873 -4.185 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.654 -12.473 -2.211 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.848 -12.173 -3.927 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.061 -10.569 -2.126 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.870 -10.971 -3.628 1.00 0.00 H new ATOM 127 N VAL A 9 -2.163 -13.857 -0.051 1.00 0.00 N ATOM 128 CA VAL A 9 -1.684 -14.511 1.187 1.00 0.00 C ATOM 129 C VAL A 9 -2.834 -14.777 2.195 1.00 0.00 C ATOM 130 O VAL A 9 -2.944 -15.877 2.754 1.00 0.00 O ATOM 131 CB VAL A 9 -0.523 -13.662 1.816 1.00 0.00 C ATOM 132 CG1 VAL A 9 -0.077 -14.206 3.189 1.00 0.00 C ATOM 133 CG2 VAL A 9 0.683 -13.599 0.838 1.00 0.00 C ATOM 0 H VAL A 9 -1.718 -12.957 -0.227 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.290 -15.494 0.928 1.00 0.00 H new ATOM 0 HB VAL A 9 -0.907 -12.655 1.981 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.728 -13.585 3.582 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -0.920 -14.187 3.879 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.277 -15.231 3.077 1.00 0.00 H new ATOM 0 HG21 VAL A 9 1.483 -13.008 1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.045 -14.608 0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 9 0.369 -13.137 -0.098 1.00 0.00 H new ATOM 143 N GLN A 10 -3.710 -13.779 2.368 1.00 0.00 N ATOM 144 CA GLN A 10 -4.921 -13.904 3.209 1.00 0.00 C ATOM 145 C GLN A 10 -5.948 -14.870 2.591 1.00 0.00 C ATOM 146 O GLN A 10 -6.435 -15.767 3.275 1.00 0.00 O ATOM 147 CB GLN A 10 -5.574 -12.513 3.472 1.00 0.00 C ATOM 148 CG GLN A 10 -5.026 -11.767 4.702 1.00 0.00 C ATOM 149 CD GLN A 10 -5.270 -12.501 6.039 1.00 0.00 C ATOM 150 OE1 GLN A 10 -4.482 -12.379 6.976 1.00 0.00 O ATOM 151 NE2 GLN A 10 -6.367 -13.258 6.148 1.00 0.00 N ATOM 0 H GLN A 10 -3.605 -12.862 1.933 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.602 -14.320 4.164 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.431 -11.887 2.591 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -6.648 -12.649 3.595 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.955 -11.613 4.574 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -5.486 -10.780 4.751 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -7.007 -13.345 5.359 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -6.564 -13.748 7.021 1.00 0.00 H new ATOM 160 N LYS A 11 -6.255 -14.681 1.295 1.00 0.00 N ATOM 161 CA LYS A 11 -7.291 -15.477 0.593 1.00 0.00 C ATOM 162 C LYS A 11 -6.928 -16.965 0.509 1.00 0.00 C ATOM 163 O LYS A 11 -7.821 -17.806 0.445 1.00 0.00 O ATOM 164 CB LYS A 11 -7.567 -14.911 -0.818 1.00 0.00 C ATOM 165 CG LYS A 11 -8.301 -13.553 -0.833 1.00 0.00 C ATOM 166 CD LYS A 11 -9.685 -13.611 -0.152 1.00 0.00 C ATOM 167 CE LYS A 11 -10.455 -12.286 -0.257 1.00 0.00 C ATOM 168 NZ LYS A 11 -11.762 -12.358 0.433 1.00 0.00 N ATOM 0 H LYS A 11 -5.801 -13.982 0.706 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.201 -15.396 1.188 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.618 -14.802 -1.344 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.160 -15.636 -1.376 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.685 -12.807 -0.330 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.423 -13.223 -1.865 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.276 -14.406 -0.607 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.557 -13.870 0.899 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.858 -11.483 0.176 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.611 -12.037 -1.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -12.254 -11.446 0.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -12.340 -13.108 0.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.612 -12.571 1.440 1.00 0.00 H new ATOM 182 N GLN A 12 -5.617 -17.272 0.510 1.00 0.00 N ATOM 183 CA GLN A 12 -5.128 -18.660 0.552 1.00 0.00 C ATOM 184 C GLN A 12 -5.434 -19.276 1.921 1.00 0.00 C ATOM 185 O GLN A 12 -5.919 -20.390 2.000 1.00 0.00 O ATOM 186 CB GLN A 12 -3.602 -18.733 0.347 1.00 0.00 C ATOM 187 CG GLN A 12 -3.109 -18.363 -1.046 1.00 0.00 C ATOM 188 CD GLN A 12 -1.595 -18.266 -1.068 1.00 0.00 C ATOM 189 OE1 GLN A 12 -0.906 -19.221 -1.333 1.00 0.00 O ATOM 190 NE2 GLN A 12 -1.069 -17.104 -0.750 1.00 0.00 N ATOM 0 H GLN A 12 -4.875 -16.572 0.482 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.630 -19.201 -0.250 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -3.124 -18.072 1.070 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.271 -19.746 0.573 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -3.441 -19.111 -1.766 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -3.544 -17.411 -1.351 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.674 -16.313 -0.530 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.055 -16.993 -0.723 1.00 0.00 H new ATOM 199 N LEU A 13 -5.105 -18.503 2.977 1.00 0.00 N ATOM 200 CA LEU A 13 -5.250 -18.911 4.387 1.00 0.00 C ATOM 201 C LEU A 13 -6.705 -19.289 4.660 1.00 0.00 C ATOM 202 O LEU A 13 -6.995 -20.388 5.155 1.00 0.00 O ATOM 203 CB LEU A 13 -4.821 -17.731 5.308 1.00 0.00 C ATOM 204 CG LEU A 13 -4.494 -18.014 6.817 1.00 0.00 C ATOM 205 CD1 LEU A 13 -4.148 -16.688 7.513 1.00 0.00 C ATOM 206 CD2 LEU A 13 -5.608 -18.748 7.604 1.00 0.00 C ATOM 0 H LEU A 13 -4.725 -17.562 2.870 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.616 -19.774 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.939 -17.272 4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -5.617 -16.987 5.279 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.647 -18.700 6.817 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.920 -16.876 8.562 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.282 -16.238 7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -4.997 -16.008 7.443 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -5.287 -18.897 8.635 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -6.518 -18.149 7.590 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -5.803 -19.715 7.141 1.00 0.00 H new ATOM 218 N GLU A 14 -7.607 -18.353 4.336 1.00 0.00 N ATOM 219 CA GLU A 14 -9.039 -18.515 4.589 1.00 0.00 C ATOM 220 C GLU A 14 -9.570 -19.729 3.818 1.00 0.00 C ATOM 221 O GLU A 14 -10.364 -20.502 4.334 1.00 0.00 O ATOM 222 CB GLU A 14 -9.821 -17.240 4.201 1.00 0.00 C ATOM 223 CG GLU A 14 -9.259 -15.932 4.794 1.00 0.00 C ATOM 224 CD GLU A 14 -9.114 -15.958 6.325 1.00 0.00 C ATOM 225 OE1 GLU A 14 -10.143 -15.804 7.027 1.00 0.00 O ATOM 226 OE2 GLU A 14 -7.983 -16.118 6.835 1.00 0.00 O ATOM 0 H GLU A 14 -7.363 -17.467 3.893 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.184 -18.681 5.656 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.833 -17.154 3.114 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.856 -17.353 4.523 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.284 -15.731 4.349 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -9.913 -15.106 4.514 1.00 0.00 H new ATOM 233 N ALA A 15 -9.036 -19.893 2.605 1.00 0.00 N ATOM 234 CA ALA A 15 -9.361 -21.006 1.699 1.00 0.00 C ATOM 235 C ALA A 15 -8.777 -22.340 2.208 1.00 0.00 C ATOM 236 O ALA A 15 -9.303 -23.410 1.914 1.00 0.00 O ATOM 237 CB ALA A 15 -8.814 -20.688 0.310 1.00 0.00 C ATOM 0 H ALA A 15 -8.352 -19.245 2.214 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.444 -21.119 1.659 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.049 -21.507 -0.370 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.269 -19.768 -0.058 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.733 -20.561 0.365 1.00 0.00 H new ATOM 243 N TYR A 16 -7.678 -22.243 2.962 1.00 0.00 N ATOM 244 CA TYR A 16 -6.919 -23.399 3.462 1.00 0.00 C ATOM 245 C TYR A 16 -7.691 -24.103 4.596 1.00 0.00 C ATOM 246 O TYR A 16 -7.709 -25.342 4.673 1.00 0.00 O ATOM 247 CB TYR A 16 -5.532 -22.890 3.927 1.00 0.00 C ATOM 248 CG TYR A 16 -4.543 -23.943 4.423 1.00 0.00 C ATOM 249 CD1 TYR A 16 -3.823 -24.744 3.526 1.00 0.00 C ATOM 250 CD2 TYR A 16 -4.302 -24.118 5.785 1.00 0.00 C ATOM 251 CE1 TYR A 16 -2.906 -25.674 3.974 1.00 0.00 C ATOM 252 CE2 TYR A 16 -3.383 -25.043 6.233 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.687 -25.816 5.328 1.00 0.00 C ATOM 254 OH TYR A 16 -1.759 -26.733 5.781 1.00 0.00 O ATOM 0 H TYR A 16 -7.283 -21.347 3.248 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.782 -24.142 2.677 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -5.071 -22.355 3.097 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.687 -22.166 4.727 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -3.989 -24.632 2.465 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -4.844 -23.519 6.501 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.364 -26.286 3.269 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -3.208 -25.162 7.292 1.00 0.00 H new ATOM 0 HH TYR A 16 -0.858 -26.355 5.698 1.00 0.00 H new ATOM 264 N ASN A 17 -8.349 -23.297 5.460 1.00 0.00 N ATOM 265 CA ASN A 17 -9.177 -23.821 6.569 1.00 0.00 C ATOM 266 C ASN A 17 -10.634 -24.067 6.105 1.00 0.00 C ATOM 267 O ASN A 17 -11.309 -24.944 6.646 1.00 0.00 O ATOM 268 CB ASN A 17 -9.141 -22.880 7.814 1.00 0.00 C ATOM 269 CG ASN A 17 -9.669 -21.460 7.558 1.00 0.00 C ATOM 270 OD1 ASN A 17 -10.871 -21.213 7.633 1.00 0.00 O ATOM 271 ND2 ASN A 17 -8.777 -20.514 7.289 1.00 0.00 N ATOM 0 H ASN A 17 -8.322 -22.279 5.410 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.748 -24.777 6.870 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.728 -23.333 8.613 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -8.114 -22.812 8.172 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.083 -19.553 7.138 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -7.786 -20.749 7.233 1.00 0.00 H new ATOM 278 N ALA A 18 -11.105 -23.297 5.097 1.00 0.00 N ATOM 279 CA ALA A 18 -12.491 -23.418 4.548 1.00 0.00 C ATOM 280 C ALA A 18 -12.564 -24.394 3.353 1.00 0.00 C ATOM 281 O ALA A 18 -13.638 -24.575 2.761 1.00 0.00 O ATOM 282 CB ALA A 18 -13.028 -22.033 4.140 1.00 0.00 C ATOM 0 H ALA A 18 -10.546 -22.577 4.639 1.00 0.00 H new ATOM 0 HA ALA A 18 -13.117 -23.829 5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -14.038 -22.137 3.742 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.047 -21.379 5.012 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.380 -21.602 3.377 1.00 0.00 H new ATOM 288 N ARG A 19 -11.404 -24.991 3.001 1.00 0.00 N ATOM 289 CA ARG A 19 -11.271 -26.064 1.980 1.00 0.00 C ATOM 290 C ARG A 19 -11.475 -25.564 0.519 1.00 0.00 C ATOM 291 O ARG A 19 -11.572 -26.382 -0.406 1.00 0.00 O ATOM 292 CB ARG A 19 -12.199 -27.283 2.285 1.00 0.00 C ATOM 293 CG ARG A 19 -11.977 -27.957 3.660 1.00 0.00 C ATOM 294 CD ARG A 19 -10.536 -28.452 3.876 1.00 0.00 C ATOM 295 NE ARG A 19 -10.428 -29.266 5.098 1.00 0.00 N ATOM 296 CZ ARG A 19 -9.853 -28.891 6.248 1.00 0.00 C ATOM 297 NH1 ARG A 19 -9.225 -27.717 6.358 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.895 -29.713 7.288 1.00 0.00 N ATOM 0 H ARG A 19 -10.512 -24.738 3.426 1.00 0.00 H new ATOM 0 HA ARG A 19 -10.236 -26.397 2.051 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.236 -26.953 2.224 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -12.056 -28.031 1.505 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -12.231 -27.248 4.448 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.661 -28.800 3.757 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.218 -29.040 3.015 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.862 -27.598 3.945 1.00 0.00 H new ATOM 0 HE ARG A 19 -10.829 -30.203 5.066 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -9.177 -27.087 5.557 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -8.794 -27.450 7.243 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -10.361 -30.617 7.205 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.462 -29.441 8.171 1.00 0.00 H new ATOM 312 N ASP A 20 -11.482 -24.232 0.311 1.00 0.00 N ATOM 313 CA ASP A 20 -11.627 -23.631 -1.033 1.00 0.00 C ATOM 314 C ASP A 20 -10.326 -23.779 -1.845 1.00 0.00 C ATOM 315 O ASP A 20 -9.412 -22.972 -1.721 1.00 0.00 O ATOM 316 CB ASP A 20 -12.029 -22.128 -0.940 1.00 0.00 C ATOM 317 CG ASP A 20 -13.435 -21.902 -0.379 1.00 0.00 C ATOM 318 OD1 ASP A 20 -14.410 -21.877 -1.165 1.00 0.00 O ATOM 319 OD2 ASP A 20 -13.576 -21.747 0.848 1.00 0.00 O ATOM 0 H ASP A 20 -11.388 -23.547 1.061 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.424 -24.169 -1.547 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.308 -21.606 -0.311 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.967 -21.682 -1.933 1.00 0.00 H new ATOM 324 N ILE A 21 -10.248 -24.831 -2.670 1.00 0.00 N ATOM 325 CA ILE A 21 -9.173 -24.990 -3.668 1.00 0.00 C ATOM 326 C ILE A 21 -9.276 -23.896 -4.757 1.00 0.00 C ATOM 327 O ILE A 21 -8.261 -23.504 -5.345 1.00 0.00 O ATOM 328 CB ILE A 21 -9.188 -26.456 -4.278 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.566 -27.464 -3.259 1.00 0.00 C ATOM 330 CG2 ILE A 21 -8.488 -26.564 -5.661 1.00 0.00 C ATOM 331 CD1 ILE A 21 -7.076 -27.263 -3.012 1.00 0.00 C ATOM 0 H ILE A 21 -10.924 -25.595 -2.668 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.210 -24.860 -3.175 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.233 -26.710 -4.456 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.095 -27.377 -2.310 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -8.729 -28.478 -3.623 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.538 -27.594 -6.015 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.990 -25.911 -6.375 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.445 -26.263 -5.565 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.723 -28.003 -2.293 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.533 -27.380 -3.950 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.905 -26.262 -2.616 1.00 0.00 H new ATOM 343 N ASP A 22 -10.510 -23.374 -4.973 1.00 0.00 N ATOM 344 CA ASP A 22 -10.777 -22.312 -5.969 1.00 0.00 C ATOM 345 C ASP A 22 -9.970 -21.040 -5.654 1.00 0.00 C ATOM 346 O ASP A 22 -9.269 -20.527 -6.520 1.00 0.00 O ATOM 347 CB ASP A 22 -12.292 -21.974 -6.009 1.00 0.00 C ATOM 348 CG ASP A 22 -13.162 -23.163 -6.435 1.00 0.00 C ATOM 349 OD1 ASP A 22 -13.300 -23.413 -7.654 1.00 0.00 O ATOM 350 OD2 ASP A 22 -13.698 -23.867 -5.553 1.00 0.00 O ATOM 0 H ASP A 22 -11.341 -23.677 -4.464 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.467 -22.686 -6.945 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.609 -21.634 -5.023 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.455 -21.146 -6.699 1.00 0.00 H new ATOM 355 N ALA A 23 -10.022 -20.592 -4.387 1.00 0.00 N ATOM 356 CA ALA A 23 -9.295 -19.385 -3.922 1.00 0.00 C ATOM 357 C ALA A 23 -7.820 -19.713 -3.637 1.00 0.00 C ATOM 358 O ALA A 23 -6.938 -18.863 -3.806 1.00 0.00 O ATOM 359 CB ALA A 23 -9.979 -18.786 -2.678 1.00 0.00 C ATOM 0 H ALA A 23 -10.565 -21.050 -3.655 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.325 -18.639 -4.716 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.431 -17.902 -2.352 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.004 -18.508 -2.925 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -9.987 -19.524 -1.876 1.00 0.00 H new ATOM 365 N PHE A 24 -7.564 -20.971 -3.226 1.00 0.00 N ATOM 366 CA PHE A 24 -6.203 -21.473 -2.960 1.00 0.00 C ATOM 367 C PHE A 24 -5.419 -21.683 -4.285 1.00 0.00 C ATOM 368 O PHE A 24 -4.245 -22.049 -4.257 1.00 0.00 O ATOM 369 CB PHE A 24 -6.257 -22.781 -2.112 1.00 0.00 C ATOM 370 CG PHE A 24 -4.964 -23.088 -1.348 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.667 -22.406 -0.171 1.00 0.00 C ATOM 372 CD2 PHE A 24 -4.038 -24.023 -1.813 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.497 -22.648 0.521 1.00 0.00 C ATOM 374 CE2 PHE A 24 -2.863 -24.257 -1.121 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.593 -23.571 0.045 1.00 0.00 C ATOM 0 H PHE A 24 -8.294 -21.666 -3.070 1.00 0.00 H new ATOM 0 HA PHE A 24 -5.666 -20.722 -2.380 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.078 -22.705 -1.399 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.484 -23.619 -2.771 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.365 -21.674 0.208 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.241 -24.569 -2.722 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.291 -22.113 1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.154 -24.980 -1.495 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.675 -23.757 0.583 1.00 0.00 H new ATOM 385 N MET A 25 -6.095 -21.529 -5.450 1.00 0.00 N ATOM 386 CA MET A 25 -5.427 -21.570 -6.774 1.00 0.00 C ATOM 387 C MET A 25 -5.589 -20.247 -7.564 1.00 0.00 C ATOM 388 O MET A 25 -4.722 -19.908 -8.379 1.00 0.00 O ATOM 389 CB MET A 25 -5.961 -22.761 -7.617 1.00 0.00 C ATOM 390 CG MET A 25 -5.207 -23.035 -8.946 1.00 0.00 C ATOM 391 SD MET A 25 -3.827 -24.209 -8.801 1.00 0.00 S ATOM 392 CE MET A 25 -2.688 -23.448 -7.639 1.00 0.00 C ATOM 0 H MET A 25 -7.102 -21.375 -5.499 1.00 0.00 H new ATOM 0 HA MET A 25 -4.362 -21.706 -6.584 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.921 -23.662 -7.005 1.00 0.00 H new ATOM 0 HB3 MET A 25 -7.011 -22.578 -7.847 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.917 -23.417 -9.680 1.00 0.00 H new ATOM 0 HG3 MET A 25 -4.825 -22.091 -9.334 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.681 -23.824 -7.817 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.700 -22.366 -7.773 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.991 -23.691 -6.621 1.00 0.00 H new ATOM 402 N ALA A 26 -6.685 -19.498 -7.301 1.00 0.00 N ATOM 403 CA ALA A 26 -7.067 -18.292 -8.095 1.00 0.00 C ATOM 404 C ALA A 26 -6.001 -17.181 -8.058 1.00 0.00 C ATOM 405 O ALA A 26 -5.857 -16.414 -9.012 1.00 0.00 O ATOM 406 CB ALA A 26 -8.416 -17.732 -7.613 1.00 0.00 C ATOM 0 H ALA A 26 -7.330 -19.705 -6.539 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.151 -18.623 -9.130 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.677 -16.854 -8.203 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.189 -18.492 -7.731 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.340 -17.453 -6.562 1.00 0.00 H new ATOM 412 N TRP A 27 -5.263 -17.111 -6.950 1.00 0.00 N ATOM 413 CA TRP A 27 -4.273 -16.053 -6.704 1.00 0.00 C ATOM 414 C TRP A 27 -2.853 -16.472 -7.101 1.00 0.00 C ATOM 415 O TRP A 27 -1.914 -15.685 -6.953 1.00 0.00 O ATOM 416 CB TRP A 27 -4.319 -15.677 -5.219 1.00 0.00 C ATOM 417 CG TRP A 27 -5.609 -15.020 -4.808 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.733 -15.632 -4.337 1.00 0.00 C ATOM 419 CD2 TRP A 27 -5.902 -13.614 -4.843 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.689 -14.705 -4.062 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.212 -13.454 -4.367 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.170 -12.479 -5.219 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -7.815 -12.202 -4.260 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -5.766 -11.240 -5.117 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.079 -11.110 -4.638 1.00 0.00 C ATOM 0 H TRP A 27 -5.333 -17.789 -6.191 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.528 -15.195 -7.326 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.170 -16.575 -4.620 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.490 -15.005 -4.996 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.847 -16.697 -4.202 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.616 -14.907 -3.688 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.157 -12.574 -5.582 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -8.825 -12.097 -3.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.216 -10.358 -5.409 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -7.519 -10.126 -4.566 1.00 0.00 H new ATOM 436 N TRP A 28 -2.707 -17.703 -7.599 1.00 0.00 N ATOM 437 CA TRP A 28 -1.414 -18.262 -8.005 1.00 0.00 C ATOM 438 C TRP A 28 -1.249 -18.103 -9.522 1.00 0.00 C ATOM 439 O TRP A 28 -2.237 -18.116 -10.269 1.00 0.00 O ATOM 440 CB TRP A 28 -1.324 -19.759 -7.612 1.00 0.00 C ATOM 441 CG TRP A 28 -1.459 -20.055 -6.125 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.479 -19.681 -5.283 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.561 -20.837 -5.321 1.00 0.00 C ATOM 444 NE1 TRP A 28 -2.260 -20.182 -4.027 1.00 0.00 N ATOM 445 CE2 TRP A 28 -1.093 -20.895 -4.025 1.00 0.00 C ATOM 446 CE3 TRP A 28 0.636 -21.492 -5.575 1.00 0.00 C ATOM 447 CZ2 TRP A 28 -0.471 -21.593 -2.990 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.259 -22.174 -4.547 1.00 0.00 C ATOM 449 CH2 TRP A 28 0.703 -22.222 -3.268 1.00 0.00 C ATOM 0 H TRP A 28 -3.488 -18.345 -7.733 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.615 -17.726 -7.494 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -2.103 -20.304 -8.145 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.367 -20.150 -7.957 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.329 -19.080 -5.570 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.870 -20.045 -3.221 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.074 -21.469 -6.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.906 -21.633 -2.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.194 -22.680 -4.737 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.212 -22.767 -2.487 1.00 0.00 H new ATOM 460 N ALA A 29 0.002 -17.937 -9.954 1.00 0.00 N ATOM 461 CA ALA A 29 0.372 -17.923 -11.376 1.00 0.00 C ATOM 462 C ALA A 29 0.428 -19.365 -11.903 1.00 0.00 C ATOM 463 O ALA A 29 0.647 -20.303 -11.129 1.00 0.00 O ATOM 464 CB ALA A 29 1.726 -17.213 -11.565 1.00 0.00 C ATOM 0 H ALA A 29 0.795 -17.807 -9.325 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.378 -17.372 -11.943 1.00 0.00 H new ATOM 0 HB1 ALA A 29 1.990 -17.209 -12.623 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.652 -16.187 -11.205 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.495 -17.741 -11.001 1.00 0.00 H new ATOM 470 N ASP A 30 0.232 -19.537 -13.216 1.00 0.00 N ATOM 471 CA ASP A 30 0.273 -20.867 -13.866 1.00 0.00 C ATOM 472 C ASP A 30 1.705 -21.438 -13.893 1.00 0.00 C ATOM 473 O ASP A 30 1.897 -22.650 -13.958 1.00 0.00 O ATOM 474 CB ASP A 30 -0.307 -20.784 -15.292 1.00 0.00 C ATOM 475 CG ASP A 30 -0.371 -22.155 -15.997 1.00 0.00 C ATOM 476 OD1 ASP A 30 -1.244 -22.974 -15.644 1.00 0.00 O ATOM 477 OD2 ASP A 30 0.445 -22.419 -16.902 1.00 0.00 O ATOM 0 H ASP A 30 0.041 -18.769 -13.860 1.00 0.00 H new ATOM 0 HA ASP A 30 -0.341 -21.548 -13.277 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.309 -20.358 -15.247 1.00 0.00 H new ATOM 0 HB3 ASP A 30 0.302 -20.104 -15.887 1.00 0.00 H new ATOM 482 N ASP A 31 2.698 -20.548 -13.819 1.00 0.00 N ATOM 483 CA ASP A 31 4.128 -20.907 -13.773 1.00 0.00 C ATOM 484 C ASP A 31 4.641 -20.959 -12.317 1.00 0.00 C ATOM 485 O ASP A 31 5.861 -20.927 -12.096 1.00 0.00 O ATOM 486 CB ASP A 31 4.952 -19.867 -14.585 1.00 0.00 C ATOM 487 CG ASP A 31 4.641 -19.870 -16.094 1.00 0.00 C ATOM 488 OD1 ASP A 31 3.738 -19.127 -16.531 1.00 0.00 O ATOM 489 OD2 ASP A 31 5.310 -20.609 -16.856 1.00 0.00 O ATOM 0 H ASP A 31 2.535 -19.542 -13.789 1.00 0.00 H new ATOM 0 HA ASP A 31 4.249 -21.897 -14.212 1.00 0.00 H new ATOM 0 HB2 ASP A 31 4.758 -18.872 -14.185 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.014 -20.067 -14.442 1.00 0.00 H new ATOM 494 N CYS A 32 3.717 -21.056 -11.332 1.00 0.00 N ATOM 495 CA CYS A 32 4.075 -20.984 -9.902 1.00 0.00 C ATOM 496 C CYS A 32 4.971 -22.158 -9.474 1.00 0.00 C ATOM 497 O CYS A 32 4.609 -23.326 -9.637 1.00 0.00 O ATOM 498 CB CYS A 32 2.840 -20.916 -8.998 1.00 0.00 C ATOM 499 SG CYS A 32 3.251 -20.683 -7.247 1.00 0.00 S ATOM 0 H CYS A 32 2.720 -21.184 -11.505 1.00 0.00 H new ATOM 0 HA CYS A 32 4.637 -20.058 -9.781 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.201 -20.096 -9.327 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.264 -21.834 -9.111 1.00 0.00 H new ATOM 0 HG CYS A 32 2.465 -21.415 -6.515 1.00 0.00 H new ATOM 505 N GLN A 33 6.145 -21.820 -8.929 1.00 0.00 N ATOM 506 CA GLN A 33 7.176 -22.784 -8.539 1.00 0.00 C ATOM 507 C GLN A 33 7.050 -23.101 -7.042 1.00 0.00 C ATOM 508 O GLN A 33 7.435 -22.291 -6.188 1.00 0.00 O ATOM 509 CB GLN A 33 8.560 -22.180 -8.873 1.00 0.00 C ATOM 510 CG GLN A 33 8.757 -21.837 -10.360 1.00 0.00 C ATOM 511 CD GLN A 33 8.758 -23.060 -11.281 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.789 -23.697 -11.479 1.00 0.00 O ATOM 513 NE2 GLN A 33 7.611 -23.381 -11.866 1.00 0.00 N ATOM 0 H GLN A 33 6.408 -20.852 -8.744 1.00 0.00 H new ATOM 0 HA GLN A 33 7.055 -23.719 -9.086 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.701 -21.276 -8.281 1.00 0.00 H new ATOM 0 HB3 GLN A 33 9.334 -22.884 -8.569 1.00 0.00 H new ATOM 0 HG2 GLN A 33 7.965 -21.157 -10.675 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.700 -21.304 -10.478 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.772 -22.831 -11.680 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.568 -24.178 -12.502 1.00 0.00 H new ATOM 522 N TYR A 34 6.493 -24.285 -6.747 1.00 0.00 N ATOM 523 CA TYR A 34 6.236 -24.752 -5.383 1.00 0.00 C ATOM 524 C TYR A 34 7.379 -25.658 -4.907 1.00 0.00 C ATOM 525 O TYR A 34 7.562 -26.775 -5.421 1.00 0.00 O ATOM 526 CB TYR A 34 4.879 -25.494 -5.318 1.00 0.00 C ATOM 527 CG TYR A 34 4.381 -25.817 -3.895 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.761 -24.832 -3.117 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.518 -27.095 -3.343 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.300 -25.111 -1.848 1.00 0.00 C ATOM 531 CE2 TYR A 34 4.062 -27.376 -2.072 1.00 0.00 C ATOM 532 CZ TYR A 34 3.452 -26.386 -1.330 1.00 0.00 C ATOM 533 OH TYR A 34 2.972 -26.670 -0.068 1.00 0.00 O ATOM 0 H TYR A 34 6.205 -24.953 -7.463 1.00 0.00 H new ATOM 0 HA TYR A 34 6.186 -23.890 -4.718 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.126 -24.888 -5.821 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.964 -26.426 -5.877 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.642 -23.836 -3.518 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.989 -27.875 -3.922 1.00 0.00 H new ATOM 0 HE1 TYR A 34 2.823 -24.340 -1.261 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.182 -28.367 -1.659 1.00 0.00 H new ATOM 0 HH TYR A 34 2.002 -26.807 -0.110 1.00 0.00 H new ATOM 543 N TYR A 35 8.141 -25.162 -3.926 1.00 0.00 N ATOM 544 CA TYR A 35 9.251 -25.899 -3.302 1.00 0.00 C ATOM 545 C TYR A 35 8.956 -26.160 -1.817 1.00 0.00 C ATOM 546 O TYR A 35 8.164 -25.461 -1.184 1.00 0.00 O ATOM 547 CB TYR A 35 10.600 -25.132 -3.434 1.00 0.00 C ATOM 548 CG TYR A 35 11.133 -24.956 -4.871 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.659 -23.950 -5.706 1.00 0.00 C ATOM 550 CD2 TYR A 35 12.133 -25.787 -5.375 1.00 0.00 C ATOM 551 CE1 TYR A 35 11.162 -23.777 -6.977 1.00 0.00 C ATOM 552 CE2 TYR A 35 12.637 -25.622 -6.647 1.00 0.00 C ATOM 553 CZ TYR A 35 12.142 -24.617 -7.446 1.00 0.00 C ATOM 554 OH TYR A 35 12.640 -24.442 -8.717 1.00 0.00 O ATOM 0 H TYR A 35 8.005 -24.229 -3.537 1.00 0.00 H new ATOM 0 HA TYR A 35 9.344 -26.848 -3.830 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.481 -24.145 -2.987 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.354 -25.658 -2.848 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.881 -23.291 -5.351 1.00 0.00 H new ATOM 0 HD2 TYR A 35 12.522 -26.580 -4.753 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.786 -22.982 -7.604 1.00 0.00 H new ATOM 0 HE2 TYR A 35 13.414 -26.276 -7.014 1.00 0.00 H new ATOM 0 HH TYR A 35 13.327 -25.117 -8.895 1.00 0.00 H new ATOM 564 N ALA A 36 9.586 -27.209 -1.299 1.00 0.00 N ATOM 565 CA ALA A 36 9.675 -27.505 0.135 1.00 0.00 C ATOM 566 C ALA A 36 11.130 -27.326 0.574 1.00 0.00 C ATOM 567 O ALA A 36 12.032 -27.313 -0.268 1.00 0.00 O ATOM 568 CB ALA A 36 9.190 -28.934 0.410 1.00 0.00 C ATOM 0 H ALA A 36 10.064 -27.899 -1.878 1.00 0.00 H new ATOM 0 HA ALA A 36 9.039 -26.826 0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.260 -29.143 1.477 1.00 0.00 H new ATOM 0 HB2 ALA A 36 8.153 -29.035 0.088 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.811 -29.641 -0.140 1.00 0.00 H new ATOM 574 N PHE A 37 11.337 -27.160 1.882 1.00 0.00 N ATOM 575 CA PHE A 37 12.681 -27.061 2.492 1.00 0.00 C ATOM 576 C PHE A 37 13.616 -28.248 2.075 1.00 0.00 C ATOM 577 O PHE A 37 13.174 -29.405 2.077 1.00 0.00 O ATOM 578 CB PHE A 37 12.552 -26.978 4.042 1.00 0.00 C ATOM 579 CG PHE A 37 11.781 -28.133 4.703 1.00 0.00 C ATOM 580 CD1 PHE A 37 10.380 -28.147 4.724 1.00 0.00 C ATOM 581 CD2 PHE A 37 12.451 -29.198 5.304 1.00 0.00 C ATOM 582 CE1 PHE A 37 9.686 -29.180 5.322 1.00 0.00 C ATOM 583 CE2 PHE A 37 11.751 -30.230 5.902 1.00 0.00 C ATOM 584 CZ PHE A 37 10.370 -30.220 5.910 1.00 0.00 C ATOM 0 H PHE A 37 10.577 -27.089 2.559 1.00 0.00 H new ATOM 0 HA PHE A 37 13.148 -26.150 2.118 1.00 0.00 H new ATOM 0 HB2 PHE A 37 13.553 -26.939 4.471 1.00 0.00 H new ATOM 0 HB3 PHE A 37 12.059 -26.041 4.299 1.00 0.00 H new ATOM 0 HD1 PHE A 37 9.834 -27.336 4.265 1.00 0.00 H new ATOM 0 HD2 PHE A 37 13.531 -29.217 5.302 1.00 0.00 H new ATOM 0 HE1 PHE A 37 8.606 -29.172 5.328 1.00 0.00 H new ATOM 0 HE2 PHE A 37 12.286 -31.046 6.364 1.00 0.00 H new ATOM 0 HZ PHE A 37 9.827 -31.028 6.377 1.00 0.00 H new ATOM 594 N PRO A 38 14.910 -27.988 1.660 1.00 0.00 N ATOM 595 CA PRO A 38 15.468 -26.626 1.418 1.00 0.00 C ATOM 596 C PRO A 38 14.988 -26.003 0.075 1.00 0.00 C ATOM 597 O PRO A 38 14.645 -24.815 0.027 1.00 0.00 O ATOM 598 CB PRO A 38 17.000 -26.866 1.419 1.00 0.00 C ATOM 599 CG PRO A 38 17.164 -28.283 0.947 1.00 0.00 C ATOM 600 CD PRO A 38 15.950 -29.038 1.462 1.00 0.00 C ATOM 0 HA PRO A 38 15.140 -25.909 2.170 1.00 0.00 H new ATOM 0 HB2 PRO A 38 17.511 -26.167 0.757 1.00 0.00 H new ATOM 0 HB3 PRO A 38 17.422 -26.729 2.415 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.219 -28.328 -0.141 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.086 -28.718 1.331 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.620 -29.793 0.748 1.00 0.00 H new ATOM 0 HD3 PRO A 38 16.172 -29.557 2.395 1.00 0.00 H new ATOM 608 N ALA A 39 14.933 -26.830 -0.990 1.00 0.00 N ATOM 609 CA ALA A 39 14.537 -26.394 -2.345 1.00 0.00 C ATOM 610 C ALA A 39 14.167 -27.621 -3.203 1.00 0.00 C ATOM 611 O ALA A 39 14.737 -27.853 -4.279 1.00 0.00 O ATOM 612 CB ALA A 39 15.653 -25.551 -3.005 1.00 0.00 C ATOM 0 H ALA A 39 15.163 -27.822 -0.934 1.00 0.00 H new ATOM 0 HA ALA A 39 13.658 -25.754 -2.268 1.00 0.00 H new ATOM 0 HB1 ALA A 39 15.335 -25.243 -4.001 1.00 0.00 H new ATOM 0 HB2 ALA A 39 15.849 -24.668 -2.397 1.00 0.00 H new ATOM 0 HB3 ALA A 39 16.562 -26.147 -3.082 1.00 0.00 H new ATOM 618 N THR A 40 13.199 -28.403 -2.711 1.00 0.00 N ATOM 619 CA THR A 40 12.653 -29.584 -3.409 1.00 0.00 C ATOM 620 C THR A 40 11.419 -29.170 -4.230 1.00 0.00 C ATOM 621 O THR A 40 10.422 -28.768 -3.643 1.00 0.00 O ATOM 622 CB THR A 40 12.236 -30.680 -2.367 1.00 0.00 C ATOM 623 OG1 THR A 40 13.318 -30.893 -1.439 1.00 0.00 O ATOM 624 CG2 THR A 40 11.848 -32.016 -3.040 1.00 0.00 C ATOM 0 H THR A 40 12.763 -28.235 -1.804 1.00 0.00 H new ATOM 0 HA THR A 40 13.418 -29.990 -4.071 1.00 0.00 H new ATOM 0 HB THR A 40 11.353 -30.318 -1.841 1.00 0.00 H new ATOM 0 HG1 THR A 40 13.059 -31.576 -0.786 1.00 0.00 H new ATOM 0 HG21 THR A 40 11.568 -32.741 -2.275 1.00 0.00 H new ATOM 0 HG22 THR A 40 11.006 -31.854 -3.712 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.697 -32.397 -3.608 1.00 0.00 H new ATOM 632 N LEU A 41 11.485 -29.251 -5.571 1.00 0.00 N ATOM 633 CA LEU A 41 10.361 -28.849 -6.443 1.00 0.00 C ATOM 634 C LEU A 41 9.293 -29.958 -6.453 1.00 0.00 C ATOM 635 O LEU A 41 9.499 -31.009 -7.061 1.00 0.00 O ATOM 636 CB LEU A 41 10.862 -28.549 -7.890 1.00 0.00 C ATOM 637 CG LEU A 41 9.802 -27.974 -8.891 1.00 0.00 C ATOM 638 CD1 LEU A 41 9.213 -26.635 -8.389 1.00 0.00 C ATOM 639 CD2 LEU A 41 10.393 -27.822 -10.314 1.00 0.00 C ATOM 0 H LEU A 41 12.303 -29.591 -6.076 1.00 0.00 H new ATOM 0 HA LEU A 41 9.918 -27.934 -6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.689 -27.842 -7.825 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.263 -29.471 -8.310 1.00 0.00 H new ATOM 0 HG LEU A 41 8.985 -28.694 -8.944 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.482 -26.267 -9.109 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.728 -26.790 -7.425 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.014 -25.904 -8.279 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.632 -27.421 -10.983 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.244 -27.142 -10.284 1.00 0.00 H new ATOM 0 HD23 LEU A 41 10.720 -28.796 -10.678 1.00 0.00 H new ATOM 651 N LEU A 42 8.179 -29.740 -5.723 1.00 0.00 N ATOM 652 CA LEU A 42 7.022 -30.664 -5.747 1.00 0.00 C ATOM 653 C LEU A 42 6.178 -30.402 -6.990 1.00 0.00 C ATOM 654 O LEU A 42 5.642 -31.336 -7.601 1.00 0.00 O ATOM 655 CB LEU A 42 6.114 -30.525 -4.484 1.00 0.00 C ATOM 656 CG LEU A 42 6.716 -30.984 -3.124 1.00 0.00 C ATOM 657 CD1 LEU A 42 7.324 -32.397 -3.212 1.00 0.00 C ATOM 658 CD2 LEU A 42 7.729 -29.972 -2.586 1.00 0.00 C ATOM 0 H LEU A 42 8.055 -28.934 -5.110 1.00 0.00 H new ATOM 0 HA LEU A 42 7.426 -31.676 -5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.824 -29.479 -4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.201 -31.094 -4.659 1.00 0.00 H new ATOM 0 HG LEU A 42 5.892 -31.032 -2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 42 7.733 -32.678 -2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.550 -33.109 -3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.120 -32.405 -3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.128 -30.327 -1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.544 -29.857 -3.301 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.238 -29.010 -2.437 1.00 0.00 H new ATOM 670 N ALA A 43 6.059 -29.116 -7.343 1.00 0.00 N ATOM 671 CA ALA A 43 5.158 -28.672 -8.413 1.00 0.00 C ATOM 672 C ALA A 43 5.741 -27.470 -9.163 1.00 0.00 C ATOM 673 O ALA A 43 5.922 -26.412 -8.577 1.00 0.00 O ATOM 674 CB ALA A 43 3.808 -28.336 -7.782 1.00 0.00 C ATOM 0 H ALA A 43 6.580 -28.360 -6.899 1.00 0.00 H new ATOM 0 HA ALA A 43 5.033 -29.465 -9.150 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.117 -28.002 -8.556 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.404 -29.223 -7.293 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.938 -27.543 -7.046 1.00 0.00 H new ATOM 680 N GLY A 44 6.017 -27.641 -10.469 1.00 0.00 N ATOM 681 CA GLY A 44 6.655 -26.604 -11.290 1.00 0.00 C ATOM 682 C GLY A 44 5.658 -25.875 -12.177 1.00 0.00 C ATOM 683 O GLY A 44 5.956 -25.600 -13.347 1.00 0.00 O ATOM 0 H GLY A 44 5.804 -28.498 -10.979 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.153 -25.885 -10.640 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.426 -27.059 -11.912 1.00 0.00 H new ATOM 687 N ASN A 45 4.516 -25.509 -11.566 1.00 0.00 N ATOM 688 CA ASN A 45 3.302 -24.950 -12.228 1.00 0.00 C ATOM 689 C ASN A 45 2.096 -25.106 -11.282 1.00 0.00 C ATOM 690 O ASN A 45 2.119 -25.953 -10.384 1.00 0.00 O ATOM 691 CB ASN A 45 2.950 -25.603 -13.608 1.00 0.00 C ATOM 692 CG ASN A 45 2.628 -27.098 -13.522 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.492 -27.490 -13.259 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.620 -27.936 -13.773 1.00 0.00 N ATOM 0 H ASN A 45 4.400 -25.594 -10.556 1.00 0.00 H new ATOM 0 HA ASN A 45 3.529 -23.904 -12.435 1.00 0.00 H new ATOM 0 HB2 ASN A 45 2.095 -25.081 -14.038 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.788 -25.460 -14.291 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.455 -28.942 -13.752 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.550 -27.576 -13.988 1.00 0.00 H new ATOM 701 N ALA A 46 1.025 -24.328 -11.549 1.00 0.00 N ATOM 702 CA ALA A 46 -0.179 -24.256 -10.687 1.00 0.00 C ATOM 703 C ALA A 46 -0.956 -25.592 -10.619 1.00 0.00 C ATOM 704 O ALA A 46 -1.488 -25.945 -9.564 1.00 0.00 O ATOM 705 CB ALA A 46 -1.099 -23.124 -11.165 1.00 0.00 C ATOM 0 H ALA A 46 0.969 -23.728 -12.372 1.00 0.00 H new ATOM 0 HA ALA A 46 0.166 -24.048 -9.674 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.981 -23.078 -10.526 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.565 -22.175 -11.115 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.405 -23.314 -12.194 1.00 0.00 H new ATOM 711 N ALA A 47 -0.989 -26.333 -11.744 1.00 0.00 N ATOM 712 CA ALA A 47 -1.800 -27.572 -11.875 1.00 0.00 C ATOM 713 C ALA A 47 -1.400 -28.638 -10.839 1.00 0.00 C ATOM 714 O ALA A 47 -2.259 -29.231 -10.175 1.00 0.00 O ATOM 715 CB ALA A 47 -1.676 -28.152 -13.293 1.00 0.00 C ATOM 0 H ALA A 47 -0.461 -26.097 -12.584 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.837 -27.295 -11.686 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.277 -29.058 -13.369 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.031 -27.420 -14.018 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.632 -28.390 -13.499 1.00 0.00 H new ATOM 721 N GLU A 48 -0.079 -28.859 -10.709 1.00 0.00 N ATOM 722 CA GLU A 48 0.484 -29.886 -9.809 1.00 0.00 C ATOM 723 C GLU A 48 0.345 -29.456 -8.328 1.00 0.00 C ATOM 724 O GLU A 48 0.233 -30.299 -7.429 1.00 0.00 O ATOM 725 CB GLU A 48 1.964 -30.164 -10.164 1.00 0.00 C ATOM 726 CG GLU A 48 2.234 -30.469 -11.650 1.00 0.00 C ATOM 727 CD GLU A 48 3.695 -30.888 -11.907 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.590 -30.010 -11.904 1.00 0.00 O ATOM 729 OE2 GLU A 48 3.960 -32.098 -12.096 1.00 0.00 O ATOM 0 H GLU A 48 0.628 -28.333 -11.223 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.081 -30.808 -9.946 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.560 -29.299 -9.873 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.312 -31.007 -9.567 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.567 -31.264 -11.982 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.001 -29.588 -12.247 1.00 0.00 H new ATOM 736 N ILE A 49 0.357 -28.127 -8.099 1.00 0.00 N ATOM 737 CA ILE A 49 0.145 -27.519 -6.765 1.00 0.00 C ATOM 738 C ILE A 49 -1.271 -27.826 -6.260 1.00 0.00 C ATOM 739 O ILE A 49 -1.460 -28.279 -5.121 1.00 0.00 O ATOM 740 CB ILE A 49 0.341 -25.955 -6.830 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.789 -25.601 -7.260 1.00 0.00 C ATOM 742 CG2 ILE A 49 -0.026 -25.268 -5.496 1.00 0.00 C ATOM 743 CD1 ILE A 49 2.060 -24.138 -7.519 1.00 0.00 C ATOM 0 H ILE A 49 0.515 -27.440 -8.836 1.00 0.00 H new ATOM 0 HA ILE A 49 0.878 -27.945 -6.080 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.346 -25.572 -7.585 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.473 -25.946 -6.484 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.026 -26.160 -8.165 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.124 -24.192 -5.587 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -1.070 -25.470 -5.258 1.00 0.00 H new ATOM 0 HG23 ILE A 49 0.609 -25.657 -4.700 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.102 -24.007 -7.812 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.410 -23.784 -8.319 1.00 0.00 H new ATOM 0 HD13 ILE A 49 1.864 -23.566 -6.612 1.00 0.00 H new ATOM 755 N ARG A 50 -2.239 -27.572 -7.149 1.00 0.00 N ATOM 756 CA ARG A 50 -3.674 -27.705 -6.884 1.00 0.00 C ATOM 757 C ARG A 50 -4.017 -29.114 -6.395 1.00 0.00 C ATOM 758 O ARG A 50 -4.510 -29.279 -5.282 1.00 0.00 O ATOM 759 CB ARG A 50 -4.429 -27.405 -8.196 1.00 0.00 C ATOM 760 CG ARG A 50 -5.956 -27.617 -8.155 1.00 0.00 C ATOM 761 CD ARG A 50 -6.585 -27.409 -9.534 1.00 0.00 C ATOM 762 NE ARG A 50 -8.035 -27.663 -9.558 1.00 0.00 N ATOM 763 CZ ARG A 50 -8.798 -27.585 -10.655 1.00 0.00 C ATOM 764 NH1 ARG A 50 -8.272 -27.236 -11.832 1.00 0.00 N ATOM 765 NH2 ARG A 50 -10.090 -27.860 -10.578 1.00 0.00 N ATOM 0 H ARG A 50 -2.038 -27.260 -8.099 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.967 -27.006 -6.101 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.232 -26.371 -8.478 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.015 -28.034 -8.984 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.176 -28.624 -7.801 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.402 -26.924 -7.442 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.397 -26.386 -9.861 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.096 -28.068 -10.252 1.00 0.00 H new ATOM 0 HE ARG A 50 -8.489 -27.915 -8.680 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -7.277 -27.025 -11.903 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.866 -27.181 -12.660 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -10.502 -28.130 -9.685 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -10.674 -27.802 -11.412 1.00 0.00 H new ATOM 779 N VAL A 51 -3.651 -30.109 -7.218 1.00 0.00 N ATOM 780 CA VAL A 51 -4.014 -31.526 -6.999 1.00 0.00 C ATOM 781 C VAL A 51 -3.374 -32.113 -5.731 1.00 0.00 C ATOM 782 O VAL A 51 -4.004 -32.911 -5.034 1.00 0.00 O ATOM 783 CB VAL A 51 -3.665 -32.406 -8.251 1.00 0.00 C ATOM 784 CG1 VAL A 51 -4.498 -31.964 -9.480 1.00 0.00 C ATOM 785 CG2 VAL A 51 -2.152 -32.372 -8.577 1.00 0.00 C ATOM 0 H VAL A 51 -3.093 -29.957 -8.058 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.094 -31.545 -6.852 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.923 -33.436 -8.006 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.241 -32.587 -10.337 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.560 -32.073 -9.258 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.281 -30.921 -9.711 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.954 -32.994 -9.450 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.848 -31.346 -8.786 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.588 -32.752 -7.725 1.00 0.00 H new ATOM 795 N ARG A 52 -2.136 -31.689 -5.436 1.00 0.00 N ATOM 796 CA ARG A 52 -1.393 -32.136 -4.246 1.00 0.00 C ATOM 797 C ARG A 52 -2.039 -31.574 -2.967 1.00 0.00 C ATOM 798 O ARG A 52 -2.063 -32.234 -1.922 1.00 0.00 O ATOM 799 CB ARG A 52 0.095 -31.712 -4.369 1.00 0.00 C ATOM 800 CG ARG A 52 1.000 -32.172 -3.198 1.00 0.00 C ATOM 801 CD ARG A 52 2.499 -31.914 -3.452 1.00 0.00 C ATOM 802 NE ARG A 52 3.350 -32.458 -2.371 1.00 0.00 N ATOM 803 CZ ARG A 52 3.776 -33.738 -2.284 1.00 0.00 C ATOM 804 NH1 ARG A 52 3.427 -34.645 -3.195 1.00 0.00 N ATOM 805 NH2 ARG A 52 4.560 -34.098 -1.278 1.00 0.00 N ATOM 0 H ARG A 52 -1.621 -31.026 -6.015 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.433 -33.223 -4.181 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.497 -32.113 -5.300 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.144 -30.626 -4.443 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.698 -31.653 -2.288 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.845 -33.237 -3.024 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.788 -32.365 -4.401 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.671 -30.842 -3.543 1.00 0.00 H new ATOM 0 HE ARG A 52 3.638 -31.816 -1.633 1.00 0.00 H new ATOM 0 HH11 ARG A 52 2.828 -34.379 -3.976 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.759 -35.606 -3.111 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.838 -33.411 -0.577 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.886 -35.062 -1.205 1.00 0.00 H new ATOM 819 N HIS A 53 -2.571 -30.343 -3.064 1.00 0.00 N ATOM 820 CA HIS A 53 -3.289 -29.704 -1.949 1.00 0.00 C ATOM 821 C HIS A 53 -4.720 -30.242 -1.810 1.00 0.00 C ATOM 822 O HIS A 53 -5.227 -30.261 -0.705 1.00 0.00 O ATOM 823 CB HIS A 53 -3.257 -28.164 -2.068 1.00 0.00 C ATOM 824 CG HIS A 53 -1.892 -27.581 -1.798 1.00 0.00 C ATOM 825 ND1 HIS A 53 -1.206 -26.801 -2.700 1.00 0.00 N ATOM 826 CD2 HIS A 53 -1.089 -27.676 -0.705 1.00 0.00 C ATOM 827 CE1 HIS A 53 -0.052 -26.437 -2.178 1.00 0.00 C ATOM 828 NE2 HIS A 53 0.046 -26.954 -0.972 1.00 0.00 N ATOM 0 H HIS A 53 -2.516 -29.770 -3.906 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.765 -29.966 -1.030 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.578 -27.876 -3.069 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.974 -27.736 -1.368 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.539 -26.544 -3.629 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -1.305 -28.219 0.204 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.690 -25.817 -2.660 1.00 0.00 H new ATOM 837 N ILE A 54 -5.351 -30.700 -2.918 1.00 0.00 N ATOM 838 CA ILE A 54 -6.676 -31.375 -2.861 1.00 0.00 C ATOM 839 C ILE A 54 -6.589 -32.605 -1.930 1.00 0.00 C ATOM 840 O ILE A 54 -7.475 -32.833 -1.102 1.00 0.00 O ATOM 841 CB ILE A 54 -7.170 -31.807 -4.299 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.435 -30.556 -5.195 1.00 0.00 C ATOM 843 CG2 ILE A 54 -8.430 -32.711 -4.239 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.758 -30.859 -6.650 1.00 0.00 C ATOM 0 H ILE A 54 -4.968 -30.616 -3.860 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.404 -30.668 -2.464 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.369 -32.396 -4.747 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.262 -29.990 -4.766 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.556 -29.912 -5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.732 -32.982 -5.251 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.203 -33.615 -3.674 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -9.242 -32.172 -3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -7.925 -29.926 -7.188 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -6.924 -31.395 -7.104 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.656 -31.474 -6.703 1.00 0.00 H new ATOM 856 N GLU A 55 -5.464 -33.335 -2.054 1.00 0.00 N ATOM 857 CA GLU A 55 -5.142 -34.518 -1.228 1.00 0.00 C ATOM 858 C GLU A 55 -5.017 -34.154 0.269 1.00 0.00 C ATOM 859 O GLU A 55 -5.436 -34.919 1.144 1.00 0.00 O ATOM 860 CB GLU A 55 -3.827 -35.151 -1.744 1.00 0.00 C ATOM 861 CG GLU A 55 -3.902 -35.646 -3.196 1.00 0.00 C ATOM 862 CD GLU A 55 -2.572 -36.200 -3.727 1.00 0.00 C ATOM 863 OE1 GLU A 55 -2.199 -37.332 -3.355 1.00 0.00 O ATOM 864 OE2 GLU A 55 -1.901 -35.518 -4.528 1.00 0.00 O ATOM 0 H GLU A 55 -4.742 -33.117 -2.741 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.958 -35.236 -1.315 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -3.025 -34.417 -1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.560 -35.988 -1.099 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.664 -36.423 -3.267 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.224 -34.824 -3.835 1.00 0.00 H new ATOM 871 N ARG A 56 -4.443 -32.974 0.542 1.00 0.00 N ATOM 872 CA ARG A 56 -4.257 -32.458 1.915 1.00 0.00 C ATOM 873 C ARG A 56 -5.573 -31.849 2.463 1.00 0.00 C ATOM 874 O ARG A 56 -5.790 -31.827 3.673 1.00 0.00 O ATOM 875 CB ARG A 56 -3.080 -31.436 1.937 1.00 0.00 C ATOM 876 CG ARG A 56 -2.802 -30.739 3.297 1.00 0.00 C ATOM 877 CD ARG A 56 -2.598 -31.716 4.479 1.00 0.00 C ATOM 878 NE ARG A 56 -1.412 -32.583 4.339 1.00 0.00 N ATOM 879 CZ ARG A 56 -0.748 -33.139 5.370 1.00 0.00 C ATOM 880 NH1 ARG A 56 -1.153 -32.951 6.625 1.00 0.00 N ATOM 881 NH2 ARG A 56 0.303 -33.911 5.141 1.00 0.00 N ATOM 0 H ARG A 56 -4.092 -32.346 -0.181 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.998 -33.284 2.577 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.172 -31.952 1.625 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -3.281 -30.666 1.192 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.914 -30.115 3.198 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.634 -30.074 3.529 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -2.510 -31.142 5.401 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -3.485 -32.342 4.577 1.00 0.00 H new ATOM 0 HE ARG A 56 -1.072 -32.774 3.397 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -1.976 -32.380 6.815 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -0.640 -33.379 7.396 1.00 0.00 H new ATOM 0 HH21 ARG A 56 0.610 -34.084 4.184 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.806 -34.332 5.922 1.00 0.00 H new ATOM 895 N PHE A 57 -6.455 -31.380 1.568 1.00 0.00 N ATOM 896 CA PHE A 57 -7.766 -30.808 1.956 1.00 0.00 C ATOM 897 C PHE A 57 -8.788 -31.935 2.252 1.00 0.00 C ATOM 898 O PHE A 57 -9.824 -31.683 2.884 1.00 0.00 O ATOM 899 CB PHE A 57 -8.282 -29.813 0.868 1.00 0.00 C ATOM 900 CG PHE A 57 -7.590 -28.427 0.842 1.00 0.00 C ATOM 901 CD1 PHE A 57 -6.250 -28.263 1.198 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.291 -27.290 0.444 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.643 -27.023 1.152 1.00 0.00 C ATOM 904 CE2 PHE A 57 -7.684 -26.048 0.403 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.362 -25.917 0.756 1.00 0.00 C ATOM 0 H PHE A 57 -6.288 -31.383 0.562 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.640 -30.237 2.876 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -8.160 -30.278 -0.110 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.351 -29.662 1.018 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.677 -29.122 1.515 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.330 -27.381 0.162 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.604 -26.921 1.427 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.249 -25.181 0.094 1.00 0.00 H new ATOM 0 HZ PHE A 57 -5.887 -24.947 0.723 1.00 0.00 H new ATOM 915 N LYS A 58 -8.476 -33.179 1.808 1.00 0.00 N ATOM 916 CA LYS A 58 -9.216 -34.396 2.229 1.00 0.00 C ATOM 917 C LYS A 58 -9.080 -34.622 3.747 1.00 0.00 C ATOM 918 O LYS A 58 -9.972 -35.206 4.369 1.00 0.00 O ATOM 919 CB LYS A 58 -8.698 -35.653 1.478 1.00 0.00 C ATOM 920 CG LYS A 58 -8.809 -35.584 -0.058 1.00 0.00 C ATOM 921 CD LYS A 58 -10.258 -35.383 -0.562 1.00 0.00 C ATOM 922 CE LYS A 58 -10.318 -35.186 -2.082 1.00 0.00 C ATOM 923 NZ LYS A 58 -11.709 -35.011 -2.577 1.00 0.00 N ATOM 0 H LYS A 58 -7.714 -33.366 1.156 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.266 -34.240 1.980 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -7.653 -35.813 1.745 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -9.254 -36.523 1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -8.189 -34.766 -0.423 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -8.408 -36.503 -0.485 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -10.861 -36.248 -0.285 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -10.697 -34.517 -0.067 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -9.725 -34.313 -2.356 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -9.865 -36.046 -2.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -11.697 -34.882 -3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -12.270 -35.854 -2.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -12.135 -34.175 -2.128 1.00 0.00 H new ATOM 937 N GLU A 59 -7.952 -34.154 4.318 1.00 0.00 N ATOM 938 CA GLU A 59 -7.657 -34.271 5.756 1.00 0.00 C ATOM 939 C GLU A 59 -8.650 -33.422 6.586 1.00 0.00 C ATOM 940 O GLU A 59 -8.726 -32.205 6.392 1.00 0.00 O ATOM 941 CB GLU A 59 -6.185 -33.846 6.033 1.00 0.00 C ATOM 942 CG GLU A 59 -5.756 -33.897 7.510 1.00 0.00 C ATOM 943 CD GLU A 59 -4.261 -33.590 7.720 1.00 0.00 C ATOM 944 OE1 GLU A 59 -3.867 -32.400 7.716 1.00 0.00 O ATOM 945 OE2 GLU A 59 -3.468 -34.543 7.875 1.00 0.00 O ATOM 0 H GLU A 59 -7.218 -33.682 3.790 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.777 -35.311 6.059 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.523 -34.491 5.456 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -6.041 -32.830 5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -6.350 -33.182 8.079 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.977 -34.886 7.912 1.00 0.00 H new ATOM 952 N PRO A 60 -9.466 -34.059 7.494 1.00 0.00 N ATOM 953 CA PRO A 60 -10.375 -33.321 8.405 1.00 0.00 C ATOM 954 C PRO A 60 -9.594 -32.573 9.509 1.00 0.00 C ATOM 955 O PRO A 60 -10.025 -31.520 9.987 1.00 0.00 O ATOM 956 CB PRO A 60 -11.283 -34.435 8.988 1.00 0.00 C ATOM 957 CG PRO A 60 -10.443 -35.678 8.927 1.00 0.00 C ATOM 958 CD PRO A 60 -9.592 -35.540 7.680 1.00 0.00 C ATOM 0 HA PRO A 60 -10.943 -32.541 7.897 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -11.582 -34.208 10.011 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -12.198 -34.546 8.406 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.821 -35.773 9.817 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -11.067 -36.570 8.878 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -8.617 -36.011 7.807 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.065 -36.012 6.819 1.00 0.00 H new ATOM 966 N ASP A 61 -8.426 -33.129 9.876 1.00 0.00 N ATOM 967 CA ASP A 61 -7.531 -32.578 10.914 1.00 0.00 C ATOM 968 C ASP A 61 -6.861 -31.277 10.447 1.00 0.00 C ATOM 969 O ASP A 61 -6.360 -30.517 11.274 1.00 0.00 O ATOM 970 CB ASP A 61 -6.446 -33.622 11.282 1.00 0.00 C ATOM 971 CG ASP A 61 -7.043 -34.936 11.808 1.00 0.00 C ATOM 972 OD1 ASP A 61 -7.456 -35.781 10.981 1.00 0.00 O ATOM 973 OD2 ASP A 61 -7.095 -35.131 13.038 1.00 0.00 O ATOM 0 H ASP A 61 -8.070 -33.987 9.455 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.136 -32.350 11.792 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -5.836 -33.831 10.403 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.783 -33.200 12.038 1.00 0.00 H new ATOM 978 N LEU A 62 -6.866 -31.044 9.117 1.00 0.00 N ATOM 979 CA LEU A 62 -6.252 -29.864 8.497 1.00 0.00 C ATOM 980 C LEU A 62 -6.871 -28.558 9.032 1.00 0.00 C ATOM 981 O LEU A 62 -8.093 -28.363 8.957 1.00 0.00 O ATOM 982 CB LEU A 62 -6.414 -29.916 6.960 1.00 0.00 C ATOM 983 CG LEU A 62 -5.729 -28.750 6.189 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.203 -28.853 6.320 1.00 0.00 C ATOM 985 CD2 LEU A 62 -6.177 -28.686 4.716 1.00 0.00 C ATOM 0 H LEU A 62 -7.300 -31.677 8.445 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.193 -29.875 8.754 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.007 -30.860 6.598 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.477 -29.915 6.721 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.048 -27.812 6.643 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.735 -28.032 5.777 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.924 -28.798 7.372 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.865 -29.802 5.904 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.673 -27.857 4.218 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.920 -29.620 4.216 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.256 -28.535 4.670 1.00 0.00 H new ATOM 997 N TYR A 63 -6.021 -27.679 9.573 1.00 0.00 N ATOM 998 CA TYR A 63 -6.455 -26.392 10.122 1.00 0.00 C ATOM 999 C TYR A 63 -5.307 -25.373 10.018 1.00 0.00 C ATOM 1000 O TYR A 63 -4.212 -25.641 10.498 1.00 0.00 O ATOM 1001 CB TYR A 63 -6.894 -26.601 11.594 1.00 0.00 C ATOM 1002 CG TYR A 63 -7.532 -25.381 12.264 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -8.844 -25.010 11.962 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -6.830 -24.608 13.195 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -9.432 -23.918 12.561 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.420 -23.515 13.797 1.00 0.00 C ATOM 1007 CZ TYR A 63 -8.715 -23.173 13.478 1.00 0.00 C ATOM 1008 OH TYR A 63 -9.298 -22.084 14.083 1.00 0.00 O ATOM 0 H TYR A 63 -5.016 -27.840 9.642 1.00 0.00 H new ATOM 0 HA TYR A 63 -7.301 -26.001 9.557 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.603 -27.428 11.631 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.023 -26.902 12.177 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.408 -25.590 11.246 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.813 -24.870 13.446 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -10.448 -23.645 12.315 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.867 -22.929 14.517 1.00 0.00 H new ATOM 0 HH TYR A 63 -8.659 -21.672 14.701 1.00 0.00 H new ATOM 1018 N GLY A 64 -5.566 -24.214 9.390 1.00 0.00 N ATOM 1019 CA GLY A 64 -4.571 -23.138 9.282 1.00 0.00 C ATOM 1020 C GLY A 64 -4.870 -22.014 10.255 1.00 0.00 C ATOM 1021 O GLY A 64 -5.861 -21.298 10.078 1.00 0.00 O ATOM 0 H GLY A 64 -6.460 -23.999 8.948 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -3.576 -23.538 9.479 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -4.562 -22.748 8.264 1.00 0.00 H new ATOM 1025 N GLU A 65 -4.034 -21.877 11.303 1.00 0.00 N ATOM 1026 CA GLU A 65 -4.159 -20.799 12.305 1.00 0.00 C ATOM 1027 C GLU A 65 -2.898 -19.928 12.288 1.00 0.00 C ATOM 1028 O GLU A 65 -1.827 -20.393 12.687 1.00 0.00 O ATOM 1029 CB GLU A 65 -4.394 -21.401 13.716 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.571 -20.358 14.837 1.00 0.00 C ATOM 1031 CD GLU A 65 -5.045 -20.975 16.162 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -6.268 -21.101 16.360 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -4.199 -21.357 17.001 1.00 0.00 O ATOM 0 H GLU A 65 -3.254 -22.510 11.479 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.017 -20.175 12.056 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -5.281 -22.034 13.683 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.551 -22.045 13.967 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.624 -19.844 15.000 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.291 -19.605 14.515 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.033 -18.673 11.819 1.00 0.00 N ATOM 1041 CA LEU A 66 -1.895 -17.740 11.702 1.00 0.00 C ATOM 1042 C LEU A 66 -1.511 -17.159 13.072 1.00 0.00 C ATOM 1043 O LEU A 66 -2.370 -16.959 13.935 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.179 -16.585 10.717 1.00 0.00 C ATOM 1045 CG LEU A 66 -0.901 -15.792 10.279 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -0.013 -16.662 9.383 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -1.250 -14.447 9.603 1.00 0.00 C ATOM 0 H LEU A 66 -3.923 -18.280 11.513 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.062 -18.323 11.309 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.665 -16.990 9.829 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.883 -15.893 11.178 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.340 -15.545 11.180 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.871 -16.096 9.087 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.293 -17.554 9.930 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.570 -16.956 8.493 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.332 -13.934 9.317 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.854 -14.632 8.714 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.811 -13.824 10.300 1.00 0.00 H new ATOM 1059 N LEU A 67 -0.207 -16.909 13.252 1.00 0.00 N ATOM 1060 CA LEU A 67 0.355 -16.333 14.487 1.00 0.00 C ATOM 1061 C LEU A 67 0.893 -14.928 14.193 1.00 0.00 C ATOM 1062 O LEU A 67 0.578 -13.952 14.882 1.00 0.00 O ATOM 1063 CB LEU A 67 1.528 -17.229 14.968 1.00 0.00 C ATOM 1064 CG LEU A 67 1.336 -18.757 14.747 1.00 0.00 C ATOM 1065 CD1 LEU A 67 2.664 -19.485 14.928 1.00 0.00 C ATOM 1066 CD2 LEU A 67 0.234 -19.342 15.652 1.00 0.00 C ATOM 0 H LEU A 67 0.496 -17.102 12.539 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.418 -16.278 15.254 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.436 -16.916 14.453 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.687 -17.050 16.031 1.00 0.00 H new ATOM 0 HG LEU A 67 0.998 -18.909 13.722 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.517 -20.554 14.771 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.387 -19.108 14.205 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.038 -19.315 15.938 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.136 -20.411 15.462 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.498 -19.182 16.697 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.713 -18.847 15.438 1.00 0.00 H new ATOM 1078 N THR A 68 1.725 -14.877 13.143 1.00 0.00 N ATOM 1079 CA THR A 68 2.529 -13.703 12.759 1.00 0.00 C ATOM 1080 C THR A 68 2.889 -13.811 11.264 1.00 0.00 C ATOM 1081 O THR A 68 2.937 -14.912 10.725 1.00 0.00 O ATOM 1082 CB THR A 68 3.841 -13.638 13.639 1.00 0.00 C ATOM 1083 OG1 THR A 68 3.495 -13.368 15.004 1.00 0.00 O ATOM 1084 CG2 THR A 68 4.865 -12.584 13.175 1.00 0.00 C ATOM 0 H THR A 68 1.863 -15.672 12.519 1.00 0.00 H new ATOM 0 HA THR A 68 1.957 -12.791 12.928 1.00 0.00 H new ATOM 0 HB THR A 68 4.318 -14.612 13.528 1.00 0.00 H new ATOM 0 HG1 THR A 68 4.310 -13.330 15.547 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.734 -12.606 13.833 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.177 -12.805 12.154 1.00 0.00 H new ATOM 0 HG23 THR A 68 4.409 -11.594 13.209 1.00 0.00 H new ATOM 1092 N ARG A 69 3.111 -12.663 10.597 1.00 0.00 N ATOM 1093 CA ARG A 69 3.687 -12.623 9.240 1.00 0.00 C ATOM 1094 C ARG A 69 4.640 -11.423 9.111 1.00 0.00 C ATOM 1095 O ARG A 69 4.359 -10.345 9.643 1.00 0.00 O ATOM 1096 CB ARG A 69 2.583 -12.569 8.150 1.00 0.00 C ATOM 1097 CG ARG A 69 1.648 -11.342 8.235 1.00 0.00 C ATOM 1098 CD ARG A 69 0.747 -11.190 7.004 1.00 0.00 C ATOM 1099 NE ARG A 69 -0.095 -12.373 6.762 1.00 0.00 N ATOM 1100 CZ ARG A 69 -1.276 -12.367 6.141 1.00 0.00 C ATOM 1101 NH1 ARG A 69 -1.791 -11.227 5.678 1.00 0.00 N ATOM 1102 NH2 ARG A 69 -1.927 -13.515 5.965 1.00 0.00 N ATOM 0 H ARG A 69 2.898 -11.742 10.981 1.00 0.00 H new ATOM 0 HA ARG A 69 4.250 -13.543 9.083 1.00 0.00 H new ATOM 0 HB2 ARG A 69 3.059 -12.578 7.170 1.00 0.00 H new ATOM 0 HB3 ARG A 69 1.979 -13.474 8.219 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.026 -11.427 9.126 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.250 -10.441 8.352 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.109 -10.316 7.133 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.367 -11.006 6.127 1.00 0.00 H new ATOM 0 HE ARG A 69 0.253 -13.271 7.097 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -1.281 -10.352 5.798 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -2.694 -11.231 5.204 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -1.522 -14.388 6.304 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -2.830 -13.522 5.492 1.00 0.00 H new ATOM 1116 N VAL A 70 5.791 -11.626 8.437 1.00 0.00 N ATOM 1117 CA VAL A 70 6.731 -10.535 8.123 1.00 0.00 C ATOM 1118 C VAL A 70 6.737 -10.315 6.595 1.00 0.00 C ATOM 1119 O VAL A 70 7.149 -11.171 5.811 1.00 0.00 O ATOM 1120 CB VAL A 70 8.184 -10.771 8.726 1.00 0.00 C ATOM 1121 CG1 VAL A 70 8.102 -11.001 10.253 1.00 0.00 C ATOM 1122 CG2 VAL A 70 8.951 -11.925 8.050 1.00 0.00 C ATOM 0 H VAL A 70 6.091 -12.541 8.099 1.00 0.00 H new ATOM 0 HA VAL A 70 6.389 -9.622 8.610 1.00 0.00 H new ATOM 0 HB VAL A 70 8.752 -9.864 8.520 1.00 0.00 H new ATOM 0 HG11 VAL A 70 9.104 -11.161 10.651 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.658 -10.127 10.729 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.487 -11.877 10.456 1.00 0.00 H new ATOM 0 HG21 VAL A 70 9.933 -12.029 8.511 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.393 -12.853 8.172 1.00 0.00 H new ATOM 0 HG23 VAL A 70 9.070 -11.710 6.988 1.00 0.00 H new ATOM 1132 N ILE A 71 6.201 -9.167 6.186 1.00 0.00 N ATOM 1133 CA ILE A 71 6.060 -8.799 4.766 1.00 0.00 C ATOM 1134 C ILE A 71 7.194 -7.837 4.354 1.00 0.00 C ATOM 1135 O ILE A 71 7.586 -6.948 5.122 1.00 0.00 O ATOM 1136 CB ILE A 71 4.630 -8.188 4.470 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.509 -7.711 2.983 1.00 0.00 C ATOM 1138 CG2 ILE A 71 4.267 -7.064 5.469 1.00 0.00 C ATOM 1139 CD1 ILE A 71 3.122 -7.250 2.576 1.00 0.00 C ATOM 0 H ILE A 71 5.848 -8.458 6.828 1.00 0.00 H new ATOM 0 HA ILE A 71 6.146 -9.701 4.161 1.00 0.00 H new ATOM 0 HB ILE A 71 3.900 -8.984 4.614 1.00 0.00 H new ATOM 0 HG12 ILE A 71 5.211 -6.894 2.820 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.812 -8.528 2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 71 3.278 -6.671 5.231 1.00 0.00 H new ATOM 0 HG22 ILE A 71 4.264 -7.465 6.483 1.00 0.00 H new ATOM 0 HG23 ILE A 71 5.002 -6.263 5.398 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.134 -6.939 1.532 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.415 -8.070 2.702 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.820 -6.410 3.202 1.00 0.00 H new ATOM 1151 N VAL A 72 7.728 -8.062 3.146 1.00 0.00 N ATOM 1152 CA VAL A 72 8.804 -7.268 2.546 1.00 0.00 C ATOM 1153 C VAL A 72 8.580 -7.206 1.018 1.00 0.00 C ATOM 1154 O VAL A 72 8.860 -8.165 0.294 1.00 0.00 O ATOM 1155 CB VAL A 72 10.233 -7.851 2.925 1.00 0.00 C ATOM 1156 CG1 VAL A 72 10.323 -9.387 2.693 1.00 0.00 C ATOM 1157 CG2 VAL A 72 11.373 -7.094 2.187 1.00 0.00 C ATOM 0 H VAL A 72 7.413 -8.823 2.544 1.00 0.00 H new ATOM 0 HA VAL A 72 8.780 -6.254 2.944 1.00 0.00 H new ATOM 0 HB VAL A 72 10.367 -7.686 3.994 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.318 -9.739 2.966 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.578 -9.892 3.308 1.00 0.00 H new ATOM 0 HG13 VAL A 72 10.136 -9.608 1.642 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.336 -7.520 2.471 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.236 -7.191 1.110 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.347 -6.040 2.462 1.00 0.00 H new ATOM 1167 N GLY A 73 8.005 -6.085 0.549 1.00 0.00 N ATOM 1168 CA GLY A 73 7.748 -5.876 -0.880 1.00 0.00 C ATOM 1169 C GLY A 73 6.743 -6.875 -1.459 1.00 0.00 C ATOM 1170 O GLY A 73 5.618 -6.983 -0.958 1.00 0.00 O ATOM 0 H GLY A 73 7.710 -5.310 1.143 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.374 -4.863 -1.032 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.687 -5.955 -1.428 1.00 0.00 H new ATOM 1174 N ASN A 74 7.180 -7.645 -2.475 1.00 0.00 N ATOM 1175 CA ASN A 74 6.316 -8.603 -3.206 1.00 0.00 C ATOM 1176 C ASN A 74 6.249 -9.990 -2.524 1.00 0.00 C ATOM 1177 O ASN A 74 5.575 -10.890 -3.028 1.00 0.00 O ATOM 1178 CB ASN A 74 6.788 -8.771 -4.680 1.00 0.00 C ATOM 1179 CG ASN A 74 8.167 -9.442 -4.825 1.00 0.00 C ATOM 1180 OD1 ASN A 74 9.076 -9.221 -4.020 1.00 0.00 O ATOM 1181 ND2 ASN A 74 8.323 -10.293 -5.834 1.00 0.00 N ATOM 0 H ASN A 74 8.142 -7.623 -2.815 1.00 0.00 H new ATOM 0 HA ASN A 74 5.313 -8.176 -3.191 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.049 -9.362 -5.222 1.00 0.00 H new ATOM 0 HB3 ASN A 74 6.821 -7.790 -5.154 1.00 0.00 H new ATOM 0 HD21 ASN A 74 9.210 -10.781 -5.957 1.00 0.00 H new ATOM 0 HD22 ASN A 74 7.556 -10.458 -6.485 1.00 0.00 H new ATOM 1188 N VAL A 75 6.911 -10.142 -1.371 1.00 0.00 N ATOM 1189 CA VAL A 75 7.060 -11.445 -0.685 1.00 0.00 C ATOM 1190 C VAL A 75 6.649 -11.331 0.800 1.00 0.00 C ATOM 1191 O VAL A 75 7.057 -10.403 1.495 1.00 0.00 O ATOM 1192 CB VAL A 75 8.541 -12.027 -0.855 1.00 0.00 C ATOM 1193 CG1 VAL A 75 9.618 -10.914 -0.909 1.00 0.00 C ATOM 1194 CG2 VAL A 75 8.897 -13.050 0.254 1.00 0.00 C ATOM 0 H VAL A 75 7.361 -9.369 -0.881 1.00 0.00 H new ATOM 0 HA VAL A 75 6.385 -12.158 -1.158 1.00 0.00 H new ATOM 0 HB VAL A 75 8.542 -12.542 -1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.603 -11.366 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 75 9.419 -10.256 -1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.591 -10.336 0.015 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.911 -13.418 0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.832 -12.567 1.229 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.198 -13.886 0.216 1.00 0.00 H new ATOM 1204 N VAL A 76 5.818 -12.292 1.264 1.00 0.00 N ATOM 1205 CA VAL A 76 5.406 -12.413 2.675 1.00 0.00 C ATOM 1206 C VAL A 76 5.941 -13.743 3.244 1.00 0.00 C ATOM 1207 O VAL A 76 5.897 -14.767 2.562 1.00 0.00 O ATOM 1208 CB VAL A 76 3.829 -12.385 2.829 1.00 0.00 C ATOM 1209 CG1 VAL A 76 3.386 -12.489 4.311 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.211 -11.129 2.172 1.00 0.00 C ATOM 0 H VAL A 76 5.413 -13.009 0.662 1.00 0.00 H new ATOM 0 HA VAL A 76 5.817 -11.564 3.221 1.00 0.00 H new ATOM 0 HB VAL A 76 3.455 -13.264 2.305 1.00 0.00 H new ATOM 0 HG11 VAL A 76 2.298 -12.466 4.368 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.752 -13.424 4.735 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.797 -11.650 4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 76 2.129 -11.147 2.299 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.617 -10.234 2.644 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.451 -11.119 1.109 1.00 0.00 H new ATOM 1220 N ILE A 77 6.439 -13.706 4.493 1.00 0.00 N ATOM 1221 CA ILE A 77 6.682 -14.907 5.306 1.00 0.00 C ATOM 1222 C ILE A 77 5.455 -15.044 6.204 1.00 0.00 C ATOM 1223 O ILE A 77 5.293 -14.281 7.158 1.00 0.00 O ATOM 1224 CB ILE A 77 7.990 -14.751 6.184 1.00 0.00 C ATOM 1225 CG1 ILE A 77 9.279 -14.808 5.309 1.00 0.00 C ATOM 1226 CG2 ILE A 77 8.067 -15.775 7.359 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.677 -16.203 4.868 1.00 0.00 C ATOM 0 H ILE A 77 6.685 -12.837 4.967 1.00 0.00 H new ATOM 0 HA ILE A 77 6.834 -15.785 4.678 1.00 0.00 H new ATOM 0 HB ILE A 77 7.928 -13.762 6.638 1.00 0.00 H new ATOM 0 HG12 ILE A 77 9.130 -14.189 4.424 1.00 0.00 H new ATOM 0 HG13 ILE A 77 10.104 -14.369 5.870 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.987 -15.615 7.922 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.210 -15.638 8.018 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.058 -16.789 6.959 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.583 -16.149 4.265 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.862 -16.823 5.745 1.00 0.00 H new ATOM 0 HD13 ILE A 77 8.873 -16.641 4.277 1.00 0.00 H new ATOM 1239 N ASP A 78 4.572 -15.975 5.848 1.00 0.00 N ATOM 1240 CA ASP A 78 3.313 -16.197 6.559 1.00 0.00 C ATOM 1241 C ASP A 78 3.542 -17.336 7.565 1.00 0.00 C ATOM 1242 O ASP A 78 3.671 -18.491 7.174 1.00 0.00 O ATOM 1243 CB ASP A 78 2.206 -16.525 5.509 1.00 0.00 C ATOM 1244 CG ASP A 78 0.774 -16.407 6.048 1.00 0.00 C ATOM 1245 OD1 ASP A 78 0.379 -15.277 6.424 1.00 0.00 O ATOM 1246 OD2 ASP A 78 0.031 -17.411 6.073 1.00 0.00 O ATOM 0 H ASP A 78 4.710 -16.600 5.054 1.00 0.00 H new ATOM 0 HA ASP A 78 2.983 -15.318 7.113 1.00 0.00 H new ATOM 0 HB2 ASP A 78 2.318 -15.854 4.657 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.361 -17.538 5.139 1.00 0.00 H new ATOM 1251 N HIS A 79 3.671 -16.980 8.860 1.00 0.00 N ATOM 1252 CA HIS A 79 4.034 -17.944 9.922 1.00 0.00 C ATOM 1253 C HIS A 79 2.775 -18.383 10.679 1.00 0.00 C ATOM 1254 O HIS A 79 2.205 -17.630 11.484 1.00 0.00 O ATOM 1255 CB HIS A 79 5.071 -17.336 10.912 1.00 0.00 C ATOM 1256 CG HIS A 79 5.407 -18.220 12.099 1.00 0.00 C ATOM 1257 ND1 HIS A 79 5.280 -19.594 12.088 1.00 0.00 N ATOM 1258 CD2 HIS A 79 5.865 -17.911 13.333 1.00 0.00 C ATOM 1259 CE1 HIS A 79 5.623 -20.080 13.251 1.00 0.00 C ATOM 1260 NE2 HIS A 79 5.991 -19.085 14.031 1.00 0.00 N ATOM 0 H HIS A 79 3.529 -16.028 9.197 1.00 0.00 H new ATOM 0 HA HIS A 79 4.494 -18.812 9.449 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.989 -17.118 10.367 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.687 -16.385 11.281 1.00 0.00 H new ATOM 0 HD1 HIS A 79 4.965 -20.147 11.291 1.00 0.00 H new ATOM 0 HD2 HIS A 79 6.090 -16.921 13.702 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.607 -21.124 13.527 1.00 0.00 H new ATOM 1269 N GLU A 80 2.393 -19.628 10.426 1.00 0.00 N ATOM 1270 CA GLU A 80 1.196 -20.263 10.978 1.00 0.00 C ATOM 1271 C GLU A 80 1.578 -21.549 11.730 1.00 0.00 C ATOM 1272 O GLU A 80 2.726 -22.011 11.678 1.00 0.00 O ATOM 1273 CB GLU A 80 0.136 -20.555 9.838 1.00 0.00 C ATOM 1274 CG GLU A 80 0.698 -20.687 8.391 1.00 0.00 C ATOM 1275 CD GLU A 80 1.847 -21.711 8.228 1.00 0.00 C ATOM 1276 OE1 GLU A 80 1.629 -22.915 8.463 1.00 0.00 O ATOM 1277 OE2 GLU A 80 2.979 -21.305 7.876 1.00 0.00 O ATOM 0 H GLU A 80 2.923 -20.246 9.812 1.00 0.00 H new ATOM 0 HA GLU A 80 0.732 -19.578 11.688 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.389 -21.477 10.087 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.604 -19.755 9.846 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.117 -20.969 7.725 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.053 -19.710 8.064 1.00 0.00 H new ATOM 1284 N THR A 81 0.601 -22.074 12.471 1.00 0.00 N ATOM 1285 CA THR A 81 0.660 -23.399 13.076 1.00 0.00 C ATOM 1286 C THR A 81 -0.471 -24.238 12.464 1.00 0.00 C ATOM 1287 O THR A 81 -1.652 -24.017 12.782 1.00 0.00 O ATOM 1288 CB THR A 81 0.492 -23.337 14.631 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.425 -22.413 15.190 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.704 -24.712 15.275 1.00 0.00 C ATOM 0 H THR A 81 -0.268 -21.578 12.669 1.00 0.00 H new ATOM 0 HA THR A 81 1.636 -23.843 12.878 1.00 0.00 H new ATOM 0 HB THR A 81 -0.527 -23.009 14.837 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.227 -22.894 15.483 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.580 -24.631 16.355 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.027 -25.417 14.877 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.710 -25.067 15.051 1.00 0.00 H new ATOM 1298 N VAL A 82 -0.123 -25.154 11.545 1.00 0.00 N ATOM 1299 CA VAL A 82 -1.114 -26.015 10.883 1.00 0.00 C ATOM 1300 C VAL A 82 -1.312 -27.329 11.644 1.00 0.00 C ATOM 1301 O VAL A 82 -0.354 -28.054 11.932 1.00 0.00 O ATOM 1302 CB VAL A 82 -0.764 -26.292 9.375 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -0.825 -24.977 8.574 1.00 0.00 C ATOM 1304 CG2 VAL A 82 0.605 -26.991 9.203 1.00 0.00 C ATOM 0 H VAL A 82 0.838 -25.316 11.244 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.055 -25.465 10.897 1.00 0.00 H new ATOM 0 HB VAL A 82 -1.510 -26.983 8.983 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.582 -25.175 7.530 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.829 -24.557 8.639 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -0.108 -24.267 8.985 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.797 -27.159 8.143 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.390 -26.360 9.619 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.593 -27.948 9.725 1.00 0.00 H new ATOM 1314 N THR A 83 -2.575 -27.598 11.985 1.00 0.00 N ATOM 1315 CA THR A 83 -2.992 -28.827 12.647 1.00 0.00 C ATOM 1316 C THR A 83 -3.042 -29.983 11.632 1.00 0.00 C ATOM 1317 O THR A 83 -3.540 -29.819 10.510 1.00 0.00 O ATOM 1318 CB THR A 83 -4.384 -28.629 13.315 1.00 0.00 C ATOM 1319 OG1 THR A 83 -4.356 -27.479 14.183 1.00 0.00 O ATOM 1320 CG2 THR A 83 -4.838 -29.862 14.115 1.00 0.00 C ATOM 0 H THR A 83 -3.345 -26.955 11.804 1.00 0.00 H new ATOM 0 HA THR A 83 -2.267 -29.076 13.422 1.00 0.00 H new ATOM 0 HB THR A 83 -5.103 -28.477 12.510 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.236 -27.361 14.598 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.814 -29.668 14.559 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.906 -30.723 13.450 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.115 -30.070 14.904 1.00 0.00 H new ATOM 1328 N ARG A 84 -2.471 -31.126 12.028 1.00 0.00 N ATOM 1329 CA ARG A 84 -2.437 -32.368 11.241 1.00 0.00 C ATOM 1330 C ARG A 84 -2.846 -33.512 12.186 1.00 0.00 C ATOM 1331 O ARG A 84 -3.465 -33.249 13.236 1.00 0.00 O ATOM 1332 CB ARG A 84 -1.006 -32.593 10.669 1.00 0.00 C ATOM 1333 CG ARG A 84 -0.481 -31.422 9.810 1.00 0.00 C ATOM 1334 CD ARG A 84 0.982 -31.586 9.392 1.00 0.00 C ATOM 1335 NE ARG A 84 1.429 -30.468 8.543 1.00 0.00 N ATOM 1336 CZ ARG A 84 2.468 -30.508 7.707 1.00 0.00 C ATOM 1337 NH1 ARG A 84 3.179 -31.619 7.568 1.00 0.00 N ATOM 1338 NH2 ARG A 84 2.784 -29.434 7.001 1.00 0.00 N ATOM 0 H ARG A 84 -2.006 -31.217 12.931 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.120 -32.321 10.393 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.317 -32.760 11.497 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.006 -33.501 10.066 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.099 -31.330 8.917 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.590 -30.493 10.369 1.00 0.00 H new ATOM 0 HD2 ARG A 84 1.611 -31.644 10.280 1.00 0.00 H new ATOM 0 HD3 ARG A 84 1.104 -32.525 8.853 1.00 0.00 H new ATOM 0 HE ARG A 84 0.903 -29.596 8.599 1.00 0.00 H new ATOM 0 HH11 ARG A 84 2.933 -32.452 8.103 1.00 0.00 H new ATOM 0 HH12 ARG A 84 3.972 -31.640 6.926 1.00 0.00 H new ATOM 0 HH21 ARG A 84 2.234 -28.580 7.097 1.00 0.00 H new ATOM 0 HH22 ARG A 84 3.578 -29.460 6.361 1.00 0.00 H new ATOM 1352 N ASN A 85 -2.524 -34.773 11.843 1.00 0.00 N ATOM 1353 CA ASN A 85 -2.768 -35.909 12.754 1.00 0.00 C ATOM 1354 C ASN A 85 -1.491 -36.744 12.913 1.00 0.00 C ATOM 1355 O ASN A 85 -1.081 -37.461 11.992 1.00 0.00 O ATOM 1356 CB ASN A 85 -3.937 -36.785 12.253 1.00 0.00 C ATOM 1357 CG ASN A 85 -4.441 -37.744 13.324 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -4.017 -38.896 13.403 1.00 0.00 O ATOM 1359 ND2 ASN A 85 -5.320 -37.250 14.182 1.00 0.00 N ATOM 0 H ASN A 85 -2.099 -35.030 10.952 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.048 -35.511 13.729 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.756 -36.143 11.929 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.614 -37.354 11.381 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -5.671 -37.830 14.944 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -5.646 -36.289 14.081 1.00 0.00 H new ATOM 1366 N PHE A 86 -0.844 -36.603 14.080 1.00 0.00 N ATOM 1367 CA PHE A 86 0.320 -37.411 14.479 1.00 0.00 C ATOM 1368 C PHE A 86 -0.138 -38.413 15.554 1.00 0.00 C ATOM 1369 O PHE A 86 -0.853 -38.014 16.481 1.00 0.00 O ATOM 1370 CB PHE A 86 1.454 -36.499 15.034 1.00 0.00 C ATOM 1371 CG PHE A 86 2.143 -35.561 14.028 1.00 0.00 C ATOM 1372 CD1 PHE A 86 1.803 -35.531 12.674 1.00 0.00 C ATOM 1373 CD2 PHE A 86 3.146 -34.697 14.465 1.00 0.00 C ATOM 1374 CE1 PHE A 86 2.438 -34.671 11.798 1.00 0.00 C ATOM 1375 CE2 PHE A 86 3.782 -33.839 13.589 1.00 0.00 C ATOM 1376 CZ PHE A 86 3.428 -33.826 12.255 1.00 0.00 C ATOM 0 H PHE A 86 -1.118 -35.916 14.783 1.00 0.00 H new ATOM 0 HA PHE A 86 0.717 -37.944 13.615 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.038 -35.890 15.837 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.216 -37.138 15.480 1.00 0.00 H new ATOM 0 HD1 PHE A 86 1.031 -36.191 12.305 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.431 -34.699 15.507 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.159 -34.661 10.755 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.557 -33.178 13.948 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.925 -33.155 11.570 1.00 0.00 H new ATOM 1386 N PRO A 87 0.268 -39.725 15.464 1.00 0.00 N ATOM 1387 CA PRO A 87 -0.227 -40.791 16.381 1.00 0.00 C ATOM 1388 C PRO A 87 0.134 -40.543 17.865 1.00 0.00 C ATOM 1389 O PRO A 87 -0.530 -41.081 18.761 1.00 0.00 O ATOM 1390 CB PRO A 87 0.446 -42.081 15.831 1.00 0.00 C ATOM 1391 CG PRO A 87 1.658 -41.586 15.103 1.00 0.00 C ATOM 1392 CD PRO A 87 1.235 -40.280 14.476 1.00 0.00 C ATOM 0 HA PRO A 87 -1.316 -40.841 16.391 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.717 -42.763 16.637 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.223 -42.626 15.165 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.496 -41.442 15.785 1.00 0.00 H new ATOM 0 HG3 PRO A 87 1.982 -42.300 14.346 1.00 0.00 H new ATOM 0 HD2 PRO A 87 2.083 -39.613 14.325 1.00 0.00 H new ATOM 0 HD3 PRO A 87 0.772 -40.433 13.501 1.00 0.00 H new ATOM 1400 N GLU A 88 1.169 -39.709 18.110 1.00 0.00 N ATOM 1401 CA GLU A 88 1.640 -39.388 19.476 1.00 0.00 C ATOM 1402 C GLU A 88 0.679 -38.420 20.198 1.00 0.00 C ATOM 1403 O GLU A 88 0.634 -38.413 21.434 1.00 0.00 O ATOM 1404 CB GLU A 88 3.098 -38.814 19.479 1.00 0.00 C ATOM 1405 CG GLU A 88 3.362 -37.604 18.527 1.00 0.00 C ATOM 1406 CD GLU A 88 4.042 -37.997 17.195 1.00 0.00 C ATOM 1407 OE1 GLU A 88 3.460 -38.791 16.437 1.00 0.00 O ATOM 1408 OE2 GLU A 88 5.159 -37.516 16.905 1.00 0.00 O ATOM 0 H GLU A 88 1.698 -39.243 17.373 1.00 0.00 H new ATOM 0 HA GLU A 88 1.653 -40.329 20.025 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.345 -38.510 20.496 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.784 -39.618 19.211 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.415 -37.111 18.309 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.988 -36.877 19.044 1.00 0.00 H new ATOM 1415 N GLY A 89 -0.080 -37.603 19.433 1.00 0.00 N ATOM 1416 CA GLY A 89 -1.063 -36.692 20.032 1.00 0.00 C ATOM 1417 C GLY A 89 -1.872 -35.933 18.990 1.00 0.00 C ATOM 1418 O GLY A 89 -2.584 -36.552 18.195 1.00 0.00 O ATOM 0 H GLY A 89 -0.028 -37.560 18.415 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.741 -37.262 20.667 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.547 -35.979 20.675 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.783 -34.588 19.026 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.463 -33.705 18.076 1.00 0.00 C ATOM 1424 C LYS A 90 -1.799 -33.761 16.685 1.00 0.00 C ATOM 1425 O LYS A 90 -2.272 -34.485 15.803 1.00 0.00 O ATOM 1426 CB LYS A 90 -2.505 -32.267 18.669 1.00 0.00 C ATOM 1427 CG LYS A 90 -3.178 -31.188 17.788 1.00 0.00 C ATOM 1428 CD LYS A 90 -4.598 -31.561 17.307 1.00 0.00 C ATOM 1429 CE LYS A 90 -5.545 -32.010 18.435 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.932 -32.196 17.953 1.00 0.00 N ATOM 0 H LYS A 90 -1.232 -34.087 19.723 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.489 -34.042 17.925 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.028 -32.305 19.625 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.483 -31.952 18.877 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.230 -30.256 18.350 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.549 -31.001 16.918 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -5.036 -30.701 16.800 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.522 -32.361 16.570 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.182 -32.944 18.863 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.535 -31.268 19.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.537 -32.498 18.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.289 -31.298 17.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.946 -32.922 17.209 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.689 -33.021 16.503 1.00 0.00 N ATOM 1445 CA GLY A 91 0.032 -33.007 15.230 1.00 0.00 C ATOM 1446 C GLY A 91 0.122 -31.633 14.595 1.00 0.00 C ATOM 1447 O GLY A 91 0.265 -31.520 13.374 1.00 0.00 O ATOM 0 H GLY A 91 -0.278 -32.428 17.224 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.040 -33.391 15.389 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.462 -33.687 14.536 1.00 0.00 H new ATOM 1451 N GLU A 92 0.082 -30.585 15.425 1.00 0.00 N ATOM 1452 CA GLU A 92 0.111 -29.191 14.947 1.00 0.00 C ATOM 1453 C GLU A 92 1.577 -28.733 14.883 1.00 0.00 C ATOM 1454 O GLU A 92 2.361 -29.016 15.791 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.774 -28.259 15.858 1.00 0.00 C ATOM 1456 CG GLU A 92 -0.122 -27.676 17.148 1.00 0.00 C ATOM 1457 CD GLU A 92 0.323 -28.690 18.224 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -0.162 -29.848 18.245 1.00 0.00 O ATOM 1459 OE2 GLU A 92 1.135 -28.300 19.090 1.00 0.00 O ATOM 0 H GLU A 92 0.029 -30.673 16.440 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.321 -29.126 13.948 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.118 -27.423 15.249 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.659 -28.822 16.155 1.00 0.00 H new ATOM 0 HG2 GLU A 92 0.748 -27.090 16.853 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.831 -26.986 17.605 1.00 0.00 H new ATOM 1466 N VAL A 93 1.969 -28.097 13.770 1.00 0.00 N ATOM 1467 CA VAL A 93 3.379 -27.755 13.509 1.00 0.00 C ATOM 1468 C VAL A 93 3.515 -26.284 13.096 1.00 0.00 C ATOM 1469 O VAL A 93 2.728 -25.781 12.289 1.00 0.00 O ATOM 1470 CB VAL A 93 4.012 -28.715 12.417 1.00 0.00 C ATOM 1471 CG1 VAL A 93 4.017 -30.186 12.906 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.281 -28.614 11.058 1.00 0.00 C ATOM 0 H VAL A 93 1.328 -27.807 13.032 1.00 0.00 H new ATOM 0 HA VAL A 93 3.935 -27.899 14.435 1.00 0.00 H new ATOM 0 HB VAL A 93 5.040 -28.386 12.269 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.456 -30.823 12.138 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.604 -30.263 13.821 1.00 0.00 H new ATOM 0 HG13 VAL A 93 2.994 -30.507 13.103 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.749 -29.289 10.342 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.234 -28.890 11.186 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.343 -27.591 10.687 1.00 0.00 H new ATOM 1482 N ASP A 94 4.507 -25.605 13.693 1.00 0.00 N ATOM 1483 CA ASP A 94 4.885 -24.229 13.326 1.00 0.00 C ATOM 1484 C ASP A 94 5.677 -24.276 12.017 1.00 0.00 C ATOM 1485 O ASP A 94 6.723 -24.918 11.961 1.00 0.00 O ATOM 1486 CB ASP A 94 5.736 -23.561 14.454 1.00 0.00 C ATOM 1487 CG ASP A 94 4.897 -22.985 15.615 1.00 0.00 C ATOM 1488 OD1 ASP A 94 3.990 -23.685 16.107 1.00 0.00 O ATOM 1489 OD2 ASP A 94 5.144 -21.829 16.043 1.00 0.00 O ATOM 0 H ASP A 94 5.072 -25.995 14.447 1.00 0.00 H new ATOM 0 HA ASP A 94 3.985 -23.628 13.197 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.433 -24.297 14.854 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.333 -22.760 14.018 1.00 0.00 H new ATOM 1494 N VAL A 95 5.129 -23.650 10.967 1.00 0.00 N ATOM 1495 CA VAL A 95 5.733 -23.582 9.621 1.00 0.00 C ATOM 1496 C VAL A 95 5.879 -22.098 9.216 1.00 0.00 C ATOM 1497 O VAL A 95 5.210 -21.228 9.778 1.00 0.00 O ATOM 1498 CB VAL A 95 4.823 -24.332 8.560 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.517 -24.505 7.189 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.302 -25.686 9.096 1.00 0.00 C ATOM 0 H VAL A 95 4.234 -23.165 11.026 1.00 0.00 H new ATOM 0 HA VAL A 95 6.709 -24.067 9.643 1.00 0.00 H new ATOM 0 HB VAL A 95 3.961 -23.685 8.398 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.846 -25.024 6.505 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.765 -23.525 6.780 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.430 -25.087 7.314 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.684 -26.164 8.336 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.147 -26.332 9.336 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.708 -25.517 9.994 1.00 0.00 H new ATOM 1510 N ALA A 96 6.772 -21.823 8.264 1.00 0.00 N ATOM 1511 CA ALA A 96 6.883 -20.518 7.603 1.00 0.00 C ATOM 1512 C ALA A 96 6.599 -20.727 6.112 1.00 0.00 C ATOM 1513 O ALA A 96 7.461 -21.225 5.374 1.00 0.00 O ATOM 1514 CB ALA A 96 8.277 -19.906 7.838 1.00 0.00 C ATOM 0 H ALA A 96 7.448 -22.508 7.925 1.00 0.00 H new ATOM 0 HA ALA A 96 6.162 -19.814 8.018 1.00 0.00 H new ATOM 0 HB1 ALA A 96 8.338 -18.939 7.339 1.00 0.00 H new ATOM 0 HB2 ALA A 96 8.441 -19.774 8.908 1.00 0.00 H new ATOM 0 HB3 ALA A 96 9.039 -20.572 7.433 1.00 0.00 H new ATOM 1520 N CYS A 97 5.368 -20.412 5.688 1.00 0.00 N ATOM 1521 CA CYS A 97 4.945 -20.542 4.291 1.00 0.00 C ATOM 1522 C CYS A 97 5.123 -19.184 3.594 1.00 0.00 C ATOM 1523 O CYS A 97 4.391 -18.228 3.859 1.00 0.00 O ATOM 1524 CB CYS A 97 3.484 -21.032 4.219 1.00 0.00 C ATOM 1525 SG CYS A 97 3.247 -22.704 4.872 1.00 0.00 S ATOM 0 H CYS A 97 4.638 -20.059 6.307 1.00 0.00 H new ATOM 0 HA CYS A 97 5.559 -21.283 3.778 1.00 0.00 H new ATOM 0 HB2 CYS A 97 2.850 -20.341 4.774 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.152 -21.006 3.181 1.00 0.00 H new ATOM 0 HG CYS A 97 3.255 -22.667 6.171 1.00 0.00 H new ATOM 1531 N ILE A 98 6.136 -19.112 2.727 1.00 0.00 N ATOM 1532 CA ILE A 98 6.506 -17.893 1.996 1.00 0.00 C ATOM 1533 C ILE A 98 5.861 -17.918 0.602 1.00 0.00 C ATOM 1534 O ILE A 98 5.835 -18.957 -0.062 1.00 0.00 O ATOM 1535 CB ILE A 98 8.090 -17.741 1.947 1.00 0.00 C ATOM 1536 CG1 ILE A 98 8.588 -16.468 1.164 1.00 0.00 C ATOM 1537 CG2 ILE A 98 8.786 -19.017 1.432 1.00 0.00 C ATOM 1538 CD1 ILE A 98 8.684 -16.577 -0.358 1.00 0.00 C ATOM 0 H ILE A 98 6.733 -19.910 2.508 1.00 0.00 H new ATOM 0 HA ILE A 98 6.127 -17.012 2.513 1.00 0.00 H new ATOM 0 HB ILE A 98 8.385 -17.592 2.986 1.00 0.00 H new ATOM 0 HG12 ILE A 98 7.918 -15.642 1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 98 9.573 -16.200 1.546 1.00 0.00 H new ATOM 0 HG21 ILE A 98 9.865 -18.862 1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.548 -19.852 2.091 1.00 0.00 H new ATOM 0 HG23 ILE A 98 8.438 -19.240 0.423 1.00 0.00 H new ATOM 0 HD11 ILE A 98 9.039 -15.632 -0.769 1.00 0.00 H new ATOM 0 HD12 ILE A 98 9.381 -17.372 -0.623 1.00 0.00 H new ATOM 0 HD13 ILE A 98 7.701 -16.805 -0.769 1.00 0.00 H new ATOM 1550 N TYR A 99 5.334 -16.761 0.168 1.00 0.00 N ATOM 1551 CA TYR A 99 4.749 -16.583 -1.173 1.00 0.00 C ATOM 1552 C TYR A 99 5.397 -15.368 -1.842 1.00 0.00 C ATOM 1553 O TYR A 99 5.333 -14.256 -1.300 1.00 0.00 O ATOM 1554 CB TYR A 99 3.209 -16.388 -1.094 1.00 0.00 C ATOM 1555 CG TYR A 99 2.498 -17.415 -0.192 1.00 0.00 C ATOM 1556 CD1 TYR A 99 2.349 -18.742 -0.595 1.00 0.00 C ATOM 1557 CD2 TYR A 99 1.998 -17.057 1.064 1.00 0.00 C ATOM 1558 CE1 TYR A 99 1.725 -19.671 0.215 1.00 0.00 C ATOM 1559 CE2 TYR A 99 1.371 -17.983 1.879 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.235 -19.287 1.450 1.00 0.00 C ATOM 1561 OH TYR A 99 0.610 -20.217 2.255 1.00 0.00 O ATOM 0 H TYR A 99 5.301 -15.917 0.741 1.00 0.00 H new ATOM 0 HA TYR A 99 4.941 -17.480 -1.762 1.00 0.00 H new ATOM 0 HB2 TYR A 99 2.998 -15.385 -0.723 1.00 0.00 H new ATOM 0 HB3 TYR A 99 2.792 -16.451 -2.099 1.00 0.00 H new ATOM 0 HD1 TYR A 99 2.729 -19.049 -1.558 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.103 -16.038 1.405 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.620 -20.694 -0.115 1.00 0.00 H new ATOM 0 HE2 TYR A 99 0.990 -17.687 2.845 1.00 0.00 H new ATOM 0 HH TYR A 99 0.324 -19.789 3.089 1.00 0.00 H new ATOM 1571 N GLU A 100 6.047 -15.592 -2.992 1.00 0.00 N ATOM 1572 CA GLU A 100 6.574 -14.518 -3.840 1.00 0.00 C ATOM 1573 C GLU A 100 5.561 -14.233 -4.958 1.00 0.00 C ATOM 1574 O GLU A 100 5.314 -15.074 -5.839 1.00 0.00 O ATOM 1575 CB GLU A 100 7.947 -14.912 -4.434 1.00 0.00 C ATOM 1576 CG GLU A 100 8.648 -13.792 -5.231 1.00 0.00 C ATOM 1577 CD GLU A 100 9.998 -14.211 -5.843 1.00 0.00 C ATOM 1578 OE1 GLU A 100 10.845 -14.750 -5.101 1.00 0.00 O ATOM 1579 OE2 GLU A 100 10.219 -14.013 -7.063 1.00 0.00 O ATOM 0 H GLU A 100 6.222 -16.527 -3.360 1.00 0.00 H new ATOM 0 HA GLU A 100 6.722 -13.619 -3.241 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.602 -15.227 -3.622 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.812 -15.774 -5.087 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.986 -13.459 -6.030 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.808 -12.938 -4.574 1.00 0.00 H new ATOM 1586 N VAL A 101 4.969 -13.042 -4.884 1.00 0.00 N ATOM 1587 CA VAL A 101 3.896 -12.577 -5.766 1.00 0.00 C ATOM 1588 C VAL A 101 4.492 -11.746 -6.919 1.00 0.00 C ATOM 1589 O VAL A 101 5.411 -10.948 -6.720 1.00 0.00 O ATOM 1590 CB VAL A 101 2.845 -11.731 -4.943 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.649 -11.266 -5.814 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.344 -12.530 -3.714 1.00 0.00 C ATOM 0 H VAL A 101 5.232 -12.348 -4.184 1.00 0.00 H new ATOM 0 HA VAL A 101 3.380 -13.437 -6.192 1.00 0.00 H new ATOM 0 HB VAL A 101 3.358 -10.833 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.956 -10.689 -5.202 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.014 -10.645 -6.632 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.135 -12.137 -6.221 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.621 -11.931 -3.160 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.870 -13.453 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.188 -12.770 -3.067 1.00 0.00 H new ATOM 1602 N GLU A 102 3.947 -11.952 -8.120 1.00 0.00 N ATOM 1603 CA GLU A 102 4.423 -11.337 -9.369 1.00 0.00 C ATOM 1604 C GLU A 102 3.216 -10.708 -10.093 1.00 0.00 C ATOM 1605 O GLU A 102 2.404 -11.425 -10.691 1.00 0.00 O ATOM 1606 CB GLU A 102 5.102 -12.422 -10.258 1.00 0.00 C ATOM 1607 CG GLU A 102 5.810 -11.925 -11.534 1.00 0.00 C ATOM 1608 CD GLU A 102 7.064 -11.080 -11.257 1.00 0.00 C ATOM 1609 OE1 GLU A 102 8.174 -11.662 -11.152 1.00 0.00 O ATOM 1610 OE2 GLU A 102 6.955 -9.837 -11.156 1.00 0.00 O ATOM 0 H GLU A 102 3.143 -12.565 -8.258 1.00 0.00 H new ATOM 0 HA GLU A 102 5.160 -10.561 -9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 102 5.832 -12.954 -9.648 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.342 -13.147 -10.550 1.00 0.00 H new ATOM 0 HG2 GLU A 102 6.090 -12.785 -12.142 1.00 0.00 H new ATOM 0 HG3 GLU A 102 5.107 -11.334 -12.122 1.00 0.00 H new ATOM 1617 N ASN A 103 3.075 -9.374 -9.955 1.00 0.00 N ATOM 1618 CA ASN A 103 2.006 -8.561 -10.598 1.00 0.00 C ATOM 1619 C ASN A 103 0.585 -9.019 -10.169 1.00 0.00 C ATOM 1620 O ASN A 103 -0.378 -8.913 -10.941 1.00 0.00 O ATOM 1621 CB ASN A 103 2.162 -8.550 -12.152 1.00 0.00 C ATOM 1622 CG ASN A 103 3.547 -8.073 -12.605 1.00 0.00 C ATOM 1623 OD1 ASN A 103 3.781 -6.885 -12.825 1.00 0.00 O ATOM 1624 ND2 ASN A 103 4.472 -9.009 -12.733 1.00 0.00 N ATOM 0 H ASN A 103 3.709 -8.815 -9.384 1.00 0.00 H new ATOM 0 HA ASN A 103 2.125 -7.537 -10.245 1.00 0.00 H new ATOM 0 HB2 ASN A 103 1.984 -9.554 -12.538 1.00 0.00 H new ATOM 0 HB3 ASN A 103 1.400 -7.902 -12.585 1.00 0.00 H new ATOM 0 HD21 ASN A 103 5.417 -8.756 -13.023 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.241 -9.984 -12.542 1.00 0.00 H new ATOM 1631 N GLY A 104 0.466 -9.498 -8.915 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.829 -9.908 -8.341 1.00 0.00 C ATOM 1633 C GLY A 104 -1.053 -11.423 -8.308 1.00 0.00 C ATOM 1634 O GLY A 104 -2.039 -11.892 -7.719 1.00 0.00 O ATOM 0 H GLY A 104 1.255 -9.610 -8.279 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.902 -9.520 -7.325 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.631 -9.446 -8.917 1.00 0.00 H new ATOM 1638 N ARG A 105 -0.142 -12.202 -8.936 1.00 0.00 N ATOM 1639 CA ARG A 105 -0.245 -13.683 -8.990 1.00 0.00 C ATOM 1640 C ARG A 105 1.065 -14.313 -8.505 1.00 0.00 C ATOM 1641 O ARG A 105 2.135 -13.941 -8.966 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.576 -14.180 -10.429 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.933 -13.698 -10.982 1.00 0.00 C ATOM 1644 CD ARG A 105 -3.127 -14.182 -10.141 1.00 0.00 C ATOM 1645 NE ARG A 105 -4.390 -13.557 -10.571 1.00 0.00 N ATOM 1646 CZ ARG A 105 -5.167 -12.761 -9.814 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -4.821 -12.433 -8.568 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -6.283 -12.275 -10.321 1.00 0.00 N ATOM 0 H ARG A 105 0.677 -11.829 -9.415 1.00 0.00 H new ATOM 0 HA ARG A 105 -1.061 -13.989 -8.335 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.214 -13.849 -11.103 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -0.564 -15.270 -10.434 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.939 -12.609 -11.019 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -2.049 -14.052 -12.006 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -3.212 -15.266 -10.221 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.948 -13.953 -9.090 1.00 0.00 H new ATOM 0 HE ARG A 105 -4.702 -13.744 -11.524 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -3.951 -12.787 -8.170 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -5.426 -11.828 -8.013 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -6.550 -12.503 -11.279 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -6.879 -11.671 -9.756 1.00 0.00 H new ATOM 1662 N ILE A 106 0.945 -15.316 -7.623 1.00 0.00 N ATOM 1663 CA ILE A 106 2.082 -15.958 -6.939 1.00 0.00 C ATOM 1664 C ILE A 106 2.905 -16.789 -7.932 1.00 0.00 C ATOM 1665 O ILE A 106 2.464 -17.844 -8.372 1.00 0.00 O ATOM 1666 CB ILE A 106 1.563 -16.867 -5.769 1.00 0.00 C ATOM 1667 CG1 ILE A 106 0.680 -16.037 -4.792 1.00 0.00 C ATOM 1668 CG2 ILE A 106 2.723 -17.559 -5.013 1.00 0.00 C ATOM 1669 CD1 ILE A 106 -0.022 -16.856 -3.737 1.00 0.00 C ATOM 0 H ILE A 106 0.042 -15.711 -7.359 1.00 0.00 H new ATOM 0 HA ILE A 106 2.724 -15.181 -6.524 1.00 0.00 H new ATOM 0 HB ILE A 106 0.954 -17.657 -6.209 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.306 -15.292 -4.300 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.068 -15.494 -5.370 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.318 -18.178 -4.212 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.286 -18.185 -5.705 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.383 -16.803 -4.588 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.614 -16.199 -3.100 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.677 -17.583 -4.217 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.718 -17.379 -3.130 1.00 0.00 H new ATOM 1681 N ALA A 107 4.088 -16.281 -8.296 1.00 0.00 N ATOM 1682 CA ALA A 107 4.981 -16.942 -9.262 1.00 0.00 C ATOM 1683 C ALA A 107 5.829 -18.029 -8.596 1.00 0.00 C ATOM 1684 O ALA A 107 6.386 -18.890 -9.288 1.00 0.00 O ATOM 1685 CB ALA A 107 5.879 -15.901 -9.937 1.00 0.00 C ATOM 0 H ALA A 107 4.455 -15.402 -7.932 1.00 0.00 H new ATOM 0 HA ALA A 107 4.362 -17.428 -10.016 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.537 -16.396 -10.651 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.261 -15.171 -10.460 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.479 -15.393 -9.182 1.00 0.00 H new ATOM 1691 N LYS A 108 5.950 -17.969 -7.256 1.00 0.00 N ATOM 1692 CA LYS A 108 6.765 -18.909 -6.462 1.00 0.00 C ATOM 1693 C LYS A 108 6.154 -19.008 -5.068 1.00 0.00 C ATOM 1694 O LYS A 108 5.826 -17.983 -4.480 1.00 0.00 O ATOM 1695 CB LYS A 108 8.235 -18.409 -6.330 1.00 0.00 C ATOM 1696 CG LYS A 108 9.042 -18.343 -7.653 1.00 0.00 C ATOM 1697 CD LYS A 108 10.263 -17.409 -7.557 1.00 0.00 C ATOM 1698 CE LYS A 108 10.908 -17.123 -8.919 1.00 0.00 C ATOM 1699 NZ LYS A 108 11.868 -16.001 -8.832 1.00 0.00 N ATOM 0 H LYS A 108 5.482 -17.262 -6.690 1.00 0.00 H new ATOM 0 HA LYS A 108 6.775 -19.878 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.223 -17.415 -5.883 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.762 -19.064 -5.636 1.00 0.00 H new ATOM 0 HG2 LYS A 108 9.376 -19.345 -7.921 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.389 -18.000 -8.456 1.00 0.00 H new ATOM 0 HD2 LYS A 108 9.958 -16.467 -7.101 1.00 0.00 H new ATOM 0 HD3 LYS A 108 11.005 -17.857 -6.897 1.00 0.00 H new ATOM 0 HE2 LYS A 108 11.420 -18.016 -9.276 1.00 0.00 H new ATOM 0 HE3 LYS A 108 10.133 -16.886 -9.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 12.069 -15.642 -9.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 11.460 -15.239 -8.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 12.751 -16.333 -8.394 1.00 0.00 H new ATOM 1713 N ALA A 109 6.003 -20.226 -4.540 1.00 0.00 N ATOM 1714 CA ALA A 109 5.580 -20.432 -3.147 1.00 0.00 C ATOM 1715 C ALA A 109 6.381 -21.576 -2.547 1.00 0.00 C ATOM 1716 O ALA A 109 6.446 -22.659 -3.121 1.00 0.00 O ATOM 1717 CB ALA A 109 4.077 -20.722 -3.084 1.00 0.00 C ATOM 0 H ALA A 109 6.168 -21.090 -5.057 1.00 0.00 H new ATOM 0 HA ALA A 109 5.768 -19.527 -2.570 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.779 -20.872 -2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.526 -19.879 -3.502 1.00 0.00 H new ATOM 0 HB3 ALA A 109 3.855 -21.621 -3.659 1.00 0.00 H new ATOM 1723 N TRP A 110 6.973 -21.339 -1.379 1.00 0.00 N ATOM 1724 CA TRP A 110 7.847 -22.311 -0.701 1.00 0.00 C ATOM 1725 C TRP A 110 7.378 -22.423 0.753 1.00 0.00 C ATOM 1726 O TRP A 110 6.689 -21.526 1.256 1.00 0.00 O ATOM 1727 CB TRP A 110 9.357 -21.866 -0.780 1.00 0.00 C ATOM 1728 CG TRP A 110 9.786 -21.265 -2.112 1.00 0.00 C ATOM 1729 CD1 TRP A 110 9.576 -21.784 -3.355 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.490 -20.031 -2.326 1.00 0.00 C ATOM 1731 NE1 TRP A 110 10.070 -20.950 -4.317 1.00 0.00 N ATOM 1732 CE2 TRP A 110 10.643 -19.869 -3.711 1.00 0.00 C ATOM 1733 CE3 TRP A 110 11.003 -19.053 -1.481 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 11.281 -18.765 -4.267 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 11.631 -17.951 -2.034 1.00 0.00 C ATOM 1736 CH2 TRP A 110 11.763 -17.815 -3.419 1.00 0.00 C ATOM 0 H TRP A 110 6.863 -20.463 -0.868 1.00 0.00 H new ATOM 0 HA TRP A 110 7.782 -23.282 -1.191 1.00 0.00 H new ATOM 0 HB2 TRP A 110 9.546 -21.136 0.007 1.00 0.00 H new ATOM 0 HB3 TRP A 110 9.986 -22.731 -0.570 1.00 0.00 H new ATOM 0 HD1 TRP A 110 9.086 -22.726 -3.552 1.00 0.00 H new ATOM 0 HE1 TRP A 110 10.019 -21.109 -5.323 1.00 0.00 H new ATOM 0 HE3 TRP A 110 10.913 -19.152 -0.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.390 -18.665 -5.337 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 12.026 -17.183 -1.385 1.00 0.00 H new ATOM 0 HH2 TRP A 110 12.255 -16.943 -3.823 1.00 0.00 H new ATOM 1747 N PHE A 111 7.719 -23.517 1.433 1.00 0.00 N ATOM 1748 CA PHE A 111 7.437 -23.658 2.873 1.00 0.00 C ATOM 1749 C PHE A 111 8.593 -24.390 3.548 1.00 0.00 C ATOM 1750 O PHE A 111 9.234 -25.264 2.943 1.00 0.00 O ATOM 1751 CB PHE A 111 6.064 -24.366 3.137 1.00 0.00 C ATOM 1752 CG PHE A 111 6.068 -25.896 3.015 1.00 0.00 C ATOM 1753 CD1 PHE A 111 5.916 -26.528 1.783 1.00 0.00 C ATOM 1754 CD2 PHE A 111 6.233 -26.696 4.152 1.00 0.00 C ATOM 1755 CE1 PHE A 111 5.927 -27.910 1.692 1.00 0.00 C ATOM 1756 CE2 PHE A 111 6.247 -28.067 4.061 1.00 0.00 C ATOM 1757 CZ PHE A 111 6.094 -28.679 2.830 1.00 0.00 C ATOM 0 H PHE A 111 8.190 -24.320 1.017 1.00 0.00 H new ATOM 0 HA PHE A 111 7.350 -22.663 3.309 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.727 -24.101 4.139 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.330 -23.966 2.437 1.00 0.00 H new ATOM 0 HD1 PHE A 111 5.788 -25.934 0.890 1.00 0.00 H new ATOM 0 HD2 PHE A 111 6.351 -26.227 5.118 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.805 -28.388 0.731 1.00 0.00 H new ATOM 0 HE2 PHE A 111 6.377 -28.666 4.950 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.105 -29.756 2.757 1.00 0.00 H new ATOM 1767 N LYS A 112 8.859 -24.016 4.799 1.00 0.00 N ATOM 1768 CA LYS A 112 9.840 -24.690 5.645 1.00 0.00 C ATOM 1769 C LYS A 112 9.254 -24.842 7.050 1.00 0.00 C ATOM 1770 O LYS A 112 8.781 -23.869 7.637 1.00 0.00 O ATOM 1771 CB LYS A 112 11.194 -23.928 5.637 1.00 0.00 C ATOM 1772 CG LYS A 112 11.155 -22.471 6.138 1.00 0.00 C ATOM 1773 CD LYS A 112 12.526 -21.772 6.007 1.00 0.00 C ATOM 1774 CE LYS A 112 12.598 -20.470 6.817 1.00 0.00 C ATOM 1775 NZ LYS A 112 12.512 -20.728 8.280 1.00 0.00 N ATOM 0 H LYS A 112 8.396 -23.231 5.256 1.00 0.00 H new ATOM 0 HA LYS A 112 10.054 -25.685 5.255 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.904 -24.483 6.251 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.583 -23.930 4.619 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.409 -21.914 5.571 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.839 -22.456 7.181 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.310 -22.450 6.344 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.721 -21.555 4.957 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.531 -19.953 6.593 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.786 -19.808 6.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.846 -19.892 8.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.525 -20.926 8.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.105 -21.547 8.524 1.00 0.00 H new ATOM 1789 N ILE A 113 9.265 -26.076 7.580 1.00 0.00 N ATOM 1790 CA ILE A 113 8.637 -26.386 8.870 1.00 0.00 C ATOM 1791 C ILE A 113 9.659 -26.159 9.994 1.00 0.00 C ATOM 1792 O ILE A 113 10.778 -26.685 9.949 1.00 0.00 O ATOM 1793 CB ILE A 113 8.065 -27.855 8.907 1.00 0.00 C ATOM 1794 CG1 ILE A 113 6.869 -27.986 7.907 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.626 -28.275 10.345 1.00 0.00 C ATOM 1796 CD1 ILE A 113 6.324 -29.391 7.740 1.00 0.00 C ATOM 0 H ILE A 113 9.706 -26.878 7.130 1.00 0.00 H new ATOM 0 HA ILE A 113 7.787 -25.719 9.014 1.00 0.00 H new ATOM 0 HB ILE A 113 8.864 -28.532 8.605 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.061 -27.337 8.244 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.188 -27.618 6.932 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.238 -29.294 10.324 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.484 -28.227 11.016 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.849 -27.598 10.700 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.499 -29.379 7.028 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.113 -30.046 7.370 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.968 -29.760 8.702 1.00 0.00 H new ATOM 1808 N GLY A 114 9.252 -25.334 10.967 1.00 0.00 N ATOM 1809 CA GLY A 114 10.062 -25.028 12.150 1.00 0.00 C ATOM 1810 C GLY A 114 10.409 -26.267 12.976 1.00 0.00 C ATOM 1811 O GLY A 114 11.587 -26.599 13.145 1.00 0.00 O ATOM 0 H GLY A 114 8.349 -24.859 10.955 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.984 -24.539 11.835 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.523 -24.319 12.778 1.00 0.00 H new ATOM 1815 N GLU A 115 9.368 -26.953 13.476 1.00 0.00 N ATOM 1816 CA GLU A 115 9.513 -28.202 14.255 1.00 0.00 C ATOM 1817 C GLU A 115 8.168 -28.981 14.257 1.00 0.00 C ATOM 1818 O GLU A 115 7.139 -28.429 13.840 1.00 0.00 O ATOM 1819 CB GLU A 115 9.944 -27.875 15.721 1.00 0.00 C ATOM 1820 CG GLU A 115 8.806 -27.289 16.576 1.00 0.00 C ATOM 1821 CD GLU A 115 9.186 -27.047 18.042 1.00 0.00 C ATOM 1822 OE1 GLU A 115 9.923 -26.080 18.320 1.00 0.00 O ATOM 1823 OE2 GLU A 115 8.745 -27.816 18.924 1.00 0.00 O ATOM 0 H GLU A 115 8.399 -26.660 13.353 1.00 0.00 H new ATOM 0 HA GLU A 115 10.283 -28.820 13.793 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.313 -28.785 16.195 1.00 0.00 H new ATOM 0 HB3 GLU A 115 10.773 -27.168 15.699 1.00 0.00 H new ATOM 0 HG2 GLU A 115 8.483 -26.346 16.135 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.953 -27.966 16.540 1.00 0.00 H new ATOM 1830 N PRO A 116 8.154 -30.278 14.716 1.00 0.00 N ATOM 1831 CA PRO A 116 6.908 -30.978 15.096 1.00 0.00 C ATOM 1832 C PRO A 116 6.501 -30.694 16.569 1.00 0.00 C ATOM 1833 O PRO A 116 7.332 -30.777 17.486 1.00 0.00 O ATOM 1834 CB PRO A 116 7.287 -32.449 14.854 1.00 0.00 C ATOM 1835 CG PRO A 116 8.749 -32.532 15.202 1.00 0.00 C ATOM 1836 CD PRO A 116 9.339 -31.184 14.824 1.00 0.00 C ATOM 0 HA PRO A 116 6.032 -30.660 14.531 1.00 0.00 H new ATOM 0 HB2 PRO A 116 6.694 -33.118 15.477 1.00 0.00 H new ATOM 0 HB3 PRO A 116 7.110 -32.738 13.818 1.00 0.00 H new ATOM 0 HG2 PRO A 116 8.888 -32.736 16.264 1.00 0.00 H new ATOM 0 HG3 PRO A 116 9.236 -33.340 14.656 1.00 0.00 H new ATOM 0 HD2 PRO A 116 10.041 -30.832 15.579 1.00 0.00 H new ATOM 0 HD3 PRO A 116 9.885 -31.239 13.882 1.00 0.00 H new ATOM 1844 N ARG A 117 5.211 -30.324 16.794 1.00 0.00 N ATOM 1845 CA ARG A 117 4.694 -29.978 18.143 1.00 0.00 C ATOM 1846 C ARG A 117 3.427 -30.793 18.466 1.00 0.00 C ATOM 1847 O ARG A 117 2.743 -31.294 17.561 1.00 0.00 O ATOM 1848 CB ARG A 117 4.378 -28.458 18.248 1.00 0.00 C ATOM 1849 CG ARG A 117 5.417 -27.549 17.583 1.00 0.00 C ATOM 1850 CD ARG A 117 5.189 -26.063 17.869 1.00 0.00 C ATOM 1851 NE ARG A 117 5.654 -25.646 19.204 1.00 0.00 N ATOM 1852 CZ ARG A 117 5.601 -24.387 19.674 1.00 0.00 C ATOM 1853 NH1 ARG A 117 5.005 -23.416 18.976 1.00 0.00 N ATOM 1854 NH2 ARG A 117 6.138 -24.105 20.858 1.00 0.00 N ATOM 0 H ARG A 117 4.511 -30.258 16.055 1.00 0.00 H new ATOM 0 HA ARG A 117 5.471 -30.225 18.867 1.00 0.00 H new ATOM 0 HB2 ARG A 117 3.405 -28.269 17.795 1.00 0.00 H new ATOM 0 HB3 ARG A 117 4.297 -28.188 19.301 1.00 0.00 H new ATOM 0 HG2 ARG A 117 6.411 -27.831 17.929 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.397 -27.712 16.505 1.00 0.00 H new ATOM 0 HD2 ARG A 117 5.704 -25.472 17.112 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.126 -25.842 17.777 1.00 0.00 H new ATOM 0 HE ARG A 117 6.044 -26.364 19.815 1.00 0.00 H new ATOM 0 HH11 ARG A 117 4.581 -23.624 18.072 1.00 0.00 H new ATOM 0 HH12 ARG A 117 4.974 -22.466 19.347 1.00 0.00 H new ATOM 0 HH21 ARG A 117 6.586 -24.841 21.403 1.00 0.00 H new ATOM 0 HH22 ARG A 117 6.102 -23.152 21.221 1.00 0.00 H new ATOM 1868 N ILE A 118 3.140 -30.922 19.772 1.00 0.00 N ATOM 1869 CA ILE A 118 1.905 -31.536 20.301 1.00 0.00 C ATOM 1870 C ILE A 118 1.355 -30.614 21.403 1.00 0.00 C ATOM 1871 O ILE A 118 2.101 -30.243 22.319 1.00 0.00 O ATOM 1872 CB ILE A 118 2.134 -32.993 20.881 1.00 0.00 C ATOM 1873 CG1 ILE A 118 2.621 -33.981 19.771 1.00 0.00 C ATOM 1874 CG2 ILE A 118 0.850 -33.543 21.567 1.00 0.00 C ATOM 1875 CD1 ILE A 118 1.616 -34.231 18.660 1.00 0.00 C ATOM 0 H ILE A 118 3.770 -30.597 20.506 1.00 0.00 H new ATOM 0 HA ILE A 118 1.198 -31.645 19.479 1.00 0.00 H new ATOM 0 HB ILE A 118 2.916 -32.915 21.636 1.00 0.00 H new ATOM 0 HG12 ILE A 118 3.538 -33.589 19.332 1.00 0.00 H new ATOM 0 HG13 ILE A 118 2.872 -34.934 20.236 1.00 0.00 H new ATOM 0 HG21 ILE A 118 1.044 -34.544 21.953 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.567 -32.886 22.389 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.039 -33.585 20.840 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.039 -34.928 17.936 1.00 0.00 H new ATOM 0 HD12 ILE A 118 0.705 -34.655 19.082 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.381 -33.290 18.163 1.00 0.00 H new ATOM 1887 N VAL A 119 0.058 -30.240 21.283 1.00 0.00 N ATOM 1888 CA VAL A 119 -0.652 -29.374 22.268 1.00 0.00 C ATOM 1889 C VAL A 119 -0.574 -29.970 23.689 1.00 0.00 C ATOM 1890 O VAL A 119 -0.335 -29.251 24.665 1.00 0.00 O ATOM 1891 CB VAL A 119 -2.174 -29.157 21.873 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -2.942 -28.320 22.929 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -2.309 -28.504 20.480 1.00 0.00 C ATOM 0 H VAL A 119 -0.530 -30.528 20.501 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.149 -28.407 22.254 1.00 0.00 H new ATOM 0 HB VAL A 119 -2.626 -30.148 21.840 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.978 -28.199 22.614 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.913 -28.832 23.891 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.475 -27.340 23.026 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -3.364 -28.370 20.242 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.812 -27.534 20.483 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.846 -29.146 19.731 1.00 0.00 H new ATOM 1903 N SER A 120 -0.744 -31.302 23.773 1.00 0.00 N ATOM 1904 CA SER A 120 -0.765 -32.049 25.048 1.00 0.00 C ATOM 1905 C SER A 120 0.594 -31.981 25.789 1.00 0.00 C ATOM 1906 O SER A 120 0.652 -32.195 27.005 1.00 0.00 O ATOM 1907 CB SER A 120 -1.180 -33.519 24.783 1.00 0.00 C ATOM 1908 OG SER A 120 -1.386 -34.238 25.991 1.00 0.00 O ATOM 0 H SER A 120 -0.872 -31.896 22.954 1.00 0.00 H new ATOM 0 HA SER A 120 -1.500 -31.579 25.702 1.00 0.00 H new ATOM 0 HB2 SER A 120 -2.094 -33.537 24.190 1.00 0.00 H new ATOM 0 HB3 SER A 120 -0.408 -34.013 24.194 1.00 0.00 H new ATOM 0 HG SER A 120 -1.648 -35.159 25.783 1.00 0.00 H new ATOM 1914 N GLN A 121 1.678 -31.679 25.045 1.00 0.00 N ATOM 1915 CA GLN A 121 3.027 -31.532 25.616 1.00 0.00 C ATOM 1916 C GLN A 121 3.302 -30.051 25.934 1.00 0.00 C ATOM 1917 O GLN A 121 3.815 -29.303 25.091 1.00 0.00 O ATOM 1918 CB GLN A 121 4.099 -32.116 24.646 1.00 0.00 C ATOM 1919 CG GLN A 121 3.869 -33.591 24.244 1.00 0.00 C ATOM 1920 CD GLN A 121 3.786 -34.564 25.430 1.00 0.00 C ATOM 1921 OE1 GLN A 121 4.435 -34.375 26.464 1.00 0.00 O ATOM 1922 NE2 GLN A 121 2.998 -35.620 25.284 1.00 0.00 N ATOM 0 H GLN A 121 1.640 -31.531 24.036 1.00 0.00 H new ATOM 0 HA GLN A 121 3.085 -32.097 26.546 1.00 0.00 H new ATOM 0 HB2 GLN A 121 4.123 -31.507 23.743 1.00 0.00 H new ATOM 0 HB3 GLN A 121 5.079 -32.030 25.115 1.00 0.00 H new ATOM 0 HG2 GLN A 121 2.946 -33.659 23.668 1.00 0.00 H new ATOM 0 HG3 GLN A 121 4.679 -33.907 23.586 1.00 0.00 H new ATOM 0 HE21 GLN A 121 2.474 -35.750 24.418 1.00 0.00 H new ATOM 0 HE22 GLN A 121 2.916 -36.303 26.037 1.00 0.00 H new ATOM 1931 N LYS A 122 2.882 -29.624 27.140 1.00 0.00 N ATOM 1932 CA LYS A 122 3.175 -28.282 27.665 1.00 0.00 C ATOM 1933 C LYS A 122 4.591 -28.284 28.271 1.00 0.00 C ATOM 1934 O LYS A 122 4.780 -28.636 29.445 1.00 0.00 O ATOM 1935 CB LYS A 122 2.114 -27.859 28.720 1.00 0.00 C ATOM 1936 CG LYS A 122 0.675 -27.700 28.176 1.00 0.00 C ATOM 1937 CD LYS A 122 -0.321 -27.266 29.281 1.00 0.00 C ATOM 1938 CE LYS A 122 -1.733 -26.990 28.736 1.00 0.00 C ATOM 1939 NZ LYS A 122 -1.756 -25.850 27.782 1.00 0.00 N ATOM 0 H LYS A 122 2.331 -30.201 27.775 1.00 0.00 H new ATOM 0 HA LYS A 122 3.132 -27.554 26.855 1.00 0.00 H new ATOM 0 HB2 LYS A 122 2.104 -28.600 29.519 1.00 0.00 H new ATOM 0 HB3 LYS A 122 2.424 -26.914 29.165 1.00 0.00 H new ATOM 0 HG2 LYS A 122 0.671 -26.962 27.374 1.00 0.00 H new ATOM 0 HG3 LYS A 122 0.346 -28.644 27.742 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -0.376 -28.046 30.041 1.00 0.00 H new ATOM 0 HD3 LYS A 122 0.056 -26.369 29.772 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -2.110 -27.884 28.239 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -2.406 -26.779 29.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -2.742 -25.603 27.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.282 -25.029 28.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -1.260 -26.119 26.908 1.00 0.00 H new ATOM 1953 N SER A 123 5.588 -27.960 27.439 1.00 0.00 N ATOM 1954 CA SER A 123 6.997 -27.923 27.845 1.00 0.00 C ATOM 1955 C SER A 123 7.341 -26.519 28.419 1.00 0.00 C ATOM 1956 O SER A 123 7.346 -26.349 29.662 1.00 0.00 O ATOM 1957 CB SER A 123 7.879 -28.321 26.627 1.00 0.00 C ATOM 1958 OG SER A 123 7.540 -27.578 25.463 1.00 0.00 O ATOM 1959 OXT SER A 123 7.531 -25.568 27.626 1.00 0.00 O ATOM 0 H SER A 123 5.439 -27.715 26.460 1.00 0.00 H new ATOM 0 HA SER A 123 7.196 -28.640 28.642 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.929 -28.157 26.870 1.00 0.00 H new ATOM 0 HB3 SER A 123 7.761 -29.386 26.426 1.00 0.00 H new ATOM 0 HG SER A 123 7.402 -26.638 25.704 1.00 0.00 H new TER 1965 SER A 123