USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1128 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 37 ASN : amide:sc= 0.805 K(o=1.5,f=0.85) USER MOD Set 1.2: A 106 THR OG1 : rot -130:sc= 0.724 USER MOD Set 2.1: A 2 LYS NZ :NH3+ 171:sc= -0.413 (180deg=-0.689) USER MOD Set 2.2: A 32 THR OG1 : rot -25:sc= 1.1 USER MOD Single : A 1 MET CE :methyl -111:sc= 0 (180deg=-2.44!) USER MOD Single : A 1 MET N :NH3+ -171:sc= 1.88 (180deg=0.909) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.369 USER MOD Single : A 10 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.034) USER MOD Single : A 14 HIS : no HD1:sc= -0.172 K(o=-0.17,f=-0.74) USER MOD Single : A 19 TYR OH : rot 7:sc= 0.0163 USER MOD Single : A 24 CYS SG : rot 180:sc= 0.0647 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0.226 K(o=0.23,f=-4.2!) USER MOD Single : A 46 THR OG1 : rot -140:sc= -1.1 USER MOD Single : A 47 ASN :FLIP amide:sc= -0.0579 F(o=-1.7!,f=-0.058) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN :FLIP amide:sc= 0 F(o=-0.97,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0786 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -160:sc= 0 USER MOD Single : A 64 TYR OH : rot 25:sc= 0.0182 USER MOD Single : A 72 GLN : amide:sc= -0.0667 X(o=-0.067,f=-0.56) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.0502 F(o=-1.5!,f=-0.05) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= 0.59 K(o=0.59,f=-4.6!) USER MOD Single : A 84 SER OG : rot 170:sc= -0.956 USER MOD Single : A 85 HIS :FLIP no HE2:sc= 0.229 F(o=-0.98,f=0.23) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=-0.0001) USER MOD Single : A 93 SER OG : rot 180:sc= 0.0941 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot -13:sc= 0.595 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -13:sc= -0.483! USER MOD Single : A 130 SER OG : rot 78:sc= 1.24 USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 149 HIS : no HD1:sc= -0.471 K(o=-0.47,f=-3.3!) USER MOD Single : A 150 HIS : no HD1:sc= -0.0628 K(o=-0.063,f=-2.1!) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 152 HIS : no HD1:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.191 -5.351 4.867 1.00 0.00 N ATOM 2 CA MET A 1 -8.310 -5.363 3.683 1.00 0.00 C ATOM 3 C MET A 1 -8.410 -6.686 2.933 1.00 0.00 C ATOM 4 O MET A 1 -7.969 -7.727 3.417 1.00 0.00 O ATOM 5 CB MET A 1 -6.858 -5.109 4.105 1.00 0.00 C ATOM 6 CG MET A 1 -5.847 -5.293 2.984 1.00 0.00 C ATOM 7 SD MET A 1 -4.142 -5.090 3.543 1.00 0.00 S ATOM 8 CE MET A 1 -3.245 -5.498 2.052 1.00 0.00 C ATOM 0 H1 MET A 1 -9.219 -4.392 5.269 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.151 -5.638 4.588 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.825 -6.014 5.579 1.00 0.00 H new ATOM 0 HA MET A 1 -8.636 -4.568 3.013 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.775 -4.093 4.492 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.605 -5.783 4.923 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.967 -6.286 2.551 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.054 -4.573 2.192 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.722 -6.444 2.190 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.944 -5.588 1.220 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.522 -4.711 1.836 1.00 0.00 H new ATOM 20 N LYS A 2 -9.007 -6.636 1.753 1.00 0.00 N ATOM 21 CA LYS A 2 -8.998 -7.768 0.843 1.00 0.00 C ATOM 22 C LYS A 2 -7.788 -7.667 -0.064 1.00 0.00 C ATOM 23 O LYS A 2 -7.464 -6.584 -0.558 1.00 0.00 O ATOM 24 CB LYS A 2 -10.259 -7.819 -0.026 1.00 0.00 C ATOM 25 CG LYS A 2 -11.459 -8.497 0.611 1.00 0.00 C ATOM 26 CD LYS A 2 -12.200 -7.582 1.567 1.00 0.00 C ATOM 27 CE LYS A 2 -13.582 -8.133 1.880 1.00 0.00 C ATOM 28 NZ LYS A 2 -14.441 -7.140 2.574 1.00 0.00 N ATOM 0 H LYS A 2 -9.506 -5.819 1.402 1.00 0.00 H new ATOM 0 HA LYS A 2 -8.964 -8.676 1.445 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -10.538 -6.800 -0.293 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -10.020 -8.338 -0.954 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -12.142 -8.831 -0.171 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -11.128 -9.387 1.147 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -11.629 -7.473 2.489 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -12.291 -6.588 1.129 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -14.065 -8.444 0.954 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -13.484 -9.023 2.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -15.414 -7.502 2.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -14.076 -6.976 3.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -14.435 -6.245 2.044 1.00 0.00 H new ATOM 42 N THR A 3 -7.122 -8.778 -0.283 1.00 0.00 N ATOM 43 CA THR A 3 -5.959 -8.794 -1.143 1.00 0.00 C ATOM 44 C THR A 3 -5.744 -10.183 -1.731 1.00 0.00 C ATOM 45 O THR A 3 -6.110 -11.192 -1.122 1.00 0.00 O ATOM 46 CB THR A 3 -4.698 -8.329 -0.379 1.00 0.00 C ATOM 47 OG1 THR A 3 -3.565 -8.296 -1.255 1.00 0.00 O ATOM 48 CG2 THR A 3 -4.406 -9.239 0.804 1.00 0.00 C ATOM 0 H THR A 3 -7.365 -9.682 0.122 1.00 0.00 H new ATOM 0 HA THR A 3 -6.137 -8.096 -1.961 1.00 0.00 H new ATOM 0 HB THR A 3 -4.890 -7.324 -0.003 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.775 -7.998 -0.757 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.514 -8.887 1.322 1.00 0.00 H new ATOM 0 HG22 THR A 3 -5.253 -9.227 1.490 1.00 0.00 H new ATOM 0 HG23 THR A 3 -4.242 -10.256 0.449 1.00 0.00 H new ATOM 56 N THR A 4 -5.187 -10.224 -2.929 1.00 0.00 N ATOM 57 CA THR A 4 -4.900 -11.474 -3.600 1.00 0.00 C ATOM 58 C THR A 4 -3.429 -11.846 -3.432 1.00 0.00 C ATOM 59 O THR A 4 -2.579 -10.974 -3.238 1.00 0.00 O ATOM 60 CB THR A 4 -5.261 -11.388 -5.096 1.00 0.00 C ATOM 61 OG1 THR A 4 -4.845 -10.125 -5.632 1.00 0.00 O ATOM 62 CG2 THR A 4 -6.757 -11.568 -5.305 1.00 0.00 C ATOM 0 H THR A 4 -4.923 -9.394 -3.460 1.00 0.00 H new ATOM 0 HA THR A 4 -5.511 -12.252 -3.143 1.00 0.00 H new ATOM 0 HB THR A 4 -4.740 -12.191 -5.618 1.00 0.00 H new ATOM 0 HG1 THR A 4 -5.077 -10.081 -6.583 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.986 -11.503 -6.369 1.00 0.00 H new ATOM 0 HG22 THR A 4 -7.062 -12.544 -4.927 1.00 0.00 H new ATOM 0 HG23 THR A 4 -7.296 -10.786 -4.769 1.00 0.00 H new ATOM 70 N PRO A 5 -3.116 -13.150 -3.484 1.00 0.00 N ATOM 71 CA PRO A 5 -1.751 -13.660 -3.312 1.00 0.00 C ATOM 72 C PRO A 5 -0.740 -12.983 -4.237 1.00 0.00 C ATOM 73 O PRO A 5 0.417 -12.770 -3.860 1.00 0.00 O ATOM 74 CB PRO A 5 -1.867 -15.155 -3.651 1.00 0.00 C ATOM 75 CG PRO A 5 -3.219 -15.332 -4.259 1.00 0.00 C ATOM 76 CD PRO A 5 -4.077 -14.239 -3.699 1.00 0.00 C ATOM 0 HA PRO A 5 -1.383 -13.466 -2.305 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -1.084 -15.460 -4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.757 -15.768 -2.757 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -3.168 -15.268 -5.346 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.630 -16.312 -4.016 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.868 -13.950 -4.392 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.561 -14.540 -2.770 1.00 0.00 H new ATOM 84 N ASP A 6 -1.179 -12.647 -5.446 1.00 0.00 N ATOM 85 CA ASP A 6 -0.333 -11.966 -6.407 1.00 0.00 C ATOM 86 C ASP A 6 0.045 -10.571 -5.915 1.00 0.00 C ATOM 87 O ASP A 6 1.176 -10.127 -6.100 1.00 0.00 O ATOM 88 CB ASP A 6 -1.039 -11.881 -7.762 1.00 0.00 C ATOM 89 CG ASP A 6 -2.390 -11.194 -7.694 1.00 0.00 C ATOM 90 OD1 ASP A 6 -3.391 -11.879 -7.396 1.00 0.00 O ATOM 91 OD2 ASP A 6 -2.462 -9.973 -7.939 1.00 0.00 O ATOM 0 H ASP A 6 -2.123 -12.839 -5.781 1.00 0.00 H new ATOM 0 HA ASP A 6 0.585 -12.542 -6.522 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -0.401 -11.343 -8.463 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.171 -12.888 -8.159 1.00 0.00 H new ATOM 96 N ILE A 7 -0.897 -9.889 -5.275 1.00 0.00 N ATOM 97 CA ILE A 7 -0.644 -8.559 -4.735 1.00 0.00 C ATOM 98 C ILE A 7 0.299 -8.644 -3.540 1.00 0.00 C ATOM 99 O ILE A 7 1.253 -7.873 -3.435 1.00 0.00 O ATOM 100 CB ILE A 7 -1.957 -7.860 -4.308 1.00 0.00 C ATOM 101 CG1 ILE A 7 -2.851 -7.612 -5.526 1.00 0.00 C ATOM 102 CG2 ILE A 7 -1.671 -6.549 -3.584 1.00 0.00 C ATOM 103 CD1 ILE A 7 -2.226 -6.714 -6.571 1.00 0.00 C ATOM 0 H ILE A 7 -1.843 -10.235 -5.117 1.00 0.00 H new ATOM 0 HA ILE A 7 -0.182 -7.967 -5.525 1.00 0.00 H new ATOM 0 HB ILE A 7 -2.481 -8.520 -3.617 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -3.098 -8.570 -5.984 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -3.788 -7.167 -5.192 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -2.612 -6.080 -3.296 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -1.077 -6.748 -2.692 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -1.120 -5.881 -4.246 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -2.919 -6.586 -7.402 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -2.004 -5.742 -6.130 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.303 -7.166 -6.935 1.00 0.00 H new ATOM 115 N LEU A 8 0.037 -9.607 -2.658 1.00 0.00 N ATOM 116 CA LEU A 8 0.857 -9.812 -1.463 1.00 0.00 C ATOM 117 C LEU A 8 2.330 -9.991 -1.817 1.00 0.00 C ATOM 118 O LEU A 8 3.210 -9.428 -1.162 1.00 0.00 O ATOM 119 CB LEU A 8 0.366 -11.035 -0.686 1.00 0.00 C ATOM 120 CG LEU A 8 -0.987 -10.865 0.002 1.00 0.00 C ATOM 121 CD1 LEU A 8 -1.450 -12.184 0.597 1.00 0.00 C ATOM 122 CD2 LEU A 8 -0.902 -9.797 1.083 1.00 0.00 C ATOM 0 H LEU A 8 -0.740 -10.261 -2.748 1.00 0.00 H new ATOM 0 HA LEU A 8 0.760 -8.921 -0.843 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.304 -11.881 -1.371 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.110 -11.290 0.068 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.716 -10.547 -0.744 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.416 -12.045 1.083 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.546 -12.927 -0.195 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.721 -12.528 1.330 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.874 -9.688 1.564 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.160 -10.090 1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.611 -8.847 0.634 1.00 0.00 H new ATOM 134 N ASP A 9 2.596 -10.775 -2.855 1.00 0.00 N ATOM 135 CA ASP A 9 3.967 -11.020 -3.285 1.00 0.00 C ATOM 136 C ASP A 9 4.574 -9.754 -3.865 1.00 0.00 C ATOM 137 O ASP A 9 5.713 -9.407 -3.574 1.00 0.00 O ATOM 138 CB ASP A 9 4.025 -12.144 -4.315 1.00 0.00 C ATOM 139 CG ASP A 9 5.449 -12.583 -4.599 1.00 0.00 C ATOM 140 OD1 ASP A 9 6.049 -13.262 -3.733 1.00 0.00 O ATOM 141 OD2 ASP A 9 5.968 -12.271 -5.691 1.00 0.00 O ATOM 0 H ASP A 9 1.885 -11.249 -3.412 1.00 0.00 H new ATOM 0 HA ASP A 9 4.544 -11.324 -2.411 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.448 -12.996 -3.955 1.00 0.00 H new ATOM 0 HB3 ASP A 9 3.557 -11.811 -5.241 1.00 0.00 H new ATOM 146 N GLN A 10 3.799 -9.050 -4.670 1.00 0.00 N ATOM 147 CA GLN A 10 4.249 -7.793 -5.248 1.00 0.00 C ATOM 148 C GLN A 10 4.592 -6.772 -4.159 1.00 0.00 C ATOM 149 O GLN A 10 5.466 -5.924 -4.351 1.00 0.00 O ATOM 150 CB GLN A 10 3.192 -7.239 -6.202 1.00 0.00 C ATOM 151 CG GLN A 10 3.005 -8.095 -7.443 1.00 0.00 C ATOM 152 CD GLN A 10 1.945 -7.552 -8.382 1.00 0.00 C ATOM 153 OE1 GLN A 10 2.239 -6.753 -9.273 1.00 0.00 O ATOM 154 NE2 GLN A 10 0.709 -7.987 -8.193 1.00 0.00 N ATOM 0 H GLN A 10 2.855 -9.326 -4.939 1.00 0.00 H new ATOM 0 HA GLN A 10 5.160 -7.987 -5.815 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.241 -7.160 -5.675 1.00 0.00 H new ATOM 0 HB3 GLN A 10 3.475 -6.230 -6.503 1.00 0.00 H new ATOM 0 HG2 GLN A 10 3.953 -8.165 -7.976 1.00 0.00 H new ATOM 0 HG3 GLN A 10 2.733 -9.107 -7.142 1.00 0.00 H new ATOM 0 HE21 GLN A 10 0.510 -8.649 -7.443 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -0.045 -7.660 -8.798 1.00 0.00 H new ATOM 163 N ILE A 11 3.913 -6.853 -3.017 1.00 0.00 N ATOM 164 CA ILE A 11 4.212 -5.971 -1.893 1.00 0.00 C ATOM 165 C ILE A 11 5.616 -6.243 -1.353 1.00 0.00 C ATOM 166 O ILE A 11 6.419 -5.320 -1.208 1.00 0.00 O ATOM 167 CB ILE A 11 3.193 -6.128 -0.741 1.00 0.00 C ATOM 168 CG1 ILE A 11 1.776 -5.799 -1.218 1.00 0.00 C ATOM 169 CG2 ILE A 11 3.571 -5.234 0.437 1.00 0.00 C ATOM 170 CD1 ILE A 11 0.708 -6.021 -0.166 1.00 0.00 C ATOM 0 H ILE A 11 3.157 -7.516 -2.847 1.00 0.00 H new ATOM 0 HA ILE A 11 4.149 -4.951 -2.272 1.00 0.00 H new ATOM 0 HB ILE A 11 3.215 -7.167 -0.413 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.744 -4.758 -1.540 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.546 -6.410 -2.091 1.00 0.00 H new ATOM 0 HG21 ILE A 11 2.842 -5.359 1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.560 -5.511 0.801 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.581 -4.193 0.115 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.268 -5.766 -0.579 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.711 -7.067 0.140 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.912 -5.389 0.699 1.00 0.00 H new ATOM 182 N ARG A 12 5.919 -7.515 -1.083 1.00 0.00 N ATOM 183 CA ARG A 12 7.226 -7.890 -0.546 1.00 0.00 C ATOM 184 C ARG A 12 8.333 -7.611 -1.566 1.00 0.00 C ATOM 185 O ARG A 12 9.437 -7.209 -1.199 1.00 0.00 O ATOM 186 CB ARG A 12 7.238 -9.363 -0.101 1.00 0.00 C ATOM 187 CG ARG A 12 7.093 -10.362 -1.238 1.00 0.00 C ATOM 188 CD ARG A 12 6.905 -11.782 -0.733 1.00 0.00 C ATOM 189 NE ARG A 12 8.071 -12.281 -0.003 1.00 0.00 N ATOM 190 CZ ARG A 12 8.572 -13.508 -0.161 1.00 0.00 C ATOM 191 NH1 ARG A 12 8.062 -14.323 -1.079 1.00 0.00 N ATOM 192 NH2 ARG A 12 9.594 -13.919 0.583 1.00 0.00 N ATOM 0 H ARG A 12 5.280 -8.297 -1.227 1.00 0.00 H new ATOM 0 HA ARG A 12 7.419 -7.277 0.334 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.171 -9.563 0.426 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.429 -9.522 0.612 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.241 -10.083 -1.858 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.978 -10.318 -1.873 1.00 0.00 H new ATOM 0 HD2 ARG A 12 6.031 -11.819 -0.083 1.00 0.00 H new ATOM 0 HD3 ARG A 12 6.702 -12.440 -1.578 1.00 0.00 H new ATOM 0 HE ARG A 12 8.526 -11.657 0.663 1.00 0.00 H new ATOM 0 HH11 ARG A 12 7.287 -14.011 -1.664 1.00 0.00 H new ATOM 0 HH12 ARG A 12 8.446 -15.260 -1.199 1.00 0.00 H new ATOM 0 HH21 ARG A 12 10.001 -13.295 1.280 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.972 -14.858 0.457 1.00 0.00 H new ATOM 206 N VAL A 13 8.023 -7.798 -2.849 1.00 0.00 N ATOM 207 CA VAL A 13 8.972 -7.500 -3.915 1.00 0.00 C ATOM 208 C VAL A 13 9.267 -6.003 -3.967 1.00 0.00 C ATOM 209 O VAL A 13 10.406 -5.594 -4.176 1.00 0.00 O ATOM 210 CB VAL A 13 8.458 -7.981 -5.290 1.00 0.00 C ATOM 211 CG1 VAL A 13 9.412 -7.567 -6.399 1.00 0.00 C ATOM 212 CG2 VAL A 13 8.270 -9.492 -5.295 1.00 0.00 C ATOM 0 H VAL A 13 7.123 -8.154 -3.172 1.00 0.00 H new ATOM 0 HA VAL A 13 9.891 -8.041 -3.690 1.00 0.00 H new ATOM 0 HB VAL A 13 7.492 -7.509 -5.472 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.029 -7.917 -7.358 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.499 -6.481 -6.417 1.00 0.00 H new ATOM 0 HG13 VAL A 13 10.393 -8.006 -6.218 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.908 -9.810 -6.272 1.00 0.00 H new ATOM 0 HG22 VAL A 13 9.223 -9.978 -5.085 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.545 -9.771 -4.531 1.00 0.00 H new ATOM 222 N HIS A 14 8.241 -5.185 -3.756 1.00 0.00 N ATOM 223 CA HIS A 14 8.420 -3.736 -3.726 1.00 0.00 C ATOM 224 C HIS A 14 9.288 -3.317 -2.548 1.00 0.00 C ATOM 225 O HIS A 14 9.970 -2.301 -2.611 1.00 0.00 O ATOM 226 CB HIS A 14 7.077 -3.008 -3.677 1.00 0.00 C ATOM 227 CG HIS A 14 6.436 -2.850 -5.020 1.00 0.00 C ATOM 228 ND1 HIS A 14 5.154 -3.265 -5.301 1.00 0.00 N ATOM 229 CD2 HIS A 14 6.909 -2.297 -6.160 1.00 0.00 C ATOM 230 CE1 HIS A 14 4.867 -2.973 -6.555 1.00 0.00 C ATOM 231 NE2 HIS A 14 5.915 -2.386 -7.100 1.00 0.00 N ATOM 0 H HIS A 14 7.282 -5.497 -3.604 1.00 0.00 H new ATOM 0 HA HIS A 14 8.926 -3.453 -4.649 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.399 -3.555 -3.022 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.222 -2.023 -3.234 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.888 -1.865 -6.303 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.931 -3.180 -7.052 1.00 0.00 H new ATOM 0 HE2 HIS A 14 5.976 -2.053 -8.062 1.00 0.00 H new ATOM 240 N GLY A 15 9.250 -4.099 -1.475 1.00 0.00 N ATOM 241 CA GLY A 15 10.127 -3.845 -0.347 1.00 0.00 C ATOM 242 C GLY A 15 11.581 -4.041 -0.724 1.00 0.00 C ATOM 243 O GLY A 15 12.450 -3.266 -0.325 1.00 0.00 O ATOM 0 H GLY A 15 8.630 -4.902 -1.366 1.00 0.00 H new ATOM 0 HA2 GLY A 15 9.976 -2.827 0.011 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.869 -4.513 0.474 1.00 0.00 H new ATOM 247 N ALA A 16 11.842 -5.080 -1.505 1.00 0.00 N ATOM 248 CA ALA A 16 13.184 -5.353 -2.000 1.00 0.00 C ATOM 249 C ALA A 16 13.563 -4.357 -3.093 1.00 0.00 C ATOM 250 O ALA A 16 14.740 -4.085 -3.318 1.00 0.00 O ATOM 251 CB ALA A 16 13.270 -6.778 -2.519 1.00 0.00 C ATOM 0 H ALA A 16 11.138 -5.751 -1.811 1.00 0.00 H new ATOM 0 HA ALA A 16 13.891 -5.241 -1.178 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.278 -6.971 -2.887 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.038 -7.474 -1.712 1.00 0.00 H new ATOM 0 HB3 ALA A 16 12.555 -6.913 -3.331 1.00 0.00 H new ATOM 257 N ASP A 17 12.548 -3.831 -3.773 1.00 0.00 N ATOM 258 CA ASP A 17 12.748 -2.845 -4.833 1.00 0.00 C ATOM 259 C ASP A 17 13.110 -1.495 -4.247 1.00 0.00 C ATOM 260 O ASP A 17 13.954 -0.779 -4.782 1.00 0.00 O ATOM 261 CB ASP A 17 11.472 -2.706 -5.662 1.00 0.00 C ATOM 262 CG ASP A 17 11.629 -1.769 -6.847 1.00 0.00 C ATOM 263 OD1 ASP A 17 12.088 -2.228 -7.911 1.00 0.00 O ATOM 264 OD2 ASP A 17 11.262 -0.575 -6.729 1.00 0.00 O ATOM 0 H ASP A 17 11.571 -4.073 -3.608 1.00 0.00 H new ATOM 0 HA ASP A 17 13.565 -3.187 -5.468 1.00 0.00 H new ATOM 0 HB2 ASP A 17 11.171 -3.690 -6.022 1.00 0.00 H new ATOM 0 HB3 ASP A 17 10.668 -2.341 -5.022 1.00 0.00 H new ATOM 269 N ALA A 18 12.467 -1.165 -3.140 1.00 0.00 N ATOM 270 CA ALA A 18 12.724 0.087 -2.445 1.00 0.00 C ATOM 271 C ALA A 18 14.110 0.085 -1.815 1.00 0.00 C ATOM 272 O ALA A 18 14.857 1.054 -1.934 1.00 0.00 O ATOM 273 CB ALA A 18 11.657 0.336 -1.388 1.00 0.00 C ATOM 0 H ALA A 18 11.758 -1.751 -2.700 1.00 0.00 H new ATOM 0 HA ALA A 18 12.686 0.896 -3.175 1.00 0.00 H new ATOM 0 HB1 ALA A 18 11.864 1.276 -0.877 1.00 0.00 H new ATOM 0 HB2 ALA A 18 10.678 0.389 -1.865 1.00 0.00 H new ATOM 0 HB3 ALA A 18 11.664 -0.479 -0.665 1.00 0.00 H new ATOM 279 N TYR A 19 14.457 -1.021 -1.170 1.00 0.00 N ATOM 280 CA TYR A 19 15.746 -1.148 -0.500 1.00 0.00 C ATOM 281 C TYR A 19 16.872 -1.206 -1.529 1.00 0.00 C ATOM 282 O TYR A 19 16.677 -1.700 -2.637 1.00 0.00 O ATOM 283 CB TYR A 19 15.762 -2.392 0.396 1.00 0.00 C ATOM 284 CG TYR A 19 15.116 -2.178 1.749 1.00 0.00 C ATOM 285 CD1 TYR A 19 13.953 -1.428 1.883 1.00 0.00 C ATOM 286 CD2 TYR A 19 15.678 -2.725 2.895 1.00 0.00 C ATOM 287 CE1 TYR A 19 13.371 -1.230 3.120 1.00 0.00 C ATOM 288 CE2 TYR A 19 15.102 -2.534 4.134 1.00 0.00 C ATOM 289 CZ TYR A 19 13.952 -1.785 4.243 1.00 0.00 C ATOM 290 OH TYR A 19 13.379 -1.592 5.479 1.00 0.00 O ATOM 0 H TYR A 19 13.862 -1.846 -1.096 1.00 0.00 H new ATOM 0 HA TYR A 19 15.902 -0.273 0.131 1.00 0.00 H new ATOM 0 HB2 TYR A 19 15.248 -3.205 -0.117 1.00 0.00 H new ATOM 0 HB3 TYR A 19 16.794 -2.710 0.543 1.00 0.00 H new ATOM 0 HD1 TYR A 19 13.497 -0.993 1.006 1.00 0.00 H new ATOM 0 HD2 TYR A 19 16.582 -3.310 2.815 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.467 -0.645 3.208 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.551 -2.970 5.014 1.00 0.00 H new ATOM 0 HH TYR A 19 12.519 -1.134 5.373 1.00 0.00 H new ATOM 300 N PRO A 20 18.078 -0.718 -1.188 1.00 0.00 N ATOM 301 CA PRO A 20 18.418 -0.227 0.155 1.00 0.00 C ATOM 302 C PRO A 20 17.921 1.191 0.438 1.00 0.00 C ATOM 303 O PRO A 20 18.122 1.718 1.533 1.00 0.00 O ATOM 304 CB PRO A 20 19.942 -0.260 0.148 1.00 0.00 C ATOM 305 CG PRO A 20 20.314 0.008 -1.268 1.00 0.00 C ATOM 306 CD PRO A 20 19.226 -0.601 -2.114 1.00 0.00 C ATOM 0 HA PRO A 20 17.949 -0.832 0.931 1.00 0.00 H new ATOM 0 HB2 PRO A 20 20.358 0.493 0.817 1.00 0.00 H new ATOM 0 HB3 PRO A 20 20.320 -1.227 0.481 1.00 0.00 H new ATOM 0 HG2 PRO A 20 20.396 1.079 -1.452 1.00 0.00 H new ATOM 0 HG3 PRO A 20 21.283 -0.431 -1.505 1.00 0.00 H new ATOM 0 HD2 PRO A 20 18.986 0.029 -2.970 1.00 0.00 H new ATOM 0 HD3 PRO A 20 19.523 -1.573 -2.507 1.00 0.00 H new ATOM 314 N GLU A 21 17.304 1.814 -0.554 1.00 0.00 N ATOM 315 CA GLU A 21 16.833 3.186 -0.414 1.00 0.00 C ATOM 316 C GLU A 21 15.715 3.287 0.622 1.00 0.00 C ATOM 317 O GLU A 21 15.122 2.282 1.023 1.00 0.00 O ATOM 318 CB GLU A 21 16.361 3.727 -1.764 1.00 0.00 C ATOM 319 CG GLU A 21 17.442 3.700 -2.833 1.00 0.00 C ATOM 320 CD GLU A 21 18.686 4.452 -2.416 1.00 0.00 C ATOM 321 OE1 GLU A 21 19.529 3.869 -1.703 1.00 0.00 O ATOM 322 OE2 GLU A 21 18.831 5.633 -2.793 1.00 0.00 O ATOM 0 H GLU A 21 17.117 1.393 -1.464 1.00 0.00 H new ATOM 0 HA GLU A 21 17.668 3.793 -0.064 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.508 3.140 -2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.012 4.752 -1.635 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.704 2.665 -3.055 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.050 4.134 -3.753 1.00 0.00 H new ATOM 329 N GLU A 22 15.443 4.506 1.062 1.00 0.00 N ATOM 330 CA GLU A 22 14.438 4.745 2.086 1.00 0.00 C ATOM 331 C GLU A 22 13.084 5.060 1.452 1.00 0.00 C ATOM 332 O GLU A 22 12.825 6.189 1.030 1.00 0.00 O ATOM 333 CB GLU A 22 14.893 5.880 3.013 1.00 0.00 C ATOM 334 CG GLU A 22 15.393 7.115 2.278 1.00 0.00 C ATOM 335 CD GLU A 22 15.992 8.140 3.210 1.00 0.00 C ATOM 336 OE1 GLU A 22 15.240 8.985 3.740 1.00 0.00 O ATOM 337 OE2 GLU A 22 17.221 8.105 3.422 1.00 0.00 O ATOM 0 H GLU A 22 15.907 5.349 0.724 1.00 0.00 H new ATOM 0 HA GLU A 22 14.321 3.840 2.682 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.061 6.165 3.657 1.00 0.00 H new ATOM 0 HB3 GLU A 22 15.687 5.510 3.662 1.00 0.00 H new ATOM 0 HG2 GLU A 22 16.140 6.818 1.542 1.00 0.00 H new ATOM 0 HG3 GLU A 22 14.567 7.567 1.729 1.00 0.00 H new ATOM 344 N GLY A 23 12.233 4.052 1.363 1.00 0.00 N ATOM 345 CA GLY A 23 10.936 4.240 0.757 1.00 0.00 C ATOM 346 C GLY A 23 9.889 3.305 1.318 1.00 0.00 C ATOM 347 O GLY A 23 10.180 2.152 1.632 1.00 0.00 O ATOM 0 H GLY A 23 12.418 3.107 1.700 1.00 0.00 H new ATOM 0 HA2 GLY A 23 10.615 5.271 0.908 1.00 0.00 H new ATOM 0 HA3 GLY A 23 11.016 4.085 -0.319 1.00 0.00 H new ATOM 351 N CYS A 24 8.679 3.813 1.466 1.00 0.00 N ATOM 352 CA CYS A 24 7.557 3.005 1.900 1.00 0.00 C ATOM 353 C CYS A 24 6.685 2.661 0.696 1.00 0.00 C ATOM 354 O CYS A 24 7.121 2.802 -0.445 1.00 0.00 O ATOM 355 CB CYS A 24 6.750 3.757 2.960 1.00 0.00 C ATOM 356 SG CYS A 24 6.236 5.415 2.455 1.00 0.00 S ATOM 0 H CYS A 24 8.448 4.791 1.290 1.00 0.00 H new ATOM 0 HA CYS A 24 7.922 2.079 2.345 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.864 3.173 3.209 1.00 0.00 H new ATOM 0 HB3 CYS A 24 7.347 3.834 3.869 1.00 0.00 H new ATOM 0 HG CYS A 24 5.558 5.971 3.415 1.00 0.00 H new ATOM 362 N GLY A 25 5.470 2.204 0.937 1.00 0.00 N ATOM 363 CA GLY A 25 4.582 1.887 -0.158 1.00 0.00 C ATOM 364 C GLY A 25 3.150 2.268 0.139 1.00 0.00 C ATOM 365 O GLY A 25 2.727 2.254 1.294 1.00 0.00 O ATOM 0 H GLY A 25 5.083 2.047 1.867 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.916 2.407 -1.056 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.636 0.819 -0.369 1.00 0.00 H new ATOM 369 N PHE A 26 2.403 2.604 -0.900 1.00 0.00 N ATOM 370 CA PHE A 26 1.006 2.964 -0.745 1.00 0.00 C ATOM 371 C PHE A 26 0.116 1.876 -1.329 1.00 0.00 C ATOM 372 O PHE A 26 0.488 1.206 -2.297 1.00 0.00 O ATOM 373 CB PHE A 26 0.717 4.302 -1.431 1.00 0.00 C ATOM 374 CG PHE A 26 1.488 5.456 -0.854 1.00 0.00 C ATOM 375 CD1 PHE A 26 1.062 6.079 0.308 1.00 0.00 C ATOM 376 CD2 PHE A 26 2.634 5.924 -1.479 1.00 0.00 C ATOM 377 CE1 PHE A 26 1.767 7.141 0.839 1.00 0.00 C ATOM 378 CE2 PHE A 26 3.342 6.987 -0.951 1.00 0.00 C ATOM 379 CZ PHE A 26 2.906 7.597 0.208 1.00 0.00 C ATOM 0 H PHE A 26 2.743 2.634 -1.861 1.00 0.00 H new ATOM 0 HA PHE A 26 0.791 3.065 0.319 1.00 0.00 H new ATOM 0 HB2 PHE A 26 0.951 4.214 -2.492 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -0.349 4.515 -1.357 1.00 0.00 H new ATOM 0 HD1 PHE A 26 0.168 5.730 0.804 1.00 0.00 H new ATOM 0 HD2 PHE A 26 2.977 5.453 -2.388 1.00 0.00 H new ATOM 0 HE1 PHE A 26 1.427 7.615 1.748 1.00 0.00 H new ATOM 0 HE2 PHE A 26 4.235 7.340 -1.445 1.00 0.00 H new ATOM 0 HZ PHE A 26 3.456 8.430 0.620 1.00 0.00 H new ATOM 389 N LEU A 27 -1.054 1.706 -0.737 1.00 0.00 N ATOM 390 CA LEU A 27 -2.009 0.709 -1.191 1.00 0.00 C ATOM 391 C LEU A 27 -3.137 1.380 -1.961 1.00 0.00 C ATOM 392 O LEU A 27 -3.908 2.154 -1.396 1.00 0.00 O ATOM 393 CB LEU A 27 -2.582 -0.060 0.004 1.00 0.00 C ATOM 394 CG LEU A 27 -1.557 -0.791 0.871 1.00 0.00 C ATOM 395 CD1 LEU A 27 -2.234 -1.401 2.088 1.00 0.00 C ATOM 396 CD2 LEU A 27 -0.850 -1.869 0.067 1.00 0.00 C ATOM 0 H LEU A 27 -1.367 2.251 0.066 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.495 0.008 -1.849 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.131 0.640 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.303 -0.788 -0.367 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.814 -0.069 1.209 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.492 -1.918 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.701 -0.612 2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.995 -2.110 1.763 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.124 -2.378 0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.582 -2.590 -0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.336 -1.413 -0.779 1.00 0.00 H new ATOM 408 N LEU A 28 -3.221 1.095 -3.248 1.00 0.00 N ATOM 409 CA LEU A 28 -4.272 1.652 -4.082 1.00 0.00 C ATOM 410 C LEU A 28 -5.273 0.559 -4.419 1.00 0.00 C ATOM 411 O LEU A 28 -4.883 -0.548 -4.792 1.00 0.00 O ATOM 412 CB LEU A 28 -3.678 2.243 -5.366 1.00 0.00 C ATOM 413 CG LEU A 28 -2.560 3.268 -5.158 1.00 0.00 C ATOM 414 CD1 LEU A 28 -2.014 3.742 -6.495 1.00 0.00 C ATOM 415 CD2 LEU A 28 -3.060 4.450 -4.344 1.00 0.00 C ATOM 0 H LEU A 28 -2.573 0.480 -3.740 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.777 2.452 -3.541 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.292 1.427 -5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.480 2.715 -5.934 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.754 2.784 -4.606 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.220 4.470 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.615 2.891 -7.047 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.815 4.205 -7.071 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.250 5.167 -4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.885 4.931 -4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.404 4.102 -3.370 1.00 0.00 H new ATOM 427 N GLY A 29 -6.556 0.842 -4.276 1.00 0.00 N ATOM 428 CA GLY A 29 -7.543 -0.179 -4.560 1.00 0.00 C ATOM 429 C GLY A 29 -8.964 0.335 -4.614 1.00 0.00 C ATOM 430 O GLY A 29 -9.200 1.532 -4.794 1.00 0.00 O ATOM 0 H GLY A 29 -6.929 1.742 -3.974 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -7.301 -0.648 -5.514 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -7.477 -0.955 -3.797 1.00 0.00 H new ATOM 434 N THR A 30 -9.905 -0.588 -4.458 1.00 0.00 N ATOM 435 CA THR A 30 -11.324 -0.293 -4.563 1.00 0.00 C ATOM 436 C THR A 30 -12.031 -0.559 -3.240 1.00 0.00 C ATOM 437 O THR A 30 -11.522 -1.295 -2.386 1.00 0.00 O ATOM 438 CB THR A 30 -11.985 -1.152 -5.661 1.00 0.00 C ATOM 439 OG1 THR A 30 -11.667 -2.537 -5.458 1.00 0.00 O ATOM 440 CG2 THR A 30 -11.531 -0.724 -7.047 1.00 0.00 C ATOM 0 H THR A 30 -9.702 -1.566 -4.254 1.00 0.00 H new ATOM 0 HA THR A 30 -11.419 0.762 -4.821 1.00 0.00 H new ATOM 0 HB THR A 30 -13.063 -1.008 -5.594 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.091 -3.076 -6.158 1.00 0.00 H new ATOM 0 HG21 THR A 30 -12.015 -1.349 -7.798 1.00 0.00 H new ATOM 0 HG22 THR A 30 -11.802 0.319 -7.213 1.00 0.00 H new ATOM 0 HG23 THR A 30 -10.449 -0.834 -7.126 1.00 0.00 H new ATOM 448 N VAL A 31 -13.200 0.035 -3.070 1.00 0.00 N ATOM 449 CA VAL A 31 -13.995 -0.191 -1.878 1.00 0.00 C ATOM 450 C VAL A 31 -14.942 -1.360 -2.112 1.00 0.00 C ATOM 451 O VAL A 31 -15.825 -1.291 -2.963 1.00 0.00 O ATOM 452 CB VAL A 31 -14.810 1.057 -1.490 1.00 0.00 C ATOM 453 CG1 VAL A 31 -15.497 0.852 -0.150 1.00 0.00 C ATOM 454 CG2 VAL A 31 -13.923 2.294 -1.460 1.00 0.00 C ATOM 0 H VAL A 31 -13.618 0.677 -3.743 1.00 0.00 H new ATOM 0 HA VAL A 31 -13.312 -0.416 -1.059 1.00 0.00 H new ATOM 0 HB VAL A 31 -15.579 1.212 -2.247 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -16.068 1.745 0.107 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -16.170 -0.003 -0.213 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.747 0.667 0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.520 3.163 -1.184 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -13.127 2.153 -0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.486 2.452 -2.446 1.00 0.00 H new ATOM 464 N THR A 32 -14.747 -2.433 -1.365 1.00 0.00 N ATOM 465 CA THR A 32 -15.567 -3.623 -1.528 1.00 0.00 C ATOM 466 C THR A 32 -16.990 -3.359 -1.052 1.00 0.00 C ATOM 467 O THR A 32 -17.240 -2.402 -0.316 1.00 0.00 O ATOM 468 CB THR A 32 -14.982 -4.839 -0.772 1.00 0.00 C ATOM 469 OG1 THR A 32 -14.825 -4.536 0.621 1.00 0.00 O ATOM 470 CG2 THR A 32 -13.638 -5.249 -1.357 1.00 0.00 C ATOM 0 H THR A 32 -14.031 -2.506 -0.642 1.00 0.00 H new ATOM 0 HA THR A 32 -15.576 -3.862 -2.591 1.00 0.00 H new ATOM 0 HB THR A 32 -15.681 -5.668 -0.884 1.00 0.00 H new ATOM 0 HG1 THR A 32 -14.731 -3.567 0.736 1.00 0.00 H new ATOM 0 HG21 THR A 32 -13.248 -6.106 -0.808 1.00 0.00 H new ATOM 0 HG22 THR A 32 -13.764 -5.517 -2.406 1.00 0.00 H new ATOM 0 HG23 THR A 32 -12.938 -4.418 -1.277 1.00 0.00 H new ATOM 478 N ASP A 33 -17.913 -4.218 -1.458 1.00 0.00 N ATOM 479 CA ASP A 33 -19.325 -4.039 -1.140 1.00 0.00 C ATOM 480 C ASP A 33 -19.568 -4.108 0.369 1.00 0.00 C ATOM 481 O ASP A 33 -20.583 -3.624 0.869 1.00 0.00 O ATOM 482 CB ASP A 33 -20.157 -5.095 -1.864 1.00 0.00 C ATOM 483 CG ASP A 33 -21.637 -4.789 -1.831 1.00 0.00 C ATOM 484 OD1 ASP A 33 -22.051 -3.775 -2.436 1.00 0.00 O ATOM 485 OD2 ASP A 33 -22.400 -5.566 -1.221 1.00 0.00 O ATOM 0 H ASP A 33 -17.710 -5.050 -2.011 1.00 0.00 H new ATOM 0 HA ASP A 33 -19.630 -3.049 -1.479 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -19.827 -5.165 -2.900 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -19.980 -6.068 -1.407 1.00 0.00 H new ATOM 490 N ASP A 34 -18.612 -4.691 1.087 1.00 0.00 N ATOM 491 CA ASP A 34 -18.692 -4.795 2.545 1.00 0.00 C ATOM 492 C ASP A 34 -18.394 -3.454 3.209 1.00 0.00 C ATOM 493 O ASP A 34 -18.705 -3.250 4.381 1.00 0.00 O ATOM 494 CB ASP A 34 -17.689 -5.825 3.079 1.00 0.00 C ATOM 495 CG ASP A 34 -17.826 -7.194 2.448 1.00 0.00 C ATOM 496 OD1 ASP A 34 -18.753 -7.937 2.817 1.00 0.00 O ATOM 497 OD2 ASP A 34 -16.979 -7.538 1.597 1.00 0.00 O ATOM 0 H ASP A 34 -17.770 -5.100 0.683 1.00 0.00 H new ATOM 0 HA ASP A 34 -19.708 -5.108 2.784 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -16.678 -5.456 2.908 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -17.817 -5.918 4.158 1.00 0.00 H new ATOM 502 N GLY A 35 -17.775 -2.550 2.461 1.00 0.00 N ATOM 503 CA GLY A 35 -17.330 -1.292 3.034 1.00 0.00 C ATOM 504 C GLY A 35 -15.859 -1.334 3.389 1.00 0.00 C ATOM 505 O GLY A 35 -15.286 -0.349 3.854 1.00 0.00 O ATOM 0 H GLY A 35 -17.573 -2.664 1.468 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.511 -0.484 2.325 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -17.915 -1.071 3.927 1.00 0.00 H new ATOM 509 N ASP A 36 -15.253 -2.490 3.165 1.00 0.00 N ATOM 510 CA ASP A 36 -13.833 -2.696 3.436 1.00 0.00 C ATOM 511 C ASP A 36 -13.028 -2.405 2.168 1.00 0.00 C ATOM 512 O ASP A 36 -13.605 -2.259 1.094 1.00 0.00 O ATOM 513 CB ASP A 36 -13.613 -4.137 3.916 1.00 0.00 C ATOM 514 CG ASP A 36 -12.176 -4.442 4.284 1.00 0.00 C ATOM 515 OD1 ASP A 36 -11.709 -3.972 5.342 1.00 0.00 O ATOM 516 OD2 ASP A 36 -11.514 -5.180 3.537 1.00 0.00 O ATOM 0 H ASP A 36 -15.728 -3.312 2.791 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.495 -2.018 4.219 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.248 -4.323 4.782 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.932 -4.824 3.133 1.00 0.00 H new ATOM 521 N ASN A 37 -11.713 -2.322 2.275 1.00 0.00 N ATOM 522 CA ASN A 37 -10.889 -1.963 1.125 1.00 0.00 C ATOM 523 C ASN A 37 -10.211 -3.184 0.513 1.00 0.00 C ATOM 524 O ASN A 37 -9.829 -4.115 1.219 1.00 0.00 O ATOM 525 CB ASN A 37 -9.829 -0.926 1.522 1.00 0.00 C ATOM 526 CG ASN A 37 -8.777 -1.468 2.481 1.00 0.00 C ATOM 527 OD1 ASN A 37 -7.771 -2.039 2.060 1.00 0.00 O ATOM 528 ND2 ASN A 37 -8.992 -1.274 3.774 1.00 0.00 N ATOM 0 H ASN A 37 -11.194 -2.496 3.135 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.552 -1.532 0.375 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.335 -0.561 0.622 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.324 -0.071 1.983 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.311 -1.602 4.459 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.838 -0.796 4.084 1.00 0.00 H new ATOM 535 N ARG A 38 -10.095 -3.188 -0.809 1.00 0.00 N ATOM 536 CA ARG A 38 -9.298 -4.188 -1.502 1.00 0.00 C ATOM 537 C ARG A 38 -8.127 -3.521 -2.200 1.00 0.00 C ATOM 538 O ARG A 38 -8.316 -2.578 -2.966 1.00 0.00 O ATOM 539 CB ARG A 38 -10.114 -4.958 -2.543 1.00 0.00 C ATOM 540 CG ARG A 38 -9.256 -5.939 -3.332 1.00 0.00 C ATOM 541 CD ARG A 38 -9.966 -6.491 -4.555 1.00 0.00 C ATOM 542 NE ARG A 38 -9.060 -7.320 -5.357 1.00 0.00 N ATOM 543 CZ ARG A 38 -9.412 -7.973 -6.467 1.00 0.00 C ATOM 544 NH1 ARG A 38 -10.651 -7.882 -6.936 1.00 0.00 N ATOM 545 NH2 ARG A 38 -8.517 -8.711 -7.114 1.00 0.00 N ATOM 0 H ARG A 38 -10.544 -2.508 -1.422 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.947 -4.895 -0.750 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -10.918 -5.500 -2.045 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -10.582 -4.253 -3.230 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -8.338 -5.442 -3.644 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -8.966 -6.765 -2.682 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.827 -7.082 -4.244 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -10.346 -5.669 -5.162 1.00 0.00 H new ATOM 0 HE ARG A 38 -8.093 -7.404 -5.045 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -11.340 -7.311 -6.448 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -10.913 -8.384 -7.785 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -7.562 -8.778 -6.763 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -8.785 -9.210 -7.962 1.00 0.00 H new ATOM 559 N VAL A 39 -6.927 -4.016 -1.951 1.00 0.00 N ATOM 560 CA VAL A 39 -5.749 -3.507 -2.632 1.00 0.00 C ATOM 561 C VAL A 39 -5.630 -4.156 -4.005 1.00 0.00 C ATOM 562 O VAL A 39 -5.578 -5.382 -4.120 1.00 0.00 O ATOM 563 CB VAL A 39 -4.463 -3.761 -1.819 1.00 0.00 C ATOM 564 CG1 VAL A 39 -3.252 -3.174 -2.531 1.00 0.00 C ATOM 565 CG2 VAL A 39 -4.602 -3.180 -0.420 1.00 0.00 C ATOM 0 H VAL A 39 -6.743 -4.767 -1.285 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.865 -2.429 -2.740 1.00 0.00 H new ATOM 0 HB VAL A 39 -4.313 -4.837 -1.732 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.355 -3.364 -1.941 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.146 -3.638 -3.512 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.386 -2.099 -2.651 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -3.688 -3.366 0.144 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -4.775 -2.106 -0.488 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.443 -3.651 0.088 1.00 0.00 H new ATOM 575 N ALA A 40 -5.618 -3.331 -5.041 1.00 0.00 N ATOM 576 CA ALA A 40 -5.568 -3.829 -6.410 1.00 0.00 C ATOM 577 C ALA A 40 -4.328 -3.323 -7.134 1.00 0.00 C ATOM 578 O ALA A 40 -3.884 -3.924 -8.109 1.00 0.00 O ATOM 579 CB ALA A 40 -6.823 -3.424 -7.167 1.00 0.00 C ATOM 0 H ALA A 40 -5.642 -2.314 -4.962 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.516 -4.917 -6.370 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.771 -3.803 -8.188 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.699 -3.841 -6.669 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.901 -2.337 -7.187 1.00 0.00 H new ATOM 585 N ALA A 41 -3.774 -2.217 -6.653 1.00 0.00 N ATOM 586 CA ALA A 41 -2.588 -1.629 -7.254 1.00 0.00 C ATOM 587 C ALA A 41 -1.574 -1.261 -6.179 1.00 0.00 C ATOM 588 O ALA A 41 -1.943 -0.912 -5.053 1.00 0.00 O ATOM 589 CB ALA A 41 -2.958 -0.404 -8.078 1.00 0.00 C ATOM 0 H ALA A 41 -4.131 -1.708 -5.844 1.00 0.00 H new ATOM 0 HA ALA A 41 -2.137 -2.366 -7.918 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -2.058 0.023 -8.520 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -3.649 -0.693 -8.870 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.433 0.337 -7.435 1.00 0.00 H new ATOM 595 N LEU A 42 -0.301 -1.335 -6.527 1.00 0.00 N ATOM 596 CA LEU A 42 0.766 -1.061 -5.580 1.00 0.00 C ATOM 597 C LEU A 42 1.724 -0.021 -6.133 1.00 0.00 C ATOM 598 O LEU A 42 2.021 -0.008 -7.329 1.00 0.00 O ATOM 599 CB LEU A 42 1.528 -2.346 -5.267 1.00 0.00 C ATOM 600 CG LEU A 42 0.713 -3.434 -4.577 1.00 0.00 C ATOM 601 CD1 LEU A 42 1.510 -4.720 -4.512 1.00 0.00 C ATOM 602 CD2 LEU A 42 0.311 -2.986 -3.184 1.00 0.00 C ATOM 0 H LEU A 42 0.020 -1.584 -7.463 1.00 0.00 H new ATOM 0 HA LEU A 42 0.320 -0.671 -4.665 1.00 0.00 H new ATOM 0 HB2 LEU A 42 1.927 -2.749 -6.198 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.381 -2.098 -4.636 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.193 -3.616 -5.155 1.00 0.00 H new ATOM 0 HD11 LEU A 42 0.918 -5.490 -4.017 1.00 0.00 H new ATOM 0 HD12 LEU A 42 1.758 -5.046 -5.522 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.428 -4.551 -3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.270 -3.772 -2.703 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.205 -2.783 -2.595 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.291 -2.080 -3.253 1.00 0.00 H new ATOM 614 N HIS A 43 2.201 0.852 -5.265 1.00 0.00 N ATOM 615 CA HIS A 43 3.151 1.873 -5.665 1.00 0.00 C ATOM 616 C HIS A 43 4.056 2.229 -4.492 1.00 0.00 C ATOM 617 O HIS A 43 3.579 2.625 -3.433 1.00 0.00 O ATOM 618 CB HIS A 43 2.404 3.114 -6.168 1.00 0.00 C ATOM 619 CG HIS A 43 3.276 4.083 -6.906 1.00 0.00 C ATOM 620 ND1 HIS A 43 3.344 4.135 -8.281 1.00 0.00 N ATOM 621 CD2 HIS A 43 4.123 5.036 -6.455 1.00 0.00 C ATOM 622 CE1 HIS A 43 4.198 5.074 -8.642 1.00 0.00 C ATOM 623 NE2 HIS A 43 4.688 5.636 -7.552 1.00 0.00 N ATOM 0 H HIS A 43 1.946 0.874 -4.278 1.00 0.00 H new ATOM 0 HA HIS A 43 3.770 1.490 -6.476 1.00 0.00 H new ATOM 0 HB2 HIS A 43 1.592 2.798 -6.823 1.00 0.00 H new ATOM 0 HB3 HIS A 43 1.949 3.623 -5.318 1.00 0.00 H new ATOM 0 HD2 HIS A 43 4.319 5.280 -5.421 1.00 0.00 H new ATOM 0 HE1 HIS A 43 4.453 5.338 -9.658 1.00 0.00 H new ATOM 0 HE2 HIS A 43 5.373 6.391 -7.529 1.00 0.00 H new ATOM 632 N ARG A 44 5.360 2.083 -4.683 1.00 0.00 N ATOM 633 CA ARG A 44 6.315 2.359 -3.616 1.00 0.00 C ATOM 634 C ARG A 44 6.783 3.810 -3.679 1.00 0.00 C ATOM 635 O ARG A 44 6.982 4.356 -4.765 1.00 0.00 O ATOM 636 CB ARG A 44 7.511 1.384 -3.654 1.00 0.00 C ATOM 637 CG ARG A 44 8.617 1.712 -4.662 1.00 0.00 C ATOM 638 CD ARG A 44 8.179 1.526 -6.108 1.00 0.00 C ATOM 639 NE ARG A 44 7.896 2.801 -6.764 1.00 0.00 N ATOM 640 CZ ARG A 44 7.864 2.975 -8.084 1.00 0.00 C ATOM 641 NH1 ARG A 44 8.066 1.952 -8.906 1.00 0.00 N ATOM 642 NH2 ARG A 44 7.646 4.182 -8.585 1.00 0.00 N ATOM 0 H ARG A 44 5.780 1.777 -5.561 1.00 0.00 H new ATOM 0 HA ARG A 44 5.806 2.204 -2.665 1.00 0.00 H new ATOM 0 HB2 ARG A 44 7.954 1.346 -2.659 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.133 0.385 -3.873 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.940 2.743 -4.516 1.00 0.00 H new ATOM 0 HG3 ARG A 44 9.480 1.076 -4.465 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.960 1.001 -6.658 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.289 0.897 -6.139 1.00 0.00 H new ATOM 0 HE ARG A 44 7.711 3.611 -6.172 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.248 1.022 -8.528 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.039 2.096 -9.915 1.00 0.00 H new ATOM 0 HH21 ARG A 44 7.503 4.975 -7.960 1.00 0.00 H new ATOM 0 HH22 ARG A 44 7.621 4.318 -9.596 1.00 0.00 H new ATOM 656 N ALA A 45 6.915 4.437 -2.519 1.00 0.00 N ATOM 657 CA ALA A 45 7.350 5.826 -2.435 1.00 0.00 C ATOM 658 C ALA A 45 8.856 5.942 -2.668 1.00 0.00 C ATOM 659 O ALA A 45 9.617 6.314 -1.772 1.00 0.00 O ATOM 660 CB ALA A 45 6.968 6.421 -1.088 1.00 0.00 C ATOM 0 H ALA A 45 6.726 4.003 -1.616 1.00 0.00 H new ATOM 0 HA ALA A 45 6.844 6.390 -3.219 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.300 7.458 -1.041 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.886 6.380 -0.966 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.445 5.851 -0.290 1.00 0.00 H new ATOM 666 N THR A 46 9.274 5.581 -3.868 1.00 0.00 N ATOM 667 CA THR A 46 10.660 5.679 -4.285 1.00 0.00 C ATOM 668 C THR A 46 10.700 5.868 -5.795 1.00 0.00 C ATOM 669 O THR A 46 10.027 5.144 -6.528 1.00 0.00 O ATOM 670 CB THR A 46 11.462 4.420 -3.902 1.00 0.00 C ATOM 671 OG1 THR A 46 11.202 4.071 -2.538 1.00 0.00 O ATOM 672 CG2 THR A 46 12.955 4.653 -4.081 1.00 0.00 C ATOM 0 H THR A 46 8.654 5.208 -4.587 1.00 0.00 H new ATOM 0 HA THR A 46 11.116 6.528 -3.776 1.00 0.00 H new ATOM 0 HB THR A 46 11.150 3.608 -4.558 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.034 3.779 -2.111 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.500 3.750 -3.804 1.00 0.00 H new ATOM 0 HG22 THR A 46 13.163 4.897 -5.123 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.273 5.478 -3.444 1.00 0.00 H new ATOM 680 N ASN A 47 11.482 6.831 -6.253 1.00 0.00 N ATOM 681 CA ASN A 47 11.459 7.230 -7.658 1.00 0.00 C ATOM 682 C ASN A 47 12.079 6.166 -8.552 1.00 0.00 C ATOM 683 O ASN A 47 13.258 5.838 -8.426 1.00 0.00 O ATOM 684 CB ASN A 47 12.184 8.567 -7.859 1.00 0.00 C ATOM 685 CG ASN A 47 11.402 9.764 -7.337 1.00 0.00 C ATOM 686 OD1 ASN A 47 10.560 9.543 -6.342 1.00 0.00 O flip ATOM 687 ND2 ASN A 47 11.546 10.879 -7.839 1.00 0.00 N flip ATOM 0 H ASN A 47 12.142 7.353 -5.676 1.00 0.00 H new ATOM 0 HA ASN A 47 10.413 7.348 -7.942 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.150 8.527 -7.356 1.00 0.00 H new ATOM 0 HB3 ASN A 47 12.383 8.708 -8.921 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.205 11.012 -8.606 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.006 11.670 -7.488 1.00 0.00 H new ATOM 694 N ARG A 48 11.260 5.608 -9.430 1.00 0.00 N ATOM 695 CA ARG A 48 11.734 4.690 -10.461 1.00 0.00 C ATOM 696 C ARG A 48 11.482 5.300 -11.832 1.00 0.00 C ATOM 697 O ARG A 48 10.412 5.115 -12.417 1.00 0.00 O ATOM 698 CB ARG A 48 11.046 3.317 -10.362 1.00 0.00 C ATOM 699 CG ARG A 48 11.752 2.329 -9.444 1.00 0.00 C ATOM 700 CD ARG A 48 11.723 2.771 -7.992 1.00 0.00 C ATOM 701 NE ARG A 48 12.590 1.947 -7.151 1.00 0.00 N ATOM 702 CZ ARG A 48 13.795 2.338 -6.731 1.00 0.00 C ATOM 703 NH1 ARG A 48 14.283 3.517 -7.110 1.00 0.00 N ATOM 704 NH2 ARG A 48 14.516 1.555 -5.939 1.00 0.00 N ATOM 0 H ARG A 48 10.254 5.775 -9.451 1.00 0.00 H new ATOM 0 HA ARG A 48 12.802 4.533 -10.312 1.00 0.00 H new ATOM 0 HB2 ARG A 48 10.025 3.460 -10.007 1.00 0.00 H new ATOM 0 HB3 ARG A 48 10.979 2.884 -11.360 1.00 0.00 H new ATOM 0 HG2 ARG A 48 11.279 1.351 -9.533 1.00 0.00 H new ATOM 0 HG3 ARG A 48 12.787 2.213 -9.766 1.00 0.00 H new ATOM 0 HD2 ARG A 48 12.036 3.813 -7.924 1.00 0.00 H new ATOM 0 HD3 ARG A 48 10.700 2.720 -7.618 1.00 0.00 H new ATOM 0 HE ARG A 48 12.256 1.025 -6.871 1.00 0.00 H new ATOM 0 HH11 ARG A 48 13.736 4.123 -7.722 1.00 0.00 H new ATOM 0 HH12 ARG A 48 15.204 3.815 -6.788 1.00 0.00 H new ATOM 0 HH21 ARG A 48 14.150 0.649 -5.648 1.00 0.00 H new ATOM 0 HH22 ARG A 48 15.436 1.859 -5.621 1.00 0.00 H new ATOM 718 N ARG A 49 12.456 6.054 -12.326 1.00 0.00 N ATOM 719 CA ARG A 49 12.294 6.776 -13.580 1.00 0.00 C ATOM 720 C ARG A 49 13.560 6.686 -14.429 1.00 0.00 C ATOM 721 O ARG A 49 14.581 7.302 -14.118 1.00 0.00 O ATOM 722 CB ARG A 49 11.930 8.245 -13.299 1.00 0.00 C ATOM 723 CG ARG A 49 11.565 9.060 -14.538 1.00 0.00 C ATOM 724 CD ARG A 49 12.785 9.710 -15.182 1.00 0.00 C ATOM 725 NE ARG A 49 13.366 10.759 -14.339 1.00 0.00 N ATOM 726 CZ ARG A 49 14.497 11.408 -14.629 1.00 0.00 C ATOM 727 NH1 ARG A 49 15.180 11.107 -15.726 1.00 0.00 N ATOM 728 NH2 ARG A 49 14.937 12.365 -13.826 1.00 0.00 N ATOM 0 H ARG A 49 13.364 6.181 -11.878 1.00 0.00 H new ATOM 0 HA ARG A 49 11.482 6.315 -14.143 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.091 8.271 -12.604 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.772 8.725 -12.800 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.075 8.412 -15.265 1.00 0.00 H new ATOM 0 HG3 ARG A 49 10.847 9.832 -14.264 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.538 8.947 -15.380 1.00 0.00 H new ATOM 0 HD3 ARG A 49 12.502 10.136 -16.145 1.00 0.00 H new ATOM 0 HE ARG A 49 12.877 11.008 -13.479 1.00 0.00 H new ATOM 0 HH11 ARG A 49 14.842 10.377 -16.353 1.00 0.00 H new ATOM 0 HH12 ARG A 49 16.043 11.606 -15.942 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.412 12.607 -12.985 1.00 0.00 H new ATOM 0 HH22 ARG A 49 15.801 12.860 -14.048 1.00 0.00 H new ATOM 742 N SER A 50 13.492 5.892 -15.486 1.00 0.00 N ATOM 743 CA SER A 50 14.556 5.829 -16.470 1.00 0.00 C ATOM 744 C SER A 50 14.259 6.820 -17.595 1.00 0.00 C ATOM 745 O SER A 50 13.224 7.491 -17.571 1.00 0.00 O ATOM 746 CB SER A 50 14.659 4.408 -17.023 1.00 0.00 C ATOM 747 OG SER A 50 14.755 3.460 -15.971 1.00 0.00 O ATOM 0 H SER A 50 12.702 5.278 -15.683 1.00 0.00 H new ATOM 0 HA SER A 50 15.507 6.092 -16.006 1.00 0.00 H new ATOM 0 HB2 SER A 50 13.786 4.188 -17.637 1.00 0.00 H new ATOM 0 HB3 SER A 50 15.532 4.328 -17.671 1.00 0.00 H new ATOM 0 HG SER A 50 14.818 2.558 -16.348 1.00 0.00 H new ATOM 753 N GLU A 51 15.151 6.924 -18.573 1.00 0.00 N ATOM 754 CA GLU A 51 14.903 7.804 -19.705 1.00 0.00 C ATOM 755 C GLU A 51 13.963 7.132 -20.695 1.00 0.00 C ATOM 756 O GLU A 51 14.395 6.493 -21.657 1.00 0.00 O ATOM 757 CB GLU A 51 16.207 8.209 -20.391 1.00 0.00 C ATOM 758 CG GLU A 51 17.093 9.097 -19.532 1.00 0.00 C ATOM 759 CD GLU A 51 18.351 9.524 -20.252 1.00 0.00 C ATOM 760 OE1 GLU A 51 19.366 8.801 -20.161 1.00 0.00 O ATOM 761 OE2 GLU A 51 18.335 10.583 -20.914 1.00 0.00 O ATOM 0 H GLU A 51 16.037 6.419 -18.605 1.00 0.00 H new ATOM 0 HA GLU A 51 14.431 8.713 -19.331 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.761 7.310 -20.662 1.00 0.00 H new ATOM 0 HB3 GLU A 51 15.973 8.731 -21.319 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.532 9.982 -19.230 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.363 8.564 -18.620 1.00 0.00 H new ATOM 768 N GLN A 52 12.674 7.250 -20.421 1.00 0.00 N ATOM 769 CA GLN A 52 11.649 6.671 -21.271 1.00 0.00 C ATOM 770 C GLN A 52 10.948 7.765 -22.066 1.00 0.00 C ATOM 771 O GLN A 52 10.658 8.844 -21.539 1.00 0.00 O ATOM 772 CB GLN A 52 10.641 5.882 -20.428 1.00 0.00 C ATOM 773 CG GLN A 52 10.025 6.687 -19.294 1.00 0.00 C ATOM 774 CD GLN A 52 9.109 5.856 -18.418 1.00 0.00 C ATOM 775 OE1 GLN A 52 7.836 5.812 -18.768 1.00 0.00 O flip ATOM 776 NE2 GLN A 52 9.544 5.260 -17.433 1.00 0.00 N flip ATOM 0 H GLN A 52 12.311 7.747 -19.608 1.00 0.00 H new ATOM 0 HA GLN A 52 12.120 5.982 -21.972 1.00 0.00 H new ATOM 0 HB2 GLN A 52 9.845 5.518 -21.077 1.00 0.00 H new ATOM 0 HB3 GLN A 52 11.137 5.006 -20.011 1.00 0.00 H new ATOM 0 HG2 GLN A 52 10.820 7.112 -18.681 1.00 0.00 H new ATOM 0 HG3 GLN A 52 9.463 7.523 -19.711 1.00 0.00 H new ATOM 0 HE21 GLN A 52 10.535 5.320 -17.197 1.00 0.00 H new ATOM 0 HE22 GLN A 52 8.914 4.706 -16.853 1.00 0.00 H new ATOM 785 N ARG A 53 10.683 7.487 -23.329 1.00 0.00 N ATOM 786 CA ARG A 53 10.090 8.476 -24.208 1.00 0.00 C ATOM 787 C ARG A 53 8.582 8.279 -24.302 1.00 0.00 C ATOM 788 O ARG A 53 8.088 7.528 -25.146 1.00 0.00 O ATOM 789 CB ARG A 53 10.727 8.413 -25.595 1.00 0.00 C ATOM 790 CG ARG A 53 10.272 9.529 -26.515 1.00 0.00 C ATOM 791 CD ARG A 53 10.934 9.439 -27.876 1.00 0.00 C ATOM 792 NE ARG A 53 10.523 10.541 -28.742 1.00 0.00 N ATOM 793 CZ ARG A 53 10.777 10.605 -30.045 1.00 0.00 C ATOM 794 NH1 ARG A 53 11.435 9.622 -30.649 1.00 0.00 N ATOM 795 NH2 ARG A 53 10.369 11.652 -30.748 1.00 0.00 N ATOM 0 H ARG A 53 10.869 6.585 -23.768 1.00 0.00 H new ATOM 0 HA ARG A 53 10.280 9.463 -23.787 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.811 8.456 -25.492 1.00 0.00 H new ATOM 0 HB3 ARG A 53 10.488 7.453 -26.054 1.00 0.00 H new ATOM 0 HG2 ARG A 53 9.189 9.484 -26.633 1.00 0.00 H new ATOM 0 HG3 ARG A 53 10.504 10.492 -26.061 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.017 9.452 -27.757 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.677 8.490 -28.346 1.00 0.00 H new ATOM 0 HE ARG A 53 10.007 11.312 -28.319 1.00 0.00 H new ATOM 0 HH11 ARG A 53 11.748 8.813 -30.113 1.00 0.00 H new ATOM 0 HH12 ARG A 53 11.627 9.676 -31.649 1.00 0.00 H new ATOM 0 HH21 ARG A 53 9.861 12.408 -30.289 1.00 0.00 H new ATOM 0 HH22 ARG A 53 10.564 11.702 -31.748 1.00 0.00 H new ATOM 809 N THR A 54 7.862 8.940 -23.412 1.00 0.00 N ATOM 810 CA THR A 54 6.415 8.877 -23.393 1.00 0.00 C ATOM 811 C THR A 54 5.868 10.054 -22.594 1.00 0.00 C ATOM 812 O THR A 54 6.630 10.766 -21.933 1.00 0.00 O ATOM 813 CB THR A 54 5.920 7.542 -22.787 1.00 0.00 C ATOM 814 OG1 THR A 54 4.500 7.417 -22.940 1.00 0.00 O ATOM 815 CG2 THR A 54 6.285 7.440 -21.311 1.00 0.00 C ATOM 0 H THR A 54 8.264 9.533 -22.686 1.00 0.00 H new ATOM 0 HA THR A 54 6.051 8.930 -24.419 1.00 0.00 H new ATOM 0 HB THR A 54 6.413 6.732 -23.325 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.203 6.567 -22.553 1.00 0.00 H new ATOM 0 HG21 THR A 54 5.925 6.492 -20.912 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.368 7.493 -21.200 1.00 0.00 H new ATOM 0 HG23 THR A 54 5.824 8.263 -20.764 1.00 0.00 H new ATOM 823 N ARG A 55 4.564 10.261 -22.656 1.00 0.00 N ATOM 824 CA ARG A 55 3.942 11.369 -21.951 1.00 0.00 C ATOM 825 C ARG A 55 3.674 11.004 -20.500 1.00 0.00 C ATOM 826 O ARG A 55 3.345 9.858 -20.179 1.00 0.00 O ATOM 827 CB ARG A 55 2.655 11.808 -22.647 1.00 0.00 C ATOM 828 CG ARG A 55 2.909 12.513 -23.967 1.00 0.00 C ATOM 829 CD ARG A 55 1.631 13.071 -24.566 1.00 0.00 C ATOM 830 NE ARG A 55 1.902 13.944 -25.709 1.00 0.00 N ATOM 831 CZ ARG A 55 0.955 14.543 -26.434 1.00 0.00 C ATOM 832 NH1 ARG A 55 -0.322 14.397 -26.108 1.00 0.00 N ATOM 833 NH2 ARG A 55 1.286 15.315 -27.462 1.00 0.00 N ATOM 0 H ARG A 55 3.916 9.678 -23.186 1.00 0.00 H new ATOM 0 HA ARG A 55 4.636 12.209 -21.967 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.026 10.935 -22.822 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.099 12.473 -21.986 1.00 0.00 H new ATOM 0 HG2 ARG A 55 3.622 13.323 -23.815 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.365 11.815 -24.669 1.00 0.00 H new ATOM 0 HD2 ARG A 55 0.988 12.249 -24.881 1.00 0.00 H new ATOM 0 HD3 ARG A 55 1.086 13.628 -23.804 1.00 0.00 H new ATOM 0 HE ARG A 55 2.875 14.105 -25.968 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -0.581 13.827 -25.303 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -1.045 14.855 -26.662 1.00 0.00 H new ATOM 0 HH21 ARG A 55 2.268 15.453 -27.701 1.00 0.00 H new ATOM 0 HH22 ARG A 55 0.558 15.770 -28.013 1.00 0.00 H new ATOM 847 N ARG A 56 3.820 11.988 -19.631 1.00 0.00 N ATOM 848 CA ARG A 56 3.731 11.768 -18.197 1.00 0.00 C ATOM 849 C ARG A 56 2.304 11.965 -17.714 1.00 0.00 C ATOM 850 O ARG A 56 1.543 12.732 -18.304 1.00 0.00 O ATOM 851 CB ARG A 56 4.660 12.735 -17.443 1.00 0.00 C ATOM 852 CG ARG A 56 6.153 12.426 -17.552 1.00 0.00 C ATOM 853 CD ARG A 56 6.672 12.520 -18.984 1.00 0.00 C ATOM 854 NE ARG A 56 6.299 13.775 -19.638 1.00 0.00 N ATOM 855 CZ ARG A 56 6.832 14.209 -20.781 1.00 0.00 C ATOM 856 NH1 ARG A 56 7.833 13.543 -21.354 1.00 0.00 N ATOM 857 NH2 ARG A 56 6.372 15.324 -21.338 1.00 0.00 N ATOM 0 H ARG A 56 4.002 12.956 -19.896 1.00 0.00 H new ATOM 0 HA ARG A 56 4.040 10.742 -17.996 1.00 0.00 H new ATOM 0 HB2 ARG A 56 4.487 13.744 -17.816 1.00 0.00 H new ATOM 0 HB3 ARG A 56 4.381 12.733 -16.389 1.00 0.00 H new ATOM 0 HG2 ARG A 56 6.710 13.119 -16.922 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.341 11.424 -17.167 1.00 0.00 H new ATOM 0 HD2 ARG A 56 7.758 12.426 -18.980 1.00 0.00 H new ATOM 0 HD3 ARG A 56 6.282 11.683 -19.563 1.00 0.00 H new ATOM 0 HE ARG A 56 5.587 14.354 -19.192 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.197 12.695 -20.919 1.00 0.00 H new ATOM 0 HH12 ARG A 56 8.236 13.881 -22.228 1.00 0.00 H new ATOM 0 HH21 ARG A 56 5.616 15.843 -20.892 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.775 15.661 -22.212 1.00 0.00 H new ATOM 871 N TYR A 57 1.936 11.259 -16.652 1.00 0.00 N ATOM 872 CA TYR A 57 0.652 11.484 -16.001 1.00 0.00 C ATOM 873 C TYR A 57 0.672 12.853 -15.334 1.00 0.00 C ATOM 874 O TYR A 57 -0.294 13.608 -15.388 1.00 0.00 O ATOM 875 CB TYR A 57 0.373 10.394 -14.960 1.00 0.00 C ATOM 876 CG TYR A 57 0.555 8.987 -15.485 1.00 0.00 C ATOM 877 CD1 TYR A 57 -0.415 8.384 -16.276 1.00 0.00 C ATOM 878 CD2 TYR A 57 1.701 8.263 -15.185 1.00 0.00 C ATOM 879 CE1 TYR A 57 -0.248 7.097 -16.751 1.00 0.00 C ATOM 880 CE2 TYR A 57 1.876 6.978 -15.657 1.00 0.00 C ATOM 881 CZ TYR A 57 0.901 6.400 -16.441 1.00 0.00 C ATOM 882 OH TYR A 57 1.072 5.118 -16.908 1.00 0.00 O ATOM 0 H TYR A 57 2.506 10.529 -16.225 1.00 0.00 H new ATOM 0 HA TYR A 57 -0.141 11.447 -16.748 1.00 0.00 H new ATOM 0 HB2 TYR A 57 1.035 10.542 -14.107 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.648 10.506 -14.595 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -1.314 8.930 -16.524 1.00 0.00 H new ATOM 0 HD2 TYR A 57 2.468 8.713 -14.572 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -1.013 6.640 -17.361 1.00 0.00 H new ATOM 0 HE2 TYR A 57 2.773 6.428 -15.413 1.00 0.00 H new ATOM 0 HH TYR A 57 1.935 4.770 -16.600 1.00 0.00 H new ATOM 892 N GLU A 58 1.803 13.155 -14.712 1.00 0.00 N ATOM 893 CA GLU A 58 2.052 14.461 -14.130 1.00 0.00 C ATOM 894 C GLU A 58 3.556 14.651 -13.980 1.00 0.00 C ATOM 895 O GLU A 58 4.166 15.452 -14.689 1.00 0.00 O ATOM 896 CB GLU A 58 1.356 14.598 -12.774 1.00 0.00 C ATOM 897 CG GLU A 58 1.494 15.982 -12.166 1.00 0.00 C ATOM 898 CD GLU A 58 0.823 16.101 -10.817 1.00 0.00 C ATOM 899 OE1 GLU A 58 1.468 15.783 -9.800 1.00 0.00 O ATOM 900 OE2 GLU A 58 -0.348 16.533 -10.765 1.00 0.00 O ATOM 0 H GLU A 58 2.574 12.497 -14.598 1.00 0.00 H new ATOM 0 HA GLU A 58 1.646 15.231 -14.786 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.298 14.364 -12.891 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.771 13.863 -12.084 1.00 0.00 H new ATOM 0 HG2 GLU A 58 2.552 16.224 -12.063 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.064 16.717 -12.846 1.00 0.00 H new ATOM 907 N LEU A 59 4.145 13.879 -13.073 1.00 0.00 N ATOM 908 CA LEU A 59 5.586 13.869 -12.867 1.00 0.00 C ATOM 909 C LEU A 59 5.945 12.712 -11.940 1.00 0.00 C ATOM 910 O LEU A 59 5.058 12.075 -11.373 1.00 0.00 O ATOM 911 CB LEU A 59 6.060 15.201 -12.264 1.00 0.00 C ATOM 912 CG LEU A 59 7.579 15.373 -12.161 1.00 0.00 C ATOM 913 CD1 LEU A 59 8.209 15.405 -13.545 1.00 0.00 C ATOM 914 CD2 LEU A 59 7.923 16.635 -11.388 1.00 0.00 C ATOM 0 H LEU A 59 3.635 13.243 -12.460 1.00 0.00 H new ATOM 0 HA LEU A 59 6.085 13.740 -13.827 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.659 16.016 -12.867 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.632 15.302 -11.267 1.00 0.00 H new ATOM 0 HG LEU A 59 7.984 14.518 -11.620 1.00 0.00 H new ATOM 0 HD11 LEU A 59 9.288 15.528 -13.451 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.994 14.471 -14.064 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.797 16.239 -14.113 1.00 0.00 H new ATOM 0 HD21 LEU A 59 9.006 16.740 -11.326 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.504 17.501 -11.900 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.506 16.571 -10.383 1.00 0.00 H new ATOM 926 N THR A 60 7.229 12.426 -11.802 1.00 0.00 N ATOM 927 CA THR A 60 7.674 11.388 -10.892 1.00 0.00 C ATOM 928 C THR A 60 8.100 12.010 -9.563 1.00 0.00 C ATOM 929 O THR A 60 8.855 12.985 -9.528 1.00 0.00 O ATOM 930 CB THR A 60 8.824 10.547 -11.501 1.00 0.00 C ATOM 931 OG1 THR A 60 9.229 9.512 -10.595 1.00 0.00 O ATOM 932 CG2 THR A 60 10.021 11.413 -11.857 1.00 0.00 C ATOM 0 H THR A 60 7.979 12.898 -12.308 1.00 0.00 H new ATOM 0 HA THR A 60 6.839 10.710 -10.716 1.00 0.00 H new ATOM 0 HB THR A 60 8.444 10.094 -12.417 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.128 9.203 -10.832 1.00 0.00 H new ATOM 0 HG21 THR A 60 10.808 10.789 -12.281 1.00 0.00 H new ATOM 0 HG22 THR A 60 9.721 12.166 -12.586 1.00 0.00 H new ATOM 0 HG23 THR A 60 10.393 11.906 -10.959 1.00 0.00 H new ATOM 940 N ALA A 61 7.590 11.453 -8.477 1.00 0.00 N ATOM 941 CA ALA A 61 7.851 11.977 -7.144 1.00 0.00 C ATOM 942 C ALA A 61 7.567 10.911 -6.102 1.00 0.00 C ATOM 943 O ALA A 61 8.273 10.804 -5.100 1.00 0.00 O ATOM 944 CB ALA A 61 7.004 13.215 -6.880 1.00 0.00 C ATOM 0 H ALA A 61 6.987 10.630 -8.492 1.00 0.00 H new ATOM 0 HA ALA A 61 8.901 12.261 -7.081 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.213 13.592 -5.879 1.00 0.00 H new ATOM 0 HB2 ALA A 61 7.244 13.984 -7.615 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.948 12.957 -6.957 1.00 0.00 H new ATOM 950 N ASP A 62 6.505 10.142 -6.348 1.00 0.00 N ATOM 951 CA ASP A 62 6.135 8.997 -5.508 1.00 0.00 C ATOM 952 C ASP A 62 5.677 9.446 -4.126 1.00 0.00 C ATOM 953 O ASP A 62 5.541 8.638 -3.208 1.00 0.00 O ATOM 954 CB ASP A 62 7.292 7.996 -5.402 1.00 0.00 C ATOM 955 CG ASP A 62 7.603 7.338 -6.732 1.00 0.00 C ATOM 956 OD1 ASP A 62 8.341 7.932 -7.536 1.00 0.00 O ATOM 957 OD2 ASP A 62 7.093 6.226 -6.984 1.00 0.00 O ATOM 0 H ASP A 62 5.875 10.294 -7.136 1.00 0.00 H new ATOM 0 HA ASP A 62 5.295 8.495 -5.988 1.00 0.00 H new ATOM 0 HB2 ASP A 62 8.181 8.509 -5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.041 7.229 -4.669 1.00 0.00 H new ATOM 962 N ASP A 63 5.428 10.743 -3.995 1.00 0.00 N ATOM 963 CA ASP A 63 4.854 11.308 -2.781 1.00 0.00 C ATOM 964 C ASP A 63 3.373 10.943 -2.708 1.00 0.00 C ATOM 965 O ASP A 63 2.799 10.504 -3.707 1.00 0.00 O ATOM 966 CB ASP A 63 5.045 12.831 -2.788 1.00 0.00 C ATOM 967 CG ASP A 63 4.374 13.531 -1.622 1.00 0.00 C ATOM 968 OD1 ASP A 63 4.996 13.630 -0.542 1.00 0.00 O ATOM 969 OD2 ASP A 63 3.221 13.989 -1.785 1.00 0.00 O ATOM 0 H ASP A 63 5.618 11.430 -4.724 1.00 0.00 H new ATOM 0 HA ASP A 63 5.356 10.902 -1.903 1.00 0.00 H new ATOM 0 HB2 ASP A 63 6.112 13.055 -2.771 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.649 13.234 -3.720 1.00 0.00 H new ATOM 974 N TYR A 64 2.757 11.124 -1.541 1.00 0.00 N ATOM 975 CA TYR A 64 1.355 10.768 -1.349 1.00 0.00 C ATOM 976 C TYR A 64 0.465 11.408 -2.411 1.00 0.00 C ATOM 977 O TYR A 64 -0.391 10.741 -2.984 1.00 0.00 O ATOM 978 CB TYR A 64 0.869 11.178 0.048 1.00 0.00 C ATOM 979 CG TYR A 64 -0.579 10.810 0.308 1.00 0.00 C ATOM 980 CD1 TYR A 64 -0.920 9.551 0.783 1.00 0.00 C ATOM 981 CD2 TYR A 64 -1.605 11.715 0.057 1.00 0.00 C ATOM 982 CE1 TYR A 64 -2.239 9.203 1.000 1.00 0.00 C ATOM 983 CE2 TYR A 64 -2.927 11.375 0.276 1.00 0.00 C ATOM 984 CZ TYR A 64 -3.238 10.118 0.746 1.00 0.00 C ATOM 985 OH TYR A 64 -4.554 9.771 0.955 1.00 0.00 O ATOM 0 H TYR A 64 3.208 11.516 -0.714 1.00 0.00 H new ATOM 0 HA TYR A 64 1.284 9.685 -1.445 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.499 10.701 0.799 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.991 12.255 0.167 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -0.141 8.831 0.986 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -1.365 12.700 -0.315 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -2.487 8.218 1.367 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -3.712 12.091 0.080 1.00 0.00 H new ATOM 0 HH TYR A 64 -4.601 9.055 1.622 1.00 0.00 H new ATOM 995 N ARG A 65 0.666 12.697 -2.674 1.00 0.00 N ATOM 996 CA ARG A 65 -0.136 13.409 -3.619 1.00 0.00 C ATOM 997 C ARG A 65 0.047 12.855 -5.027 1.00 0.00 C ATOM 998 O ARG A 65 -0.912 12.730 -5.786 1.00 0.00 O ATOM 999 CB ARG A 65 0.245 14.874 -3.578 1.00 0.00 C ATOM 1000 CG ARG A 65 -0.856 15.716 -4.118 1.00 0.00 C ATOM 1001 CD ARG A 65 -0.476 17.177 -4.276 1.00 0.00 C ATOM 1002 NE ARG A 65 -1.507 17.901 -5.014 1.00 0.00 N ATOM 1003 CZ ARG A 65 -1.942 19.123 -4.714 1.00 0.00 C ATOM 1004 NH1 ARG A 65 -1.389 19.818 -3.728 1.00 0.00 N ATOM 1005 NH2 ARG A 65 -2.925 19.654 -5.428 1.00 0.00 N ATOM 0 H ARG A 65 1.391 13.260 -2.231 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.186 13.290 -3.354 1.00 0.00 H new ATOM 0 HB2 ARG A 65 0.467 15.169 -2.552 1.00 0.00 H new ATOM 0 HB3 ARG A 65 1.153 15.036 -4.159 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.164 15.322 -5.086 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -1.718 15.642 -3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -0.338 17.630 -3.294 1.00 0.00 H new ATOM 0 HD3 ARG A 65 0.477 17.256 -4.800 1.00 0.00 H new ATOM 0 HE ARG A 65 -1.925 17.436 -5.820 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -0.621 19.417 -3.190 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -1.732 20.753 -3.509 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -3.339 19.127 -6.197 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -3.267 20.589 -5.208 1.00 0.00 H new ATOM 1019 N ALA A 66 1.286 12.531 -5.369 1.00 0.00 N ATOM 1020 CA ALA A 66 1.587 11.912 -6.654 1.00 0.00 C ATOM 1021 C ALA A 66 0.909 10.550 -6.766 1.00 0.00 C ATOM 1022 O ALA A 66 0.414 10.172 -7.830 1.00 0.00 O ATOM 1023 CB ALA A 66 3.091 11.774 -6.847 1.00 0.00 C ATOM 0 H ALA A 66 2.100 12.686 -4.775 1.00 0.00 H new ATOM 0 HA ALA A 66 1.198 12.558 -7.441 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.293 11.310 -7.812 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.554 12.760 -6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 66 3.504 11.153 -6.052 1.00 0.00 H new ATOM 1029 N ALA A 67 0.886 9.817 -5.658 1.00 0.00 N ATOM 1030 CA ALA A 67 0.204 8.530 -5.604 1.00 0.00 C ATOM 1031 C ALA A 67 -1.305 8.725 -5.689 1.00 0.00 C ATOM 1032 O ALA A 67 -2.010 7.910 -6.275 1.00 0.00 O ATOM 1033 CB ALA A 67 0.568 7.783 -4.329 1.00 0.00 C ATOM 0 H ALA A 67 1.333 10.093 -4.784 1.00 0.00 H new ATOM 0 HA ALA A 67 0.528 7.934 -6.457 1.00 0.00 H new ATOM 0 HB1 ALA A 67 0.049 6.825 -4.308 1.00 0.00 H new ATOM 0 HB2 ALA A 67 1.644 7.613 -4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 67 0.272 8.375 -3.463 1.00 0.00 H new ATOM 1039 N ASP A 68 -1.780 9.816 -5.100 1.00 0.00 N ATOM 1040 CA ASP A 68 -3.191 10.186 -5.153 1.00 0.00 C ATOM 1041 C ASP A 68 -3.621 10.427 -6.591 1.00 0.00 C ATOM 1042 O ASP A 68 -4.658 9.931 -7.032 1.00 0.00 O ATOM 1043 CB ASP A 68 -3.432 11.443 -4.314 1.00 0.00 C ATOM 1044 CG ASP A 68 -4.871 11.921 -4.360 1.00 0.00 C ATOM 1045 OD1 ASP A 68 -5.713 11.355 -3.630 1.00 0.00 O ATOM 1046 OD2 ASP A 68 -5.164 12.873 -5.116 1.00 0.00 O ATOM 0 H ASP A 68 -1.200 10.469 -4.573 1.00 0.00 H new ATOM 0 HA ASP A 68 -3.784 9.367 -4.746 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.155 11.241 -3.279 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.779 12.240 -4.669 1.00 0.00 H new ATOM 1051 N ALA A 69 -2.806 11.177 -7.323 1.00 0.00 N ATOM 1052 CA ALA A 69 -3.073 11.454 -8.728 1.00 0.00 C ATOM 1053 C ALA A 69 -3.019 10.174 -9.554 1.00 0.00 C ATOM 1054 O ALA A 69 -3.893 9.926 -10.385 1.00 0.00 O ATOM 1055 CB ALA A 69 -2.081 12.472 -9.264 1.00 0.00 C ATOM 0 H ALA A 69 -1.952 11.605 -6.965 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.078 11.869 -8.808 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.293 12.669 -10.315 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.168 13.399 -8.697 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.069 12.080 -9.166 1.00 0.00 H new ATOM 1061 N ALA A 70 -1.989 9.361 -9.317 1.00 0.00 N ATOM 1062 CA ALA A 70 -1.841 8.083 -10.008 1.00 0.00 C ATOM 1063 C ALA A 70 -3.003 7.155 -9.683 1.00 0.00 C ATOM 1064 O ALA A 70 -3.427 6.354 -10.519 1.00 0.00 O ATOM 1065 CB ALA A 70 -0.518 7.426 -9.642 1.00 0.00 C ATOM 0 H ALA A 70 -1.245 9.567 -8.651 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.846 8.275 -11.081 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.426 6.475 -10.167 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.305 8.080 -9.930 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.484 7.252 -8.567 1.00 0.00 H new ATOM 1071 N ALA A 71 -3.511 7.264 -8.462 1.00 0.00 N ATOM 1072 CA ALA A 71 -4.678 6.508 -8.052 1.00 0.00 C ATOM 1073 C ALA A 71 -5.874 6.885 -8.911 1.00 0.00 C ATOM 1074 O ALA A 71 -6.542 6.015 -9.459 1.00 0.00 O ATOM 1075 CB ALA A 71 -4.976 6.744 -6.580 1.00 0.00 C ATOM 0 H ALA A 71 -3.128 7.873 -7.739 1.00 0.00 H new ATOM 0 HA ALA A 71 -4.474 5.446 -8.190 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -5.855 6.169 -6.290 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -4.122 6.429 -5.981 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.165 7.804 -6.412 1.00 0.00 H new ATOM 1081 N GLN A 72 -6.115 8.184 -9.052 1.00 0.00 N ATOM 1082 CA GLN A 72 -7.222 8.678 -9.868 1.00 0.00 C ATOM 1083 C GLN A 72 -7.043 8.281 -11.331 1.00 0.00 C ATOM 1084 O GLN A 72 -8.013 7.966 -12.019 1.00 0.00 O ATOM 1085 CB GLN A 72 -7.342 10.199 -9.739 1.00 0.00 C ATOM 1086 CG GLN A 72 -7.665 10.663 -8.326 1.00 0.00 C ATOM 1087 CD GLN A 72 -9.041 10.221 -7.857 1.00 0.00 C ATOM 1088 OE1 GLN A 72 -9.978 10.098 -8.650 1.00 0.00 O ATOM 1089 NE2 GLN A 72 -9.171 9.957 -6.566 1.00 0.00 N ATOM 0 H GLN A 72 -5.558 8.916 -8.611 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.142 8.221 -9.503 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.407 10.658 -10.059 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.119 10.553 -10.416 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.911 10.275 -7.641 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -7.605 11.750 -8.284 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -8.374 10.070 -5.940 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -10.068 9.641 -6.198 1.00 0.00 H new ATOM 1098 N GLU A 73 -5.797 8.285 -11.795 1.00 0.00 N ATOM 1099 CA GLU A 73 -5.467 7.829 -13.138 1.00 0.00 C ATOM 1100 C GLU A 73 -5.885 6.380 -13.356 1.00 0.00 C ATOM 1101 O GLU A 73 -6.272 5.987 -14.453 1.00 0.00 O ATOM 1102 CB GLU A 73 -3.979 7.971 -13.354 1.00 0.00 C ATOM 1103 CG GLU A 73 -3.545 9.411 -13.480 1.00 0.00 C ATOM 1104 CD GLU A 73 -4.074 10.084 -14.733 1.00 0.00 C ATOM 1105 OE1 GLU A 73 -5.185 10.655 -14.680 1.00 0.00 O ATOM 1106 OE2 GLU A 73 -3.379 10.057 -15.771 1.00 0.00 O ATOM 0 H GLU A 73 -4.993 8.603 -11.253 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.013 8.442 -13.855 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -3.449 7.507 -12.522 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -3.693 7.429 -14.256 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -3.886 9.965 -12.605 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -2.456 9.457 -13.482 1.00 0.00 H new ATOM 1113 N GLN A 74 -5.781 5.590 -12.303 1.00 0.00 N ATOM 1114 CA GLN A 74 -6.169 4.187 -12.346 1.00 0.00 C ATOM 1115 C GLN A 74 -7.623 3.992 -11.908 1.00 0.00 C ATOM 1116 O GLN A 74 -8.153 2.881 -11.954 1.00 0.00 O ATOM 1117 CB GLN A 74 -5.238 3.381 -11.444 1.00 0.00 C ATOM 1118 CG GLN A 74 -3.808 3.303 -11.961 1.00 0.00 C ATOM 1119 CD GLN A 74 -2.826 2.784 -10.925 1.00 0.00 C ATOM 1120 OE1 GLN A 74 -3.046 3.130 -9.665 1.00 0.00 O flip ATOM 1121 NE2 GLN A 74 -1.858 2.102 -11.258 1.00 0.00 N flip ATOM 0 H GLN A 74 -5.427 5.898 -11.397 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.086 3.837 -13.375 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -5.232 3.827 -10.450 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -5.633 2.371 -11.338 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -3.780 2.654 -12.836 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -3.492 4.294 -12.288 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -1.721 1.855 -12.238 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.192 1.783 -10.554 1.00 0.00 H new ATOM 1130 N GLY A 75 -8.265 5.076 -11.486 1.00 0.00 N ATOM 1131 CA GLY A 75 -9.641 4.999 -11.023 1.00 0.00 C ATOM 1132 C GLY A 75 -9.751 4.412 -9.627 1.00 0.00 C ATOM 1133 O GLY A 75 -10.763 3.799 -9.275 1.00 0.00 O ATOM 0 H GLY A 75 -7.857 6.010 -11.456 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.080 5.997 -11.030 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -10.221 4.390 -11.717 1.00 0.00 H new ATOM 1137 N LEU A 76 -8.704 4.602 -8.840 1.00 0.00 N ATOM 1138 CA LEU A 76 -8.633 4.082 -7.484 1.00 0.00 C ATOM 1139 C LEU A 76 -8.328 5.220 -6.517 1.00 0.00 C ATOM 1140 O LEU A 76 -8.316 6.383 -6.912 1.00 0.00 O ATOM 1141 CB LEU A 76 -7.523 3.029 -7.389 1.00 0.00 C ATOM 1142 CG LEU A 76 -7.601 1.883 -8.400 1.00 0.00 C ATOM 1143 CD1 LEU A 76 -6.387 0.979 -8.267 1.00 0.00 C ATOM 1144 CD2 LEU A 76 -8.880 1.088 -8.205 1.00 0.00 C ATOM 0 H LEU A 76 -7.875 5.124 -9.125 1.00 0.00 H new ATOM 0 HA LEU A 76 -9.589 3.626 -7.226 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.562 3.530 -7.510 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.537 2.604 -6.385 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.610 2.306 -9.404 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.456 0.168 -8.992 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.481 1.556 -8.453 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.352 0.563 -7.260 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -8.919 0.277 -8.932 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -8.900 0.673 -7.197 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -9.740 1.743 -8.345 1.00 0.00 H new ATOM 1156 N ASP A 77 -8.094 4.882 -5.256 1.00 0.00 N ATOM 1157 CA ASP A 77 -7.578 5.837 -4.289 1.00 0.00 C ATOM 1158 C ASP A 77 -6.701 5.112 -3.284 1.00 0.00 C ATOM 1159 O ASP A 77 -6.573 3.883 -3.337 1.00 0.00 O ATOM 1160 CB ASP A 77 -8.702 6.585 -3.567 1.00 0.00 C ATOM 1161 CG ASP A 77 -9.419 5.745 -2.530 1.00 0.00 C ATOM 1162 OD1 ASP A 77 -10.311 4.965 -2.909 1.00 0.00 O ATOM 1163 OD2 ASP A 77 -9.120 5.891 -1.329 1.00 0.00 O ATOM 0 H ASP A 77 -8.255 3.948 -4.879 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.990 6.580 -4.828 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.287 7.469 -3.083 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.426 6.935 -4.303 1.00 0.00 H new ATOM 1168 N VAL A 78 -6.096 5.867 -2.382 1.00 0.00 N ATOM 1169 CA VAL A 78 -5.205 5.293 -1.384 1.00 0.00 C ATOM 1170 C VAL A 78 -6.012 4.705 -0.231 1.00 0.00 C ATOM 1171 O VAL A 78 -6.553 5.435 0.597 1.00 0.00 O ATOM 1172 CB VAL A 78 -4.207 6.338 -0.831 1.00 0.00 C ATOM 1173 CG1 VAL A 78 -3.152 5.669 0.038 1.00 0.00 C ATOM 1174 CG2 VAL A 78 -3.553 7.113 -1.965 1.00 0.00 C ATOM 0 H VAL A 78 -6.205 6.879 -2.319 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.634 4.506 -1.876 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.763 7.042 -0.212 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.461 6.422 0.416 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.636 5.167 0.876 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.603 4.938 -0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -2.855 7.842 -1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.015 6.423 -2.614 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -4.320 7.630 -2.542 1.00 0.00 H new ATOM 1184 N VAL A 79 -6.091 3.385 -0.189 1.00 0.00 N ATOM 1185 CA VAL A 79 -6.890 2.698 0.816 1.00 0.00 C ATOM 1186 C VAL A 79 -6.038 2.281 2.012 1.00 0.00 C ATOM 1187 O VAL A 79 -6.561 1.864 3.046 1.00 0.00 O ATOM 1188 CB VAL A 79 -7.599 1.455 0.228 1.00 0.00 C ATOM 1189 CG1 VAL A 79 -8.578 1.867 -0.864 1.00 0.00 C ATOM 1190 CG2 VAL A 79 -6.583 0.456 -0.306 1.00 0.00 C ATOM 0 H VAL A 79 -5.610 2.765 -0.841 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.648 3.405 1.151 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.160 0.970 1.027 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.068 0.981 -1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.328 2.538 -0.446 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.039 2.378 -1.662 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.104 -0.410 -0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -5.989 0.925 -1.090 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.927 0.136 0.504 1.00 0.00 H new ATOM 1200 N GLY A 80 -4.725 2.402 1.871 1.00 0.00 N ATOM 1201 CA GLY A 80 -3.835 2.036 2.951 1.00 0.00 C ATOM 1202 C GLY A 80 -2.393 2.377 2.651 1.00 0.00 C ATOM 1203 O GLY A 80 -2.075 2.854 1.560 1.00 0.00 O ATOM 0 H GLY A 80 -4.263 2.746 1.030 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.144 2.548 3.862 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -3.920 0.966 3.142 1.00 0.00 H new ATOM 1207 N VAL A 81 -1.522 2.137 3.618 1.00 0.00 N ATOM 1208 CA VAL A 81 -0.098 2.407 3.463 1.00 0.00 C ATOM 1209 C VAL A 81 0.690 1.269 4.096 1.00 0.00 C ATOM 1210 O VAL A 81 0.178 0.571 4.972 1.00 0.00 O ATOM 1211 CB VAL A 81 0.331 3.737 4.140 1.00 0.00 C ATOM 1212 CG1 VAL A 81 1.697 4.184 3.645 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -0.697 4.839 3.917 1.00 0.00 C ATOM 0 H VAL A 81 -1.778 1.752 4.527 1.00 0.00 H new ATOM 0 HA VAL A 81 0.106 2.492 2.396 1.00 0.00 H new ATOM 0 HB VAL A 81 0.393 3.547 5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.974 5.118 4.135 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.437 3.419 3.879 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.661 4.337 2.566 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.362 5.754 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.811 5.019 2.848 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.655 4.533 4.338 1.00 0.00 H new ATOM 1223 N TYR A 82 1.922 1.078 3.666 1.00 0.00 N ATOM 1224 CA TYR A 82 2.772 0.057 4.253 1.00 0.00 C ATOM 1225 C TYR A 82 4.219 0.522 4.297 1.00 0.00 C ATOM 1226 O TYR A 82 4.665 1.288 3.443 1.00 0.00 O ATOM 1227 CB TYR A 82 2.641 -1.284 3.507 1.00 0.00 C ATOM 1228 CG TYR A 82 3.226 -1.333 2.111 1.00 0.00 C ATOM 1229 CD1 TYR A 82 4.574 -1.608 1.908 1.00 0.00 C ATOM 1230 CD2 TYR A 82 2.424 -1.138 0.995 1.00 0.00 C ATOM 1231 CE1 TYR A 82 5.103 -1.686 0.636 1.00 0.00 C ATOM 1232 CE2 TYR A 82 2.948 -1.210 -0.281 1.00 0.00 C ATOM 1233 CZ TYR A 82 4.288 -1.484 -0.454 1.00 0.00 C ATOM 1234 OH TYR A 82 4.815 -1.567 -1.723 1.00 0.00 O ATOM 0 H TYR A 82 2.357 1.614 2.915 1.00 0.00 H new ATOM 0 HA TYR A 82 2.437 -0.107 5.277 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.120 -2.058 4.107 1.00 0.00 H new ATOM 0 HB3 TYR A 82 1.583 -1.539 3.444 1.00 0.00 H new ATOM 0 HD1 TYR A 82 5.218 -1.763 2.761 1.00 0.00 H new ATOM 0 HD2 TYR A 82 1.373 -0.927 1.127 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.151 -1.904 0.497 1.00 0.00 H new ATOM 0 HE2 TYR A 82 2.311 -1.052 -1.139 1.00 0.00 H new ATOM 0 HH TYR A 82 4.109 -1.400 -2.382 1.00 0.00 H new ATOM 1244 N HIS A 83 4.940 0.075 5.311 1.00 0.00 N ATOM 1245 CA HIS A 83 6.347 0.419 5.456 1.00 0.00 C ATOM 1246 C HIS A 83 7.109 -0.727 6.103 1.00 0.00 C ATOM 1247 O HIS A 83 6.592 -1.409 6.991 1.00 0.00 O ATOM 1248 CB HIS A 83 6.546 1.730 6.245 1.00 0.00 C ATOM 1249 CG HIS A 83 5.805 1.825 7.549 1.00 0.00 C ATOM 1250 ND1 HIS A 83 4.831 2.771 7.782 1.00 0.00 N ATOM 1251 CD2 HIS A 83 5.916 1.115 8.697 1.00 0.00 C ATOM 1252 CE1 HIS A 83 4.376 2.638 9.012 1.00 0.00 C ATOM 1253 NE2 HIS A 83 5.016 1.641 9.593 1.00 0.00 N ATOM 0 H HIS A 83 4.575 -0.528 6.048 1.00 0.00 H new ATOM 0 HA HIS A 83 6.749 0.586 4.457 1.00 0.00 H new ATOM 0 HB2 HIS A 83 7.610 1.855 6.443 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.239 2.563 5.613 1.00 0.00 H new ATOM 0 HD2 HIS A 83 6.588 0.288 8.875 1.00 0.00 H new ATOM 0 HE1 HIS A 83 3.607 3.244 9.468 1.00 0.00 H new ATOM 0 HE2 HIS A 83 4.868 1.315 10.548 1.00 0.00 H new ATOM 1262 N SER A 84 8.329 -0.936 5.643 1.00 0.00 N ATOM 1263 CA SER A 84 9.159 -2.020 6.134 1.00 0.00 C ATOM 1264 C SER A 84 10.255 -1.470 7.034 1.00 0.00 C ATOM 1265 O SER A 84 10.802 -0.400 6.768 1.00 0.00 O ATOM 1266 CB SER A 84 9.796 -2.753 4.955 1.00 0.00 C ATOM 1267 OG SER A 84 8.846 -3.002 3.935 1.00 0.00 O ATOM 0 H SER A 84 8.770 -0.363 4.923 1.00 0.00 H new ATOM 0 HA SER A 84 8.538 -2.711 6.704 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.617 -2.159 4.554 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.223 -3.696 5.297 1.00 0.00 H new ATOM 0 HG SER A 84 9.306 -3.323 3.131 1.00 0.00 H new ATOM 1273 N HIS A 85 10.562 -2.185 8.102 1.00 0.00 N ATOM 1274 CA HIS A 85 11.680 -1.805 8.956 1.00 0.00 C ATOM 1275 C HIS A 85 12.394 -3.038 9.496 1.00 0.00 C ATOM 1276 O HIS A 85 11.761 -4.053 9.781 1.00 0.00 O ATOM 1277 CB HIS A 85 11.237 -0.874 10.105 1.00 0.00 C ATOM 1278 CG HIS A 85 10.089 -1.360 10.954 1.00 0.00 C ATOM 1279 ND1 HIS A 85 9.647 -2.606 11.251 1.00 0.00 N flip ATOM 1280 CD2 HIS A 85 9.263 -0.498 11.640 1.00 0.00 C flip ATOM 1281 CE1 HIS A 85 8.577 -2.473 12.105 1.00 0.00 C flip ATOM 1282 NE2 HIS A 85 8.368 -1.188 12.320 1.00 0.00 N flip ATOM 0 H HIS A 85 10.061 -3.023 8.399 1.00 0.00 H new ATOM 0 HA HIS A 85 12.383 -1.244 8.340 1.00 0.00 H new ATOM 0 HB2 HIS A 85 12.094 -0.701 10.755 1.00 0.00 H new ATOM 0 HB3 HIS A 85 10.962 0.090 9.677 1.00 0.00 H new ATOM 0 HD1 HIS A 85 10.037 -3.483 10.904 1.00 0.00 H new ATOM 0 HD2 HIS A 85 9.337 0.579 11.624 1.00 0.00 H new ATOM 0 HE1 HIS A 85 8.004 -3.284 12.529 1.00 0.00 H new ATOM 1291 N PRO A 86 13.726 -2.970 9.622 1.00 0.00 N ATOM 1292 CA PRO A 86 14.531 -4.059 10.162 1.00 0.00 C ATOM 1293 C PRO A 86 14.557 -4.035 11.686 1.00 0.00 C ATOM 1294 O PRO A 86 15.612 -3.873 12.304 1.00 0.00 O ATOM 1295 CB PRO A 86 15.937 -3.792 9.596 1.00 0.00 C ATOM 1296 CG PRO A 86 15.833 -2.532 8.789 1.00 0.00 C ATOM 1297 CD PRO A 86 14.571 -1.843 9.224 1.00 0.00 C ATOM 0 HA PRO A 86 14.136 -5.037 9.889 1.00 0.00 H new ATOM 0 HB2 PRO A 86 16.665 -3.680 10.400 1.00 0.00 H new ATOM 0 HB3 PRO A 86 16.271 -4.624 8.976 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.700 -1.893 8.956 1.00 0.00 H new ATOM 0 HG3 PRO A 86 15.803 -2.757 7.723 1.00 0.00 H new ATOM 0 HD2 PRO A 86 14.747 -1.154 10.050 1.00 0.00 H new ATOM 0 HD3 PRO A 86 14.124 -1.264 8.416 1.00 0.00 H new ATOM 1305 N ASP A 87 13.385 -4.215 12.277 1.00 0.00 N ATOM 1306 CA ASP A 87 13.231 -4.242 13.724 1.00 0.00 C ATOM 1307 C ASP A 87 11.852 -4.774 14.063 1.00 0.00 C ATOM 1308 O ASP A 87 10.844 -4.191 13.659 1.00 0.00 O ATOM 1309 CB ASP A 87 13.422 -2.853 14.335 1.00 0.00 C ATOM 1310 CG ASP A 87 13.366 -2.890 15.848 1.00 0.00 C ATOM 1311 OD1 ASP A 87 14.254 -3.517 16.465 1.00 0.00 O ATOM 1312 OD2 ASP A 87 12.436 -2.294 16.428 1.00 0.00 O ATOM 0 H ASP A 87 12.512 -4.347 11.766 1.00 0.00 H new ATOM 0 HA ASP A 87 13.998 -4.893 14.144 1.00 0.00 H new ATOM 0 HB2 ASP A 87 14.381 -2.445 14.017 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.650 -2.182 13.959 1.00 0.00 H new ATOM 1317 N HIS A 88 11.827 -5.868 14.817 1.00 0.00 N ATOM 1318 CA HIS A 88 10.616 -6.658 15.043 1.00 0.00 C ATOM 1319 C HIS A 88 10.160 -7.311 13.739 1.00 0.00 C ATOM 1320 O HIS A 88 10.248 -6.713 12.665 1.00 0.00 O ATOM 1321 CB HIS A 88 9.477 -5.807 15.626 1.00 0.00 C ATOM 1322 CG HIS A 88 9.740 -5.312 17.011 1.00 0.00 C ATOM 1323 ND1 HIS A 88 10.010 -3.995 17.302 1.00 0.00 N ATOM 1324 CD2 HIS A 88 9.757 -5.966 18.194 1.00 0.00 C ATOM 1325 CE1 HIS A 88 10.181 -3.859 18.602 1.00 0.00 C ATOM 1326 NE2 HIS A 88 10.031 -5.041 19.169 1.00 0.00 N ATOM 0 H HIS A 88 12.651 -6.236 15.293 1.00 0.00 H new ATOM 0 HA HIS A 88 10.862 -7.430 15.772 1.00 0.00 H new ATOM 0 HB2 HIS A 88 9.303 -4.952 14.972 1.00 0.00 H new ATOM 0 HB3 HIS A 88 8.561 -6.397 15.629 1.00 0.00 H new ATOM 0 HD2 HIS A 88 9.586 -7.022 18.344 1.00 0.00 H new ATOM 0 HE1 HIS A 88 10.406 -2.936 19.116 1.00 0.00 H new ATOM 0 HE2 HIS A 88 10.106 -5.235 20.168 1.00 0.00 H new ATOM 1335 N PRO A 89 9.667 -8.555 13.821 1.00 0.00 N ATOM 1336 CA PRO A 89 9.233 -9.312 12.644 1.00 0.00 C ATOM 1337 C PRO A 89 8.128 -8.615 11.863 1.00 0.00 C ATOM 1338 O PRO A 89 8.282 -8.347 10.674 1.00 0.00 O ATOM 1339 CB PRO A 89 8.722 -10.632 13.229 1.00 0.00 C ATOM 1340 CG PRO A 89 9.383 -10.744 14.556 1.00 0.00 C ATOM 1341 CD PRO A 89 9.530 -9.339 15.059 1.00 0.00 C ATOM 0 HA PRO A 89 10.046 -9.432 11.928 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.636 -10.626 13.328 1.00 0.00 H new ATOM 0 HB3 PRO A 89 8.979 -11.474 12.587 1.00 0.00 H new ATOM 0 HG2 PRO A 89 8.785 -11.344 15.241 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.354 -11.232 14.469 1.00 0.00 H new ATOM 0 HD2 PRO A 89 8.663 -9.026 15.641 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.402 -9.231 15.704 1.00 0.00 H new ATOM 1349 N ALA A 90 7.024 -8.298 12.525 1.00 0.00 N ATOM 1350 CA ALA A 90 5.900 -7.695 11.833 1.00 0.00 C ATOM 1351 C ALA A 90 4.891 -7.086 12.795 1.00 0.00 C ATOM 1352 O ALA A 90 3.904 -7.724 13.170 1.00 0.00 O ATOM 1353 CB ALA A 90 5.230 -8.717 10.928 1.00 0.00 C ATOM 0 H ALA A 90 6.886 -8.446 13.525 1.00 0.00 H new ATOM 0 HA ALA A 90 6.290 -6.880 11.223 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.388 -8.252 10.415 1.00 0.00 H new ATOM 0 HB2 ALA A 90 5.949 -9.078 10.193 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.872 -9.554 11.527 1.00 0.00 H new ATOM 1359 N ARG A 91 5.177 -5.863 13.221 1.00 0.00 N ATOM 1360 CA ARG A 91 4.237 -5.050 13.968 1.00 0.00 C ATOM 1361 C ARG A 91 4.762 -3.615 14.032 1.00 0.00 C ATOM 1362 O ARG A 91 5.978 -3.401 14.016 1.00 0.00 O ATOM 1363 CB ARG A 91 3.984 -5.629 15.371 1.00 0.00 C ATOM 1364 CG ARG A 91 5.175 -5.623 16.322 1.00 0.00 C ATOM 1365 CD ARG A 91 5.270 -4.316 17.094 1.00 0.00 C ATOM 1366 NE ARG A 91 6.124 -4.429 18.274 1.00 0.00 N ATOM 1367 CZ ARG A 91 6.398 -3.417 19.097 1.00 0.00 C ATOM 1368 NH1 ARG A 91 5.926 -2.198 18.851 1.00 0.00 N ATOM 1369 NH2 ARG A 91 7.146 -3.630 20.171 1.00 0.00 N ATOM 0 H ARG A 91 6.074 -5.408 13.055 1.00 0.00 H new ATOM 0 HA ARG A 91 3.274 -5.052 13.457 1.00 0.00 H new ATOM 0 HB2 ARG A 91 3.173 -5.067 15.833 1.00 0.00 H new ATOM 0 HB3 ARG A 91 3.638 -6.657 15.261 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.086 -6.454 17.022 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.094 -5.779 15.756 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.661 -3.537 16.439 1.00 0.00 H new ATOM 0 HD3 ARG A 91 4.271 -4.004 17.400 1.00 0.00 H new ATOM 0 HE ARG A 91 6.536 -5.339 18.481 1.00 0.00 H new ATOM 0 HH11 ARG A 91 5.349 -2.031 18.027 1.00 0.00 H new ATOM 0 HH12 ARG A 91 6.141 -1.430 19.487 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.508 -4.564 20.363 1.00 0.00 H new ATOM 0 HH22 ARG A 91 7.359 -2.860 20.805 1.00 0.00 H new ATOM 1383 N PRO A 92 3.863 -2.618 14.062 1.00 0.00 N ATOM 1384 CA PRO A 92 4.247 -1.199 14.085 1.00 0.00 C ATOM 1385 C PRO A 92 5.018 -0.821 15.346 1.00 0.00 C ATOM 1386 O PRO A 92 4.808 -1.398 16.416 1.00 0.00 O ATOM 1387 CB PRO A 92 2.908 -0.452 14.039 1.00 0.00 C ATOM 1388 CG PRO A 92 1.915 -1.456 13.561 1.00 0.00 C ATOM 1389 CD PRO A 92 2.401 -2.785 14.058 1.00 0.00 C ATOM 0 HA PRO A 92 4.913 -0.955 13.258 1.00 0.00 H new ATOM 0 HB2 PRO A 92 2.637 -0.068 15.023 1.00 0.00 H new ATOM 0 HB3 PRO A 92 2.958 0.404 13.366 1.00 0.00 H new ATOM 0 HG2 PRO A 92 0.920 -1.235 13.947 1.00 0.00 H new ATOM 0 HG3 PRO A 92 1.844 -1.448 12.473 1.00 0.00 H new ATOM 0 HD2 PRO A 92 2.017 -3.010 15.053 1.00 0.00 H new ATOM 0 HD3 PRO A 92 2.089 -3.600 13.405 1.00 0.00 H new ATOM 1397 N SER A 93 5.899 0.156 15.217 1.00 0.00 N ATOM 1398 CA SER A 93 6.699 0.615 16.335 1.00 0.00 C ATOM 1399 C SER A 93 6.034 1.850 16.934 1.00 0.00 C ATOM 1400 O SER A 93 4.908 2.182 16.566 1.00 0.00 O ATOM 1401 CB SER A 93 8.124 0.927 15.869 1.00 0.00 C ATOM 1402 OG SER A 93 9.027 0.982 16.962 1.00 0.00 O ATOM 0 H SER A 93 6.078 0.649 14.342 1.00 0.00 H new ATOM 0 HA SER A 93 6.763 -0.162 17.097 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.452 0.165 15.162 1.00 0.00 H new ATOM 0 HB3 SER A 93 8.134 1.879 15.339 1.00 0.00 H new ATOM 0 HG SER A 93 9.928 1.181 16.632 1.00 0.00 H new ATOM 1408 N ALA A 94 6.712 2.530 17.843 1.00 0.00 N ATOM 1409 CA ALA A 94 6.110 3.666 18.525 1.00 0.00 C ATOM 1410 C ALA A 94 5.973 4.871 17.600 1.00 0.00 C ATOM 1411 O ALA A 94 4.896 5.451 17.485 1.00 0.00 O ATOM 1412 CB ALA A 94 6.924 4.033 19.757 1.00 0.00 C ATOM 0 H ALA A 94 7.669 2.320 18.125 1.00 0.00 H new ATOM 0 HA ALA A 94 5.107 3.373 18.835 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.463 4.884 20.258 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.954 3.184 20.439 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.939 4.295 19.458 1.00 0.00 H new ATOM 1418 N THR A 95 7.052 5.221 16.913 1.00 0.00 N ATOM 1419 CA THR A 95 7.069 6.420 16.086 1.00 0.00 C ATOM 1420 C THR A 95 6.130 6.295 14.890 1.00 0.00 C ATOM 1421 O THR A 95 5.322 7.185 14.646 1.00 0.00 O ATOM 1422 CB THR A 95 8.493 6.728 15.587 1.00 0.00 C ATOM 1423 OG1 THR A 95 9.419 6.666 16.680 1.00 0.00 O ATOM 1424 CG2 THR A 95 8.558 8.107 14.944 1.00 0.00 C ATOM 0 H THR A 95 7.925 4.693 16.912 1.00 0.00 H new ATOM 0 HA THR A 95 6.723 7.240 16.715 1.00 0.00 H new ATOM 0 HB THR A 95 8.759 5.982 14.839 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.323 6.861 16.355 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.574 8.300 14.600 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.874 8.146 14.096 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.272 8.863 15.675 1.00 0.00 H new ATOM 1432 N ASP A 96 6.217 5.193 14.152 1.00 0.00 N ATOM 1433 CA ASP A 96 5.385 5.020 12.963 1.00 0.00 C ATOM 1434 C ASP A 96 3.912 4.875 13.346 1.00 0.00 C ATOM 1435 O ASP A 96 3.031 5.258 12.578 1.00 0.00 O ATOM 1436 CB ASP A 96 5.866 3.856 12.079 1.00 0.00 C ATOM 1437 CG ASP A 96 5.847 2.509 12.763 1.00 0.00 C ATOM 1438 OD1 ASP A 96 6.514 2.365 13.798 1.00 0.00 O ATOM 1439 OD2 ASP A 96 5.184 1.583 12.242 1.00 0.00 O ATOM 0 H ASP A 96 6.846 4.415 14.351 1.00 0.00 H new ATOM 0 HA ASP A 96 5.485 5.923 12.360 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.239 3.808 11.189 1.00 0.00 H new ATOM 0 HB3 ASP A 96 6.881 4.066 11.743 1.00 0.00 H new ATOM 1444 N LEU A 97 3.649 4.322 14.529 1.00 0.00 N ATOM 1445 CA LEU A 97 2.290 4.294 15.069 1.00 0.00 C ATOM 1446 C LEU A 97 1.819 5.725 15.322 1.00 0.00 C ATOM 1447 O LEU A 97 0.689 6.096 15.003 1.00 0.00 O ATOM 1448 CB LEU A 97 2.259 3.470 16.372 1.00 0.00 C ATOM 1449 CG LEU A 97 0.878 3.135 16.955 1.00 0.00 C ATOM 1450 CD1 LEU A 97 0.993 1.967 17.923 1.00 0.00 C ATOM 1451 CD2 LEU A 97 0.267 4.332 17.671 1.00 0.00 C ATOM 0 H LEU A 97 4.353 3.890 15.128 1.00 0.00 H new ATOM 0 HA LEU A 97 1.618 3.823 14.352 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.787 2.533 16.193 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.823 4.014 17.130 1.00 0.00 H new ATOM 0 HG LEU A 97 0.224 2.865 16.126 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.010 1.735 18.332 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.382 1.095 17.397 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.670 2.232 18.735 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.709 4.058 18.070 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.920 4.639 18.488 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.153 5.157 16.968 1.00 0.00 H new ATOM 1463 N GLU A 98 2.714 6.525 15.882 1.00 0.00 N ATOM 1464 CA GLU A 98 2.436 7.916 16.201 1.00 0.00 C ATOM 1465 C GLU A 98 2.275 8.766 14.939 1.00 0.00 C ATOM 1466 O GLU A 98 1.486 9.712 14.912 1.00 0.00 O ATOM 1467 CB GLU A 98 3.560 8.461 17.083 1.00 0.00 C ATOM 1468 CG GLU A 98 3.486 7.961 18.516 1.00 0.00 C ATOM 1469 CD GLU A 98 4.551 8.564 19.401 1.00 0.00 C ATOM 1470 OE1 GLU A 98 5.667 8.008 19.464 1.00 0.00 O ATOM 1471 OE2 GLU A 98 4.276 9.600 20.040 1.00 0.00 O ATOM 0 H GLU A 98 3.657 6.226 16.129 1.00 0.00 H new ATOM 0 HA GLU A 98 1.490 7.968 16.740 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.521 8.177 16.654 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.520 9.550 17.082 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.504 8.194 18.927 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.586 6.876 18.523 1.00 0.00 H new ATOM 1478 N GLU A 99 3.007 8.412 13.891 1.00 0.00 N ATOM 1479 CA GLU A 99 2.965 9.155 12.634 1.00 0.00 C ATOM 1480 C GLU A 99 1.774 8.727 11.775 1.00 0.00 C ATOM 1481 O GLU A 99 1.583 9.231 10.669 1.00 0.00 O ATOM 1482 CB GLU A 99 4.270 8.960 11.852 1.00 0.00 C ATOM 1483 CG GLU A 99 5.518 9.397 12.609 1.00 0.00 C ATOM 1484 CD GLU A 99 5.490 10.858 13.006 1.00 0.00 C ATOM 1485 OE1 GLU A 99 4.888 11.185 14.051 1.00 0.00 O ATOM 1486 OE2 GLU A 99 6.075 11.689 12.277 1.00 0.00 O ATOM 0 H GLU A 99 3.640 7.612 13.885 1.00 0.00 H new ATOM 0 HA GLU A 99 2.849 10.211 12.877 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.369 7.907 11.587 1.00 0.00 H new ATOM 0 HB3 GLU A 99 4.209 9.520 10.919 1.00 0.00 H new ATOM 0 HG2 GLU A 99 5.625 8.785 13.505 1.00 0.00 H new ATOM 0 HG3 GLU A 99 6.395 9.212 11.989 1.00 0.00 H new ATOM 1493 N ALA A 100 0.975 7.798 12.286 1.00 0.00 N ATOM 1494 CA ALA A 100 -0.198 7.324 11.564 1.00 0.00 C ATOM 1495 C ALA A 100 -1.332 8.345 11.649 1.00 0.00 C ATOM 1496 O ALA A 100 -2.103 8.363 12.610 1.00 0.00 O ATOM 1497 CB ALA A 100 -0.643 5.973 12.104 1.00 0.00 C ATOM 0 H ALA A 100 1.118 7.359 13.196 1.00 0.00 H new ATOM 0 HA ALA A 100 0.068 7.202 10.514 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -1.520 5.633 11.554 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.164 5.250 11.984 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.891 6.068 13.161 1.00 0.00 H new ATOM 1503 N THR A 101 -1.414 9.202 10.641 1.00 0.00 N ATOM 1504 CA THR A 101 -2.401 10.272 10.613 1.00 0.00 C ATOM 1505 C THR A 101 -3.757 9.782 10.095 1.00 0.00 C ATOM 1506 O THR A 101 -4.784 10.423 10.312 1.00 0.00 O ATOM 1507 CB THR A 101 -1.905 11.421 9.716 1.00 0.00 C ATOM 1508 OG1 THR A 101 -0.546 11.737 10.038 1.00 0.00 O ATOM 1509 CG2 THR A 101 -2.763 12.666 9.875 1.00 0.00 C ATOM 0 H THR A 101 -0.803 9.176 9.825 1.00 0.00 H new ATOM 0 HA THR A 101 -2.532 10.622 11.637 1.00 0.00 H new ATOM 0 HB THR A 101 -1.976 11.088 8.681 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.235 12.467 9.463 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.383 13.455 9.227 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.793 12.436 9.601 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.730 13.001 10.912 1.00 0.00 H new ATOM 1517 N PHE A 102 -3.758 8.639 9.420 1.00 0.00 N ATOM 1518 CA PHE A 102 -4.964 8.137 8.764 1.00 0.00 C ATOM 1519 C PHE A 102 -5.519 6.894 9.463 1.00 0.00 C ATOM 1520 O PHE A 102 -5.153 5.772 9.119 1.00 0.00 O ATOM 1521 CB PHE A 102 -4.680 7.817 7.295 1.00 0.00 C ATOM 1522 CG PHE A 102 -4.178 8.989 6.501 1.00 0.00 C ATOM 1523 CD1 PHE A 102 -5.043 10.000 6.111 1.00 0.00 C ATOM 1524 CD2 PHE A 102 -2.842 9.078 6.139 1.00 0.00 C ATOM 1525 CE1 PHE A 102 -4.586 11.077 5.377 1.00 0.00 C ATOM 1526 CE2 PHE A 102 -2.379 10.155 5.405 1.00 0.00 C ATOM 1527 CZ PHE A 102 -3.253 11.155 5.023 1.00 0.00 C ATOM 0 H PHE A 102 -2.939 8.041 9.311 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.716 8.924 8.827 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -3.944 7.015 7.244 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.593 7.442 6.832 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -6.086 9.945 6.384 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -2.156 8.298 6.433 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -5.270 11.858 5.080 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -1.336 10.214 5.131 1.00 0.00 H new ATOM 0 HZ PHE A 102 -2.894 11.996 4.449 1.00 0.00 H new ATOM 1537 N PRO A 103 -6.392 7.071 10.471 1.00 0.00 N ATOM 1538 CA PRO A 103 -6.995 5.954 11.212 1.00 0.00 C ATOM 1539 C PRO A 103 -8.008 5.170 10.377 1.00 0.00 C ATOM 1540 O PRO A 103 -8.605 4.204 10.851 1.00 0.00 O ATOM 1541 CB PRO A 103 -7.699 6.636 12.398 1.00 0.00 C ATOM 1542 CG PRO A 103 -7.202 8.042 12.405 1.00 0.00 C ATOM 1543 CD PRO A 103 -6.869 8.363 10.979 1.00 0.00 C ATOM 0 HA PRO A 103 -6.243 5.223 11.508 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -8.782 6.604 12.282 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -7.464 6.132 13.336 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -7.960 8.723 12.793 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -6.325 8.144 13.044 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -7.739 8.720 10.429 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.105 9.137 10.904 1.00 0.00 H new ATOM 1551 N GLY A 104 -8.211 5.599 9.139 1.00 0.00 N ATOM 1552 CA GLY A 104 -9.124 4.906 8.254 1.00 0.00 C ATOM 1553 C GLY A 104 -8.398 4.102 7.197 1.00 0.00 C ATOM 1554 O GLY A 104 -9.020 3.541 6.296 1.00 0.00 O ATOM 0 H GLY A 104 -7.758 6.417 8.731 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -9.761 4.242 8.839 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -9.779 5.631 7.770 1.00 0.00 H new ATOM 1558 N PHE A 105 -7.080 4.048 7.307 1.00 0.00 N ATOM 1559 CA PHE A 105 -6.263 3.323 6.345 1.00 0.00 C ATOM 1560 C PHE A 105 -5.773 2.014 6.944 1.00 0.00 C ATOM 1561 O PHE A 105 -5.641 1.888 8.162 1.00 0.00 O ATOM 1562 CB PHE A 105 -5.061 4.171 5.907 1.00 0.00 C ATOM 1563 CG PHE A 105 -5.392 5.287 4.951 1.00 0.00 C ATOM 1564 CD1 PHE A 105 -6.576 6.000 5.057 1.00 0.00 C ATOM 1565 CD2 PHE A 105 -4.503 5.627 3.944 1.00 0.00 C ATOM 1566 CE1 PHE A 105 -6.866 7.026 4.179 1.00 0.00 C ATOM 1567 CE2 PHE A 105 -4.787 6.652 3.064 1.00 0.00 C ATOM 1568 CZ PHE A 105 -5.970 7.355 3.182 1.00 0.00 C ATOM 0 H PHE A 105 -6.552 4.498 8.054 1.00 0.00 H new ATOM 0 HA PHE A 105 -6.880 3.108 5.473 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -4.592 4.598 6.794 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.324 3.518 5.440 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -7.281 5.750 5.836 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -3.575 5.083 3.846 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -7.794 7.571 4.273 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -4.084 6.904 2.284 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.193 8.159 2.497 1.00 0.00 H new ATOM 1578 N THR A 106 -5.513 1.039 6.090 1.00 0.00 N ATOM 1579 CA THR A 106 -4.945 -0.219 6.531 1.00 0.00 C ATOM 1580 C THR A 106 -3.425 -0.160 6.424 1.00 0.00 C ATOM 1581 O THR A 106 -2.877 0.117 5.356 1.00 0.00 O ATOM 1582 CB THR A 106 -5.493 -1.404 5.708 1.00 0.00 C ATOM 1583 OG1 THR A 106 -6.929 -1.396 5.749 1.00 0.00 O ATOM 1584 CG2 THR A 106 -4.976 -2.728 6.254 1.00 0.00 C ATOM 0 H THR A 106 -5.687 1.096 5.087 1.00 0.00 H new ATOM 0 HA THR A 106 -5.231 -0.378 7.571 1.00 0.00 H new ATOM 0 HB THR A 106 -5.152 -1.296 4.678 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.254 -2.288 5.992 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.376 -3.548 5.658 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.887 -2.741 6.206 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.295 -2.844 7.290 1.00 0.00 H new ATOM 1592 N TYR A 107 -2.751 -0.392 7.537 1.00 0.00 N ATOM 1593 CA TYR A 107 -1.302 -0.315 7.575 1.00 0.00 C ATOM 1594 C TYR A 107 -0.695 -1.706 7.527 1.00 0.00 C ATOM 1595 O TYR A 107 -0.914 -2.522 8.420 1.00 0.00 O ATOM 1596 CB TYR A 107 -0.828 0.420 8.829 1.00 0.00 C ATOM 1597 CG TYR A 107 -1.208 1.885 8.864 1.00 0.00 C ATOM 1598 CD1 TYR A 107 -2.494 2.280 9.207 1.00 0.00 C ATOM 1599 CD2 TYR A 107 -0.277 2.872 8.563 1.00 0.00 C ATOM 1600 CE1 TYR A 107 -2.844 3.615 9.243 1.00 0.00 C ATOM 1601 CE2 TYR A 107 -0.619 4.211 8.600 1.00 0.00 C ATOM 1602 CZ TYR A 107 -1.904 4.578 8.942 1.00 0.00 C ATOM 1603 OH TYR A 107 -2.253 5.908 8.980 1.00 0.00 O ATOM 0 H TYR A 107 -3.185 -0.636 8.427 1.00 0.00 H new ATOM 0 HA TYR A 107 -0.971 0.245 6.700 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -1.245 -0.074 9.707 1.00 0.00 H new ATOM 0 HB3 TYR A 107 0.256 0.335 8.900 1.00 0.00 H new ATOM 0 HD1 TYR A 107 -3.233 1.531 9.450 1.00 0.00 H new ATOM 0 HD2 TYR A 107 0.730 2.588 8.296 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -3.851 3.904 9.506 1.00 0.00 H new ATOM 0 HE2 TYR A 107 0.116 4.966 8.362 1.00 0.00 H new ATOM 0 HH TYR A 107 -3.228 5.989 9.028 1.00 0.00 H new ATOM 1613 N VAL A 108 0.055 -1.972 6.478 1.00 0.00 N ATOM 1614 CA VAL A 108 0.719 -3.251 6.332 1.00 0.00 C ATOM 1615 C VAL A 108 2.156 -3.160 6.823 1.00 0.00 C ATOM 1616 O VAL A 108 2.920 -2.287 6.408 1.00 0.00 O ATOM 1617 CB VAL A 108 0.694 -3.741 4.868 1.00 0.00 C ATOM 1618 CG1 VAL A 108 1.397 -5.084 4.723 1.00 0.00 C ATOM 1619 CG2 VAL A 108 -0.734 -3.831 4.358 1.00 0.00 C ATOM 0 H VAL A 108 0.220 -1.319 5.712 1.00 0.00 H new ATOM 0 HA VAL A 108 0.175 -3.975 6.939 1.00 0.00 H new ATOM 0 HB VAL A 108 1.234 -3.012 4.264 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.362 -5.402 3.681 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.436 -4.987 5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.897 -5.826 5.346 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -0.730 -4.178 3.325 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.297 -4.532 4.974 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.201 -2.847 4.409 1.00 0.00 H new ATOM 1629 N ILE A 109 2.509 -4.051 7.728 1.00 0.00 N ATOM 1630 CA ILE A 109 3.865 -4.127 8.233 1.00 0.00 C ATOM 1631 C ILE A 109 4.512 -5.394 7.706 1.00 0.00 C ATOM 1632 O ILE A 109 3.988 -6.496 7.892 1.00 0.00 O ATOM 1633 CB ILE A 109 3.910 -4.125 9.778 1.00 0.00 C ATOM 1634 CG1 ILE A 109 3.171 -2.904 10.337 1.00 0.00 C ATOM 1635 CG2 ILE A 109 5.353 -4.147 10.268 1.00 0.00 C ATOM 1636 CD1 ILE A 109 3.761 -1.577 9.910 1.00 0.00 C ATOM 0 H ILE A 109 1.870 -4.737 8.131 1.00 0.00 H new ATOM 0 HA ILE A 109 4.407 -3.245 7.890 1.00 0.00 H new ATOM 0 HB ILE A 109 3.409 -5.023 10.139 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.129 -2.946 10.019 1.00 0.00 H new ATOM 0 HG13 ILE A 109 3.174 -2.958 11.426 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.367 -4.145 11.358 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.849 -5.045 9.900 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.877 -3.266 9.897 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.182 -0.764 10.347 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.794 -1.511 10.252 1.00 0.00 H new ATOM 0 HD13 ILE A 109 3.733 -1.499 8.823 1.00 0.00 H new ATOM 1648 N VAL A 110 5.635 -5.242 7.035 1.00 0.00 N ATOM 1649 CA VAL A 110 6.274 -6.364 6.386 1.00 0.00 C ATOM 1650 C VAL A 110 7.736 -6.443 6.778 1.00 0.00 C ATOM 1651 O VAL A 110 8.435 -5.427 6.857 1.00 0.00 O ATOM 1652 CB VAL A 110 6.114 -6.290 4.844 1.00 0.00 C ATOM 1653 CG1 VAL A 110 6.473 -4.910 4.320 1.00 0.00 C ATOM 1654 CG2 VAL A 110 6.948 -7.354 4.146 1.00 0.00 C ATOM 0 H VAL A 110 6.122 -4.353 6.926 1.00 0.00 H new ATOM 0 HA VAL A 110 5.779 -7.275 6.723 1.00 0.00 H new ATOM 0 HB VAL A 110 5.065 -6.481 4.620 1.00 0.00 H new ATOM 0 HG11 VAL A 110 6.351 -4.889 3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 110 5.817 -4.167 4.773 1.00 0.00 H new ATOM 0 HG13 VAL A 110 7.509 -4.683 4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 110 6.812 -7.273 3.068 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.000 -7.210 4.391 1.00 0.00 H new ATOM 0 HG23 VAL A 110 6.630 -8.342 4.479 1.00 0.00 H new ATOM 1664 N SER A 111 8.181 -7.654 7.037 1.00 0.00 N ATOM 1665 CA SER A 111 9.538 -7.894 7.460 1.00 0.00 C ATOM 1666 C SER A 111 10.454 -7.891 6.254 1.00 0.00 C ATOM 1667 O SER A 111 10.419 -8.802 5.427 1.00 0.00 O ATOM 1668 CB SER A 111 9.622 -9.238 8.182 1.00 0.00 C ATOM 1669 OG SER A 111 10.925 -9.492 8.681 1.00 0.00 O ATOM 0 H SER A 111 7.611 -8.496 6.960 1.00 0.00 H new ATOM 0 HA SER A 111 9.850 -7.105 8.145 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.909 -9.252 9.006 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.334 -10.036 7.498 1.00 0.00 H new ATOM 0 HG SER A 111 10.937 -10.359 9.137 1.00 0.00 H new ATOM 1675 N VAL A 112 11.226 -6.836 6.126 1.00 0.00 N ATOM 1676 CA VAL A 112 12.252 -6.770 5.110 1.00 0.00 C ATOM 1677 C VAL A 112 13.573 -6.450 5.780 1.00 0.00 C ATOM 1678 O VAL A 112 13.750 -5.369 6.343 1.00 0.00 O ATOM 1679 CB VAL A 112 11.938 -5.706 4.032 1.00 0.00 C ATOM 1680 CG1 VAL A 112 13.039 -5.649 2.984 1.00 0.00 C ATOM 1681 CG2 VAL A 112 10.597 -5.979 3.372 1.00 0.00 C ATOM 0 H VAL A 112 11.162 -6.007 6.717 1.00 0.00 H new ATOM 0 HA VAL A 112 12.298 -7.734 4.604 1.00 0.00 H new ATOM 0 HB VAL A 112 11.886 -4.738 4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.793 -4.893 2.238 1.00 0.00 H new ATOM 0 HG12 VAL A 112 13.984 -5.392 3.463 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.130 -6.621 2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 112 10.400 -5.216 2.618 1.00 0.00 H new ATOM 0 HG22 VAL A 112 10.618 -6.961 2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 112 9.809 -5.956 4.125 1.00 0.00 H new ATOM 1691 N ARG A 113 14.494 -7.390 5.727 1.00 0.00 N ATOM 1692 CA ARG A 113 15.763 -7.229 6.402 1.00 0.00 C ATOM 1693 C ARG A 113 16.864 -6.971 5.391 1.00 0.00 C ATOM 1694 O ARG A 113 17.420 -7.903 4.807 1.00 0.00 O ATOM 1695 CB ARG A 113 16.077 -8.459 7.260 1.00 0.00 C ATOM 1696 CG ARG A 113 17.266 -8.270 8.187 1.00 0.00 C ATOM 1697 CD ARG A 113 17.449 -9.462 9.112 1.00 0.00 C ATOM 1698 NE ARG A 113 17.619 -10.714 8.374 1.00 0.00 N ATOM 1699 CZ ARG A 113 18.796 -11.311 8.186 1.00 0.00 C ATOM 1700 NH1 ARG A 113 19.908 -10.763 8.664 1.00 0.00 N ATOM 1701 NH2 ARG A 113 18.865 -12.456 7.521 1.00 0.00 N ATOM 0 H ARG A 113 14.387 -8.271 5.224 1.00 0.00 H new ATOM 0 HA ARG A 113 15.701 -6.367 7.066 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.199 -8.709 7.856 1.00 0.00 H new ATOM 0 HB3 ARG A 113 16.270 -9.308 6.605 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.170 -8.126 7.595 1.00 0.00 H new ATOM 0 HG3 ARG A 113 17.126 -7.366 8.780 1.00 0.00 H new ATOM 0 HD2 ARG A 113 18.319 -9.296 9.748 1.00 0.00 H new ATOM 0 HD3 ARG A 113 16.584 -9.545 9.770 1.00 0.00 H new ATOM 0 HE ARG A 113 16.788 -11.156 7.980 1.00 0.00 H new ATOM 0 HH11 ARG A 113 19.863 -9.882 9.177 1.00 0.00 H new ATOM 0 HH12 ARG A 113 20.807 -11.223 8.518 1.00 0.00 H new ATOM 0 HH21 ARG A 113 18.016 -12.883 7.151 1.00 0.00 H new ATOM 0 HH22 ARG A 113 19.767 -12.910 7.379 1.00 0.00 H new ATOM 1715 N ASP A 114 17.114 -5.687 5.151 1.00 0.00 N ATOM 1716 CA ASP A 114 18.182 -5.245 4.259 1.00 0.00 C ATOM 1717 C ASP A 114 17.968 -5.776 2.837 1.00 0.00 C ATOM 1718 O ASP A 114 18.916 -6.001 2.085 1.00 0.00 O ATOM 1719 CB ASP A 114 19.541 -5.682 4.818 1.00 0.00 C ATOM 1720 CG ASP A 114 20.708 -5.048 4.090 1.00 0.00 C ATOM 1721 OD1 ASP A 114 20.752 -3.801 3.992 1.00 0.00 O ATOM 1722 OD2 ASP A 114 21.591 -5.791 3.613 1.00 0.00 O ATOM 0 H ASP A 114 16.582 -4.924 5.569 1.00 0.00 H new ATOM 0 HA ASP A 114 18.164 -4.157 4.203 1.00 0.00 H new ATOM 0 HB2 ASP A 114 19.594 -5.422 5.875 1.00 0.00 H new ATOM 0 HB3 ASP A 114 19.624 -6.767 4.752 1.00 0.00 H new ATOM 1727 N GLY A 115 16.707 -5.964 2.470 1.00 0.00 N ATOM 1728 CA GLY A 115 16.387 -6.398 1.125 1.00 0.00 C ATOM 1729 C GLY A 115 15.665 -7.729 1.091 1.00 0.00 C ATOM 1730 O GLY A 115 15.024 -8.063 0.099 1.00 0.00 O ATOM 0 H GLY A 115 15.901 -5.824 3.079 1.00 0.00 H new ATOM 0 HA2 GLY A 115 15.768 -5.642 0.642 1.00 0.00 H new ATOM 0 HA3 GLY A 115 17.307 -6.474 0.545 1.00 0.00 H new ATOM 1734 N ALA A 116 15.765 -8.489 2.175 1.00 0.00 N ATOM 1735 CA ALA A 116 15.128 -9.800 2.249 1.00 0.00 C ATOM 1736 C ALA A 116 13.721 -9.701 2.832 1.00 0.00 C ATOM 1737 O ALA A 116 13.554 -9.391 4.011 1.00 0.00 O ATOM 1738 CB ALA A 116 15.978 -10.753 3.075 1.00 0.00 C ATOM 0 H ALA A 116 16.280 -8.221 3.014 1.00 0.00 H new ATOM 0 HA ALA A 116 15.043 -10.190 1.235 1.00 0.00 H new ATOM 0 HB1 ALA A 116 15.491 -11.727 3.122 1.00 0.00 H new ATOM 0 HB2 ALA A 116 16.959 -10.860 2.612 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.094 -10.356 4.084 1.00 0.00 H new ATOM 1744 N PRO A 117 12.691 -9.935 2.006 1.00 0.00 N ATOM 1745 CA PRO A 117 11.296 -9.903 2.434 1.00 0.00 C ATOM 1746 C PRO A 117 10.856 -11.230 3.052 1.00 0.00 C ATOM 1747 O PRO A 117 10.799 -12.256 2.371 1.00 0.00 O ATOM 1748 CB PRO A 117 10.522 -9.636 1.133 1.00 0.00 C ATOM 1749 CG PRO A 117 11.544 -9.591 0.035 1.00 0.00 C ATOM 1750 CD PRO A 117 12.790 -10.235 0.578 1.00 0.00 C ATOM 0 HA PRO A 117 11.124 -9.152 3.205 1.00 0.00 H new ATOM 0 HB2 PRO A 117 9.788 -10.421 0.949 1.00 0.00 H new ATOM 0 HB3 PRO A 117 9.974 -8.696 1.193 1.00 0.00 H new ATOM 0 HG2 PRO A 117 11.187 -10.122 -0.848 1.00 0.00 H new ATOM 0 HG3 PRO A 117 11.741 -8.563 -0.269 1.00 0.00 H new ATOM 0 HD2 PRO A 117 12.811 -11.308 0.387 1.00 0.00 H new ATOM 0 HD3 PRO A 117 13.693 -9.815 0.135 1.00 0.00 H new ATOM 1758 N GLU A 118 10.531 -11.195 4.332 1.00 0.00 N ATOM 1759 CA GLU A 118 10.197 -12.398 5.079 1.00 0.00 C ATOM 1760 C GLU A 118 8.684 -12.628 5.136 1.00 0.00 C ATOM 1761 O GLU A 118 8.159 -13.497 4.443 1.00 0.00 O ATOM 1762 CB GLU A 118 10.785 -12.291 6.487 1.00 0.00 C ATOM 1763 CG GLU A 118 10.559 -13.515 7.357 1.00 0.00 C ATOM 1764 CD GLU A 118 11.264 -13.399 8.691 1.00 0.00 C ATOM 1765 OE1 GLU A 118 10.728 -12.732 9.601 1.00 0.00 O ATOM 1766 OE2 GLU A 118 12.365 -13.970 8.831 1.00 0.00 O ATOM 0 H GLU A 118 10.491 -10.337 4.882 1.00 0.00 H new ATOM 0 HA GLU A 118 10.628 -13.258 4.567 1.00 0.00 H new ATOM 0 HB2 GLU A 118 11.857 -12.110 6.407 1.00 0.00 H new ATOM 0 HB3 GLU A 118 10.352 -11.423 6.983 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.490 -13.650 7.522 1.00 0.00 H new ATOM 0 HG3 GLU A 118 10.916 -14.402 6.834 1.00 0.00 H new ATOM 1773 N ALA A 119 7.987 -11.838 5.947 1.00 0.00 N ATOM 1774 CA ALA A 119 6.556 -12.030 6.157 1.00 0.00 C ATOM 1775 C ALA A 119 5.816 -10.700 6.167 1.00 0.00 C ATOM 1776 O ALA A 119 6.405 -9.656 6.455 1.00 0.00 O ATOM 1777 CB ALA A 119 6.312 -12.778 7.461 1.00 0.00 C ATOM 0 H ALA A 119 8.389 -11.060 6.469 1.00 0.00 H new ATOM 0 HA ALA A 119 6.170 -12.623 5.328 1.00 0.00 H new ATOM 0 HB1 ALA A 119 5.241 -12.915 7.607 1.00 0.00 H new ATOM 0 HB2 ALA A 119 6.800 -13.752 7.419 1.00 0.00 H new ATOM 0 HB3 ALA A 119 6.720 -12.203 8.292 1.00 0.00 H new ATOM 1783 N LEU A 120 4.530 -10.749 5.844 1.00 0.00 N ATOM 1784 CA LEU A 120 3.692 -9.554 5.786 1.00 0.00 C ATOM 1785 C LEU A 120 2.537 -9.654 6.784 1.00 0.00 C ATOM 1786 O LEU A 120 1.992 -10.735 7.005 1.00 0.00 O ATOM 1787 CB LEU A 120 3.114 -9.354 4.374 1.00 0.00 C ATOM 1788 CG LEU A 120 4.131 -9.157 3.240 1.00 0.00 C ATOM 1789 CD1 LEU A 120 4.758 -10.479 2.816 1.00 0.00 C ATOM 1790 CD2 LEU A 120 3.471 -8.472 2.054 1.00 0.00 C ATOM 0 H LEU A 120 4.038 -11.613 5.615 1.00 0.00 H new ATOM 0 HA LEU A 120 4.322 -8.702 6.041 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.496 -10.219 4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.454 -8.487 4.395 1.00 0.00 H new ATOM 0 HG LEU A 120 4.932 -8.519 3.614 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.472 -10.302 2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.272 -10.927 3.666 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.978 -11.156 2.466 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.203 -8.338 1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.647 -9.087 1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 120 3.089 -7.499 2.362 1.00 0.00 H new ATOM 1802 N THR A 121 2.166 -8.529 7.381 1.00 0.00 N ATOM 1803 CA THR A 121 1.028 -8.479 8.294 1.00 0.00 C ATOM 1804 C THR A 121 0.203 -7.220 8.051 1.00 0.00 C ATOM 1805 O THR A 121 0.758 -6.167 7.747 1.00 0.00 O ATOM 1806 CB THR A 121 1.482 -8.506 9.769 1.00 0.00 C ATOM 1807 OG1 THR A 121 2.485 -7.506 9.993 1.00 0.00 O ATOM 1808 CG2 THR A 121 2.022 -9.876 10.152 1.00 0.00 C ATOM 0 H THR A 121 2.638 -7.634 7.250 1.00 0.00 H new ATOM 0 HA THR A 121 0.420 -9.362 8.099 1.00 0.00 H new ATOM 0 HB THR A 121 0.614 -8.294 10.394 1.00 0.00 H new ATOM 0 HG1 THR A 121 2.810 -7.170 9.132 1.00 0.00 H new ATOM 0 HG21 THR A 121 2.334 -9.865 11.196 1.00 0.00 H new ATOM 0 HG22 THR A 121 1.243 -10.626 10.014 1.00 0.00 H new ATOM 0 HG23 THR A 121 2.876 -10.120 9.520 1.00 0.00 H new ATOM 1816 N ALA A 122 -1.111 -7.326 8.172 1.00 0.00 N ATOM 1817 CA ALA A 122 -1.981 -6.175 7.992 1.00 0.00 C ATOM 1818 C ALA A 122 -2.584 -5.754 9.322 1.00 0.00 C ATOM 1819 O ALA A 122 -3.044 -6.593 10.103 1.00 0.00 O ATOM 1820 CB ALA A 122 -3.072 -6.477 6.978 1.00 0.00 C ATOM 0 H ALA A 122 -1.597 -8.195 8.393 1.00 0.00 H new ATOM 0 HA ALA A 122 -1.383 -5.349 7.608 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.711 -5.602 6.859 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.618 -6.728 6.019 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.670 -7.318 7.327 1.00 0.00 H new ATOM 1826 N TRP A 123 -2.562 -4.457 9.583 1.00 0.00 N ATOM 1827 CA TRP A 123 -3.015 -3.921 10.850 1.00 0.00 C ATOM 1828 C TRP A 123 -4.012 -2.796 10.638 1.00 0.00 C ATOM 1829 O TRP A 123 -3.888 -2.003 9.702 1.00 0.00 O ATOM 1830 CB TRP A 123 -1.821 -3.400 11.649 1.00 0.00 C ATOM 1831 CG TRP A 123 -0.780 -4.442 11.905 1.00 0.00 C ATOM 1832 CD1 TRP A 123 0.227 -4.820 11.065 1.00 0.00 C ATOM 1833 CD2 TRP A 123 -0.653 -5.248 13.075 1.00 0.00 C ATOM 1834 NE1 TRP A 123 0.979 -5.808 11.651 1.00 0.00 N ATOM 1835 CE2 TRP A 123 0.458 -6.088 12.885 1.00 0.00 C ATOM 1836 CE3 TRP A 123 -1.372 -5.336 14.268 1.00 0.00 C ATOM 1837 CZ2 TRP A 123 0.866 -7.005 13.847 1.00 0.00 C ATOM 1838 CZ3 TRP A 123 -0.969 -6.247 15.221 1.00 0.00 C ATOM 1839 CH2 TRP A 123 0.143 -7.072 15.006 1.00 0.00 C ATOM 0 H TRP A 123 -2.231 -3.752 8.924 1.00 0.00 H new ATOM 0 HA TRP A 123 -3.507 -4.721 11.403 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -1.367 -2.568 11.110 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -2.174 -3.007 12.603 1.00 0.00 H new ATOM 0 HD1 TRP A 123 0.406 -4.404 10.085 1.00 0.00 H new ATOM 0 HE1 TRP A 123 1.793 -6.260 11.234 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.229 -4.702 14.441 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 1.723 -7.642 13.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -1.519 -6.326 16.147 1.00 0.00 H new ATOM 0 HH2 TRP A 123 0.435 -7.776 15.772 1.00 0.00 H new ATOM 1850 N ALA A 124 -4.997 -2.732 11.512 1.00 0.00 N ATOM 1851 CA ALA A 124 -5.978 -1.665 11.481 1.00 0.00 C ATOM 1852 C ALA A 124 -5.759 -0.733 12.662 1.00 0.00 C ATOM 1853 O ALA A 124 -5.642 -1.185 13.805 1.00 0.00 O ATOM 1854 CB ALA A 124 -7.390 -2.235 11.502 1.00 0.00 C ATOM 0 H ALA A 124 -5.140 -3.412 12.258 1.00 0.00 H new ATOM 0 HA ALA A 124 -5.857 -1.099 10.557 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -8.112 -1.419 11.478 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.537 -2.875 10.632 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -7.533 -2.820 12.411 1.00 0.00 H new ATOM 1860 N LEU A 125 -5.678 0.558 12.385 1.00 0.00 N ATOM 1861 CA LEU A 125 -5.483 1.546 13.431 1.00 0.00 C ATOM 1862 C LEU A 125 -6.812 1.855 14.101 1.00 0.00 C ATOM 1863 O LEU A 125 -7.826 2.030 13.425 1.00 0.00 O ATOM 1864 CB LEU A 125 -4.867 2.827 12.853 1.00 0.00 C ATOM 1865 CG LEU A 125 -4.587 3.939 13.871 1.00 0.00 C ATOM 1866 CD1 LEU A 125 -3.627 3.458 14.947 1.00 0.00 C ATOM 1867 CD2 LEU A 125 -4.017 5.166 13.178 1.00 0.00 C ATOM 0 H LEU A 125 -5.744 0.946 11.444 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.796 1.141 14.174 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -3.932 2.568 12.356 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -5.537 3.219 12.087 1.00 0.00 H new ATOM 0 HG LEU A 125 -5.532 4.208 14.343 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.443 4.264 15.658 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.063 2.606 15.469 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -2.685 3.158 14.487 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -3.825 5.944 13.916 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -3.085 4.902 12.678 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -4.732 5.533 12.442 1.00 0.00 H new ATOM 1879 N ALA A 126 -6.803 1.895 15.427 1.00 0.00 N ATOM 1880 CA ALA A 126 -8.000 2.211 16.188 1.00 0.00 C ATOM 1881 C ALA A 126 -8.488 3.617 15.849 1.00 0.00 C ATOM 1882 O ALA A 126 -7.678 4.518 15.635 1.00 0.00 O ATOM 1883 CB ALA A 126 -7.722 2.074 17.678 1.00 0.00 C ATOM 0 H ALA A 126 -5.977 1.712 15.997 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.788 1.507 15.920 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -8.625 2.313 18.240 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.417 1.051 17.899 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -6.925 2.760 17.964 1.00 0.00 H new ATOM 1889 N PRO A 127 -9.813 3.818 15.778 1.00 0.00 N ATOM 1890 CA PRO A 127 -10.407 5.124 15.453 1.00 0.00 C ATOM 1891 C PRO A 127 -10.017 6.211 16.452 1.00 0.00 C ATOM 1892 O PRO A 127 -10.003 7.398 16.122 1.00 0.00 O ATOM 1893 CB PRO A 127 -11.914 4.861 15.507 1.00 0.00 C ATOM 1894 CG PRO A 127 -12.048 3.390 15.314 1.00 0.00 C ATOM 1895 CD PRO A 127 -10.843 2.784 15.972 1.00 0.00 C ATOM 0 HA PRO A 127 -10.062 5.493 14.487 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -12.337 5.175 16.461 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.440 5.412 14.728 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -12.969 3.018 15.764 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -12.085 3.136 14.255 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -11.018 2.580 17.028 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -10.561 1.839 15.508 1.00 0.00 H new ATOM 1903 N ASP A 128 -9.710 5.802 17.675 1.00 0.00 N ATOM 1904 CA ASP A 128 -9.251 6.731 18.704 1.00 0.00 C ATOM 1905 C ASP A 128 -7.738 6.921 18.610 1.00 0.00 C ATOM 1906 O ASP A 128 -7.175 7.825 19.228 1.00 0.00 O ATOM 1907 CB ASP A 128 -9.641 6.227 20.099 1.00 0.00 C ATOM 1908 CG ASP A 128 -8.968 4.920 20.468 1.00 0.00 C ATOM 1909 OD1 ASP A 128 -9.243 3.898 19.804 1.00 0.00 O ATOM 1910 OD2 ASP A 128 -8.165 4.908 21.426 1.00 0.00 O ATOM 0 H ASP A 128 -9.770 4.831 17.982 1.00 0.00 H new ATOM 0 HA ASP A 128 -9.734 7.694 18.540 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -9.381 6.984 20.838 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -10.722 6.097 20.143 1.00 0.00 H new ATOM 1915 N ARG A 129 -7.103 6.069 17.808 1.00 0.00 N ATOM 1916 CA ARG A 129 -5.659 6.103 17.577 1.00 0.00 C ATOM 1917 C ARG A 129 -4.871 6.015 18.884 1.00 0.00 C ATOM 1918 O ARG A 129 -4.294 6.997 19.359 1.00 0.00 O ATOM 1919 CB ARG A 129 -5.264 7.352 16.779 1.00 0.00 C ATOM 1920 CG ARG A 129 -3.793 7.400 16.394 1.00 0.00 C ATOM 1921 CD ARG A 129 -3.443 8.698 15.683 1.00 0.00 C ATOM 1922 NE ARG A 129 -3.723 9.876 16.506 1.00 0.00 N ATOM 1923 CZ ARG A 129 -2.865 10.881 16.684 1.00 0.00 C ATOM 1924 NH1 ARG A 129 -1.658 10.837 16.125 1.00 0.00 N ATOM 1925 NH2 ARG A 129 -3.210 11.926 17.426 1.00 0.00 N ATOM 0 H ARG A 129 -7.580 5.328 17.295 1.00 0.00 H new ATOM 0 HA ARG A 129 -5.402 5.224 16.986 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -5.868 7.398 15.873 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -5.504 8.238 17.367 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -3.179 7.297 17.288 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -3.558 6.555 15.747 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -2.387 8.689 15.414 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -4.008 8.764 14.754 1.00 0.00 H new ATOM 0 HE ARG A 129 -4.629 9.931 16.971 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.387 10.033 15.559 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.004 11.607 16.263 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -4.132 11.961 17.861 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -2.553 12.694 17.562 1.00 0.00 H new ATOM 1939 N SER A 130 -4.883 4.837 19.479 1.00 0.00 N ATOM 1940 CA SER A 130 -4.047 4.564 20.638 1.00 0.00 C ATOM 1941 C SER A 130 -3.065 3.445 20.323 1.00 0.00 C ATOM 1942 O SER A 130 -1.934 3.437 20.810 1.00 0.00 O ATOM 1943 CB SER A 130 -4.902 4.192 21.849 1.00 0.00 C ATOM 1944 OG SER A 130 -5.749 5.267 22.227 1.00 0.00 O ATOM 0 H SER A 130 -5.462 4.052 19.180 1.00 0.00 H new ATOM 0 HA SER A 130 -3.488 5.468 20.880 1.00 0.00 H new ATOM 0 HB2 SER A 130 -5.505 3.314 21.616 1.00 0.00 H new ATOM 0 HB3 SER A 130 -4.256 3.923 22.685 1.00 0.00 H new ATOM 0 HG SER A 130 -6.516 5.309 21.618 1.00 0.00 H new ATOM 1950 N GLU A 131 -3.501 2.516 19.484 1.00 0.00 N ATOM 1951 CA GLU A 131 -2.688 1.379 19.099 1.00 0.00 C ATOM 1952 C GLU A 131 -3.260 0.747 17.840 1.00 0.00 C ATOM 1953 O GLU A 131 -4.266 1.219 17.297 1.00 0.00 O ATOM 1954 CB GLU A 131 -2.637 0.342 20.227 1.00 0.00 C ATOM 1955 CG GLU A 131 -4.005 -0.179 20.640 1.00 0.00 C ATOM 1956 CD GLU A 131 -3.927 -1.255 21.704 1.00 0.00 C ATOM 1957 OE1 GLU A 131 -3.526 -0.944 22.844 1.00 0.00 O ATOM 1958 OE2 GLU A 131 -4.266 -2.416 21.401 1.00 0.00 O ATOM 0 H GLU A 131 -4.426 2.532 19.054 1.00 0.00 H new ATOM 0 HA GLU A 131 -1.673 1.725 18.904 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -2.019 -0.498 19.909 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -2.150 0.786 21.095 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -4.607 0.650 21.012 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -4.517 -0.577 19.764 1.00 0.00 H new ATOM 1965 N PHE A 132 -2.627 -0.319 17.388 1.00 0.00 N ATOM 1966 CA PHE A 132 -3.087 -1.045 16.219 1.00 0.00 C ATOM 1967 C PHE A 132 -3.717 -2.359 16.637 1.00 0.00 C ATOM 1968 O PHE A 132 -3.403 -2.904 17.695 1.00 0.00 O ATOM 1969 CB PHE A 132 -1.933 -1.320 15.250 1.00 0.00 C ATOM 1970 CG PHE A 132 -1.557 -0.145 14.395 1.00 0.00 C ATOM 1971 CD1 PHE A 132 -0.693 0.826 14.866 1.00 0.00 C ATOM 1972 CD2 PHE A 132 -2.069 -0.017 13.115 1.00 0.00 C ATOM 1973 CE1 PHE A 132 -0.342 1.903 14.075 1.00 0.00 C ATOM 1974 CE2 PHE A 132 -1.724 1.057 12.320 1.00 0.00 C ATOM 1975 CZ PHE A 132 -0.860 2.020 12.801 1.00 0.00 C ATOM 0 H PHE A 132 -1.786 -0.704 17.817 1.00 0.00 H new ATOM 0 HA PHE A 132 -3.828 -0.427 15.711 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -1.060 -1.634 15.822 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -2.207 -2.153 14.603 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -0.288 0.742 15.864 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -2.747 -0.767 12.734 1.00 0.00 H new ATOM 0 HE1 PHE A 132 0.337 2.653 14.453 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -2.130 1.144 11.323 1.00 0.00 H new ATOM 0 HZ PHE A 132 -0.590 2.863 12.182 1.00 0.00 H new ATOM 1985 N HIS A 133 -4.615 -2.854 15.812 1.00 0.00 N ATOM 1986 CA HIS A 133 -5.229 -4.142 16.046 1.00 0.00 C ATOM 1987 C HIS A 133 -5.017 -5.023 14.834 1.00 0.00 C ATOM 1988 O HIS A 133 -4.987 -4.538 13.701 1.00 0.00 O ATOM 1989 CB HIS A 133 -6.723 -4.000 16.357 1.00 0.00 C ATOM 1990 CG HIS A 133 -7.002 -3.429 17.717 1.00 0.00 C ATOM 1991 ND1 HIS A 133 -7.331 -4.208 18.805 1.00 0.00 N ATOM 1992 CD2 HIS A 133 -6.991 -2.151 18.167 1.00 0.00 C ATOM 1993 CE1 HIS A 133 -7.508 -3.438 19.861 1.00 0.00 C ATOM 1994 NE2 HIS A 133 -7.308 -2.186 19.503 1.00 0.00 N ATOM 0 H HIS A 133 -4.937 -2.380 14.968 1.00 0.00 H new ATOM 0 HA HIS A 133 -4.760 -4.601 16.916 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -7.184 -3.362 15.603 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -7.197 -4.979 16.279 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -6.773 -1.269 17.584 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -7.772 -3.777 20.852 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -7.377 -1.375 20.118 1.00 0.00 H new ATOM 2003 N ARG A 134 -4.857 -6.306 15.074 1.00 0.00 N ATOM 2004 CA ARG A 134 -4.503 -7.230 14.018 1.00 0.00 C ATOM 2005 C ARG A 134 -5.731 -7.650 13.233 1.00 0.00 C ATOM 2006 O ARG A 134 -6.768 -7.991 13.803 1.00 0.00 O ATOM 2007 CB ARG A 134 -3.808 -8.456 14.604 1.00 0.00 C ATOM 2008 CG ARG A 134 -3.391 -9.488 13.567 1.00 0.00 C ATOM 2009 CD ARG A 134 -2.280 -8.987 12.657 1.00 0.00 C ATOM 2010 NE ARG A 134 -1.384 -10.076 12.257 1.00 0.00 N ATOM 2011 CZ ARG A 134 -1.562 -10.861 11.191 1.00 0.00 C ATOM 2012 NH1 ARG A 134 -2.576 -10.661 10.357 1.00 0.00 N ATOM 2013 NH2 ARG A 134 -0.710 -11.850 10.956 1.00 0.00 N ATOM 0 H ARG A 134 -4.967 -6.734 15.993 1.00 0.00 H new ATOM 0 HA ARG A 134 -3.818 -6.725 13.337 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -2.925 -8.131 15.154 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -4.475 -8.929 15.324 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -3.059 -10.394 14.074 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -4.256 -9.760 12.962 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -2.714 -8.527 11.770 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -1.709 -8.213 13.170 1.00 0.00 H new ATOM 0 HE ARG A 134 -0.562 -10.247 12.837 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -3.233 -9.899 10.526 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -2.698 -11.269 9.547 1.00 0.00 H new ATOM 0 HH21 ARG A 134 0.075 -12.007 11.588 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -0.840 -12.453 10.144 1.00 0.00 H new ATOM 2027 N GLU A 135 -5.598 -7.618 11.926 1.00 0.00 N ATOM 2028 CA GLU A 135 -6.643 -8.084 11.037 1.00 0.00 C ATOM 2029 C GLU A 135 -6.094 -9.253 10.251 1.00 0.00 C ATOM 2030 O GLU A 135 -4.887 -9.329 10.009 1.00 0.00 O ATOM 2031 CB GLU A 135 -7.130 -6.971 10.094 1.00 0.00 C ATOM 2032 CG GLU A 135 -8.328 -7.374 9.238 1.00 0.00 C ATOM 2033 CD GLU A 135 -8.839 -6.259 8.337 1.00 0.00 C ATOM 2034 OE1 GLU A 135 -8.316 -6.106 7.217 1.00 0.00 O ATOM 2035 OE2 GLU A 135 -9.801 -5.558 8.729 1.00 0.00 O ATOM 0 H GLU A 135 -4.766 -7.270 11.449 1.00 0.00 H new ATOM 0 HA GLU A 135 -7.509 -8.391 11.623 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -7.396 -6.095 10.686 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -6.310 -6.676 9.440 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -8.051 -8.229 8.621 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -9.137 -7.700 9.892 1.00 0.00 H new ATOM 2042 N ASP A 136 -6.958 -10.173 9.883 1.00 0.00 N ATOM 2043 CA ASP A 136 -6.525 -11.372 9.192 1.00 0.00 C ATOM 2044 C ASP A 136 -6.458 -11.102 7.697 1.00 0.00 C ATOM 2045 O ASP A 136 -7.153 -10.220 7.192 1.00 0.00 O ATOM 2046 CB ASP A 136 -7.475 -12.534 9.488 1.00 0.00 C ATOM 2047 CG ASP A 136 -6.789 -13.881 9.379 1.00 0.00 C ATOM 2048 OD1 ASP A 136 -5.938 -14.183 10.237 1.00 0.00 O ATOM 2049 OD2 ASP A 136 -7.095 -14.648 8.446 1.00 0.00 O ATOM 0 H ASP A 136 -7.963 -10.116 10.049 1.00 0.00 H new ATOM 0 HA ASP A 136 -5.532 -11.650 9.547 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -7.885 -12.418 10.491 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -8.315 -12.499 8.794 1.00 0.00 H new ATOM 2054 N ILE A 137 -5.627 -11.851 6.988 1.00 0.00 N ATOM 2055 CA ILE A 137 -5.472 -11.646 5.558 1.00 0.00 C ATOM 2056 C ILE A 137 -6.583 -12.372 4.822 1.00 0.00 C ATOM 2057 O ILE A 137 -6.645 -13.602 4.826 1.00 0.00 O ATOM 2058 CB ILE A 137 -4.103 -12.160 5.053 1.00 0.00 C ATOM 2059 CG1 ILE A 137 -2.957 -11.414 5.745 1.00 0.00 C ATOM 2060 CG2 ILE A 137 -3.997 -12.014 3.539 1.00 0.00 C ATOM 2061 CD1 ILE A 137 -2.971 -9.916 5.514 1.00 0.00 C ATOM 0 H ILE A 137 -5.054 -12.600 7.377 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.524 -10.575 5.363 1.00 0.00 H new ATOM 0 HB ILE A 137 -4.025 -13.218 5.302 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.006 -11.607 6.817 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.008 -11.817 5.391 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.027 -12.381 3.205 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.788 -12.592 3.061 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.101 -10.964 3.267 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -2.130 -9.460 6.036 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -2.890 -9.712 4.446 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -3.903 -9.498 5.894 1.00 0.00 H new ATOM 2073 N VAL A 138 -7.464 -11.607 4.200 1.00 0.00 N ATOM 2074 CA VAL A 138 -8.602 -12.177 3.520 1.00 0.00 C ATOM 2075 C VAL A 138 -8.555 -11.891 2.029 1.00 0.00 C ATOM 2076 O VAL A 138 -8.260 -10.773 1.592 1.00 0.00 O ATOM 2077 CB VAL A 138 -9.940 -11.672 4.104 1.00 0.00 C ATOM 2078 CG1 VAL A 138 -10.159 -12.228 5.503 1.00 0.00 C ATOM 2079 CG2 VAL A 138 -9.994 -10.152 4.120 1.00 0.00 C ATOM 0 H VAL A 138 -7.408 -10.590 4.155 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.547 -13.254 3.677 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.742 -12.031 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -11.107 -11.860 5.896 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -10.181 -13.317 5.462 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -9.346 -11.906 6.154 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.947 -9.826 4.536 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.179 -9.765 4.733 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.894 -9.774 3.103 1.00 0.00 H new ATOM 2089 N ARG A 139 -8.817 -12.921 1.258 1.00 0.00 N ATOM 2090 CA ARG A 139 -8.922 -12.803 -0.176 1.00 0.00 C ATOM 2091 C ARG A 139 -10.322 -12.342 -0.545 1.00 0.00 C ATOM 2092 O ARG A 139 -11.289 -12.678 0.143 1.00 0.00 O ATOM 2093 CB ARG A 139 -8.612 -14.153 -0.820 1.00 0.00 C ATOM 2094 CG ARG A 139 -7.142 -14.525 -0.760 1.00 0.00 C ATOM 2095 CD ARG A 139 -6.944 -16.029 -0.827 1.00 0.00 C ATOM 2096 NE ARG A 139 -7.292 -16.681 0.436 1.00 0.00 N ATOM 2097 CZ ARG A 139 -7.363 -18.002 0.605 1.00 0.00 C ATOM 2098 NH1 ARG A 139 -7.240 -18.821 -0.431 1.00 0.00 N ATOM 2099 NH2 ARG A 139 -7.575 -18.500 1.816 1.00 0.00 N ATOM 0 H ARG A 139 -8.964 -13.867 1.610 1.00 0.00 H new ATOM 0 HA ARG A 139 -8.205 -12.068 -0.542 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.196 -14.927 -0.322 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -8.932 -14.132 -1.862 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -6.612 -14.050 -1.586 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -6.706 -14.141 0.162 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -7.557 -16.441 -1.629 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -5.905 -16.248 -1.075 1.00 0.00 H new ATOM 0 HE ARG A 139 -7.493 -16.086 1.240 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.090 -18.442 -1.366 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -7.296 -19.830 -0.293 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -7.683 -17.873 2.613 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -7.630 -19.510 1.950 1.00 0.00 H new ATOM 2113 N PRO A 140 -10.452 -11.535 -1.607 1.00 0.00 N ATOM 2114 CA PRO A 140 -11.755 -11.076 -2.076 1.00 0.00 C ATOM 2115 C PRO A 140 -12.656 -12.251 -2.427 1.00 0.00 C ATOM 2116 O PRO A 140 -12.181 -13.278 -2.914 1.00 0.00 O ATOM 2117 CB PRO A 140 -11.432 -10.246 -3.325 1.00 0.00 C ATOM 2118 CG PRO A 140 -10.044 -10.635 -3.709 1.00 0.00 C ATOM 2119 CD PRO A 140 -9.352 -11.019 -2.432 1.00 0.00 C ATOM 0 HA PRO A 140 -12.291 -10.504 -1.318 1.00 0.00 H new ATOM 0 HB2 PRO A 140 -12.136 -10.456 -4.130 1.00 0.00 H new ATOM 0 HB3 PRO A 140 -11.497 -9.178 -3.115 1.00 0.00 H new ATOM 0 HG2 PRO A 140 -10.053 -11.467 -4.413 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -9.529 -9.809 -4.199 1.00 0.00 H new ATOM 0 HD2 PRO A 140 -8.584 -11.774 -2.600 1.00 0.00 H new ATOM 0 HD3 PRO A 140 -8.863 -10.165 -1.965 1.00 0.00 H new ATOM 2127 N ASP A 141 -13.947 -12.099 -2.155 1.00 0.00 N ATOM 2128 CA ASP A 141 -14.923 -13.142 -2.443 1.00 0.00 C ATOM 2129 C ASP A 141 -14.813 -13.576 -3.900 1.00 0.00 C ATOM 2130 O ASP A 141 -14.585 -12.743 -4.781 1.00 0.00 O ATOM 2131 CB ASP A 141 -16.338 -12.645 -2.135 1.00 0.00 C ATOM 2132 CG ASP A 141 -16.533 -12.321 -0.664 1.00 0.00 C ATOM 2133 OD1 ASP A 141 -16.255 -11.170 -0.259 1.00 0.00 O ATOM 2134 OD2 ASP A 141 -16.969 -13.215 0.092 1.00 0.00 O ATOM 0 H ASP A 141 -14.343 -11.259 -1.733 1.00 0.00 H new ATOM 0 HA ASP A 141 -14.715 -14.003 -1.808 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -16.545 -11.756 -2.730 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -17.060 -13.405 -2.435 1.00 0.00 H new ATOM 2139 N PRO A 142 -14.987 -14.884 -4.175 1.00 0.00 N ATOM 2140 CA PRO A 142 -14.741 -15.467 -5.506 1.00 0.00 C ATOM 2141 C PRO A 142 -15.787 -15.081 -6.547 1.00 0.00 C ATOM 2142 O PRO A 142 -16.037 -15.815 -7.502 1.00 0.00 O ATOM 2143 CB PRO A 142 -14.776 -16.973 -5.239 1.00 0.00 C ATOM 2144 CG PRO A 142 -15.665 -17.124 -4.053 1.00 0.00 C ATOM 2145 CD PRO A 142 -15.440 -15.902 -3.205 1.00 0.00 C ATOM 0 HA PRO A 142 -13.803 -15.107 -5.929 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -15.165 -17.519 -6.098 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -13.778 -17.363 -5.039 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -16.709 -17.201 -4.356 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -15.426 -18.032 -3.500 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -16.353 -15.593 -2.697 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -14.691 -16.082 -2.434 1.00 0.00 H new ATOM 2153 N GLU A 143 -16.355 -13.909 -6.369 1.00 0.00 N ATOM 2154 CA GLU A 143 -17.361 -13.376 -7.270 1.00 0.00 C ATOM 2155 C GLU A 143 -17.121 -11.886 -7.476 1.00 0.00 C ATOM 2156 O GLU A 143 -16.945 -11.435 -8.605 1.00 0.00 O ATOM 2157 CB GLU A 143 -18.766 -13.626 -6.716 1.00 0.00 C ATOM 2158 CG GLU A 143 -19.056 -15.099 -6.477 1.00 0.00 C ATOM 2159 CD GLU A 143 -20.486 -15.360 -6.070 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -20.786 -15.276 -4.865 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -21.312 -15.676 -6.951 1.00 0.00 O ATOM 0 H GLU A 143 -16.132 -13.291 -5.589 1.00 0.00 H new ATOM 0 HA GLU A 143 -17.285 -13.884 -8.231 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -18.884 -13.081 -5.779 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -19.502 -13.225 -7.413 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -18.835 -15.659 -7.385 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -18.389 -15.474 -5.701 1.00 0.00 H new ATOM 2168 N ALA A 144 -17.092 -11.146 -6.365 1.00 0.00 N ATOM 2169 CA ALA A 144 -16.802 -9.709 -6.369 1.00 0.00 C ATOM 2170 C ALA A 144 -17.773 -8.927 -7.257 1.00 0.00 C ATOM 2171 O ALA A 144 -17.562 -8.793 -8.464 1.00 0.00 O ATOM 2172 CB ALA A 144 -15.358 -9.453 -6.788 1.00 0.00 C ATOM 0 H ALA A 144 -17.269 -11.527 -5.435 1.00 0.00 H new ATOM 0 HA ALA A 144 -16.939 -9.348 -5.350 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -15.163 -8.381 -6.785 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -14.683 -9.947 -6.089 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -15.195 -9.848 -7.791 1.00 0.00 H new ATOM 2178 N PRO A 145 -18.859 -8.406 -6.663 1.00 0.00 N ATOM 2179 CA PRO A 145 -19.876 -7.630 -7.387 1.00 0.00 C ATOM 2180 C PRO A 145 -19.348 -6.287 -7.890 1.00 0.00 C ATOM 2181 O PRO A 145 -18.156 -5.985 -7.768 1.00 0.00 O ATOM 2182 CB PRO A 145 -20.982 -7.410 -6.345 1.00 0.00 C ATOM 2183 CG PRO A 145 -20.680 -8.362 -5.237 1.00 0.00 C ATOM 2184 CD PRO A 145 -19.192 -8.538 -5.241 1.00 0.00 C ATOM 0 HA PRO A 145 -20.213 -8.155 -8.281 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -20.985 -6.380 -5.988 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -21.967 -7.603 -6.771 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -21.024 -7.970 -4.280 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -21.186 -9.315 -5.392 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -18.693 -7.782 -4.636 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -18.897 -9.509 -4.844 1.00 0.00 H new ATOM 2192 N LEU A 146 -20.242 -5.485 -8.454 1.00 0.00 N ATOM 2193 CA LEU A 146 -19.869 -4.198 -9.020 1.00 0.00 C ATOM 2194 C LEU A 146 -19.369 -3.233 -7.949 1.00 0.00 C ATOM 2195 O LEU A 146 -19.855 -3.230 -6.812 1.00 0.00 O ATOM 2196 CB LEU A 146 -21.047 -3.592 -9.807 1.00 0.00 C ATOM 2197 CG LEU A 146 -22.415 -3.599 -9.106 1.00 0.00 C ATOM 2198 CD1 LEU A 146 -22.528 -2.470 -8.091 1.00 0.00 C ATOM 2199 CD2 LEU A 146 -23.535 -3.504 -10.131 1.00 0.00 C ATOM 0 H LEU A 146 -21.235 -5.706 -8.531 1.00 0.00 H new ATOM 0 HA LEU A 146 -19.043 -4.366 -9.711 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -20.796 -2.561 -10.056 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -21.143 -4.133 -10.748 1.00 0.00 H new ATOM 0 HG LEU A 146 -22.508 -4.541 -8.566 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -23.508 -2.506 -7.615 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -21.752 -2.583 -7.334 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -22.405 -1.512 -8.597 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -24.498 -3.510 -9.620 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -23.431 -2.579 -10.698 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -23.480 -4.355 -10.810 1.00 0.00 H new ATOM 2211 N GLU A 147 -18.372 -2.441 -8.314 1.00 0.00 N ATOM 2212 CA GLU A 147 -17.841 -1.423 -7.426 1.00 0.00 C ATOM 2213 C GLU A 147 -18.648 -0.137 -7.588 1.00 0.00 C ATOM 2214 O GLU A 147 -19.366 0.035 -8.572 1.00 0.00 O ATOM 2215 CB GLU A 147 -16.357 -1.187 -7.731 1.00 0.00 C ATOM 2216 CG GLU A 147 -15.463 -1.148 -6.493 1.00 0.00 C ATOM 2217 CD GLU A 147 -15.435 0.207 -5.805 1.00 0.00 C ATOM 2218 OE1 GLU A 147 -16.443 0.589 -5.181 1.00 0.00 O ATOM 2219 OE2 GLU A 147 -14.408 0.907 -5.906 1.00 0.00 O ATOM 0 H GLU A 147 -17.914 -2.486 -9.224 1.00 0.00 H new ATOM 0 HA GLU A 147 -17.924 -1.756 -6.391 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -16.004 -1.975 -8.396 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -16.253 -0.245 -8.270 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -15.807 -1.900 -5.783 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -14.448 -1.422 -6.780 1.00 0.00 H new ATOM 2226 N HIS A 148 -18.526 0.754 -6.624 1.00 0.00 N ATOM 2227 CA HIS A 148 -19.314 1.977 -6.595 1.00 0.00 C ATOM 2228 C HIS A 148 -18.412 3.211 -6.545 1.00 0.00 C ATOM 2229 O HIS A 148 -18.864 4.334 -6.774 1.00 0.00 O ATOM 2230 CB HIS A 148 -20.268 1.953 -5.388 1.00 0.00 C ATOM 2231 CG HIS A 148 -19.602 1.601 -4.085 1.00 0.00 C ATOM 2232 ND1 HIS A 148 -19.542 0.314 -3.594 1.00 0.00 N ATOM 2233 CD2 HIS A 148 -18.967 2.374 -3.172 1.00 0.00 C ATOM 2234 CE1 HIS A 148 -18.902 0.313 -2.442 1.00 0.00 C ATOM 2235 NE2 HIS A 148 -18.542 1.550 -2.158 1.00 0.00 N ATOM 0 H HIS A 148 -17.881 0.654 -5.840 1.00 0.00 H new ATOM 0 HA HIS A 148 -19.902 2.034 -7.511 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -20.738 2.932 -5.291 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -21.064 1.235 -5.582 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -18.821 3.443 -3.230 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -18.705 -0.556 -1.832 1.00 0.00 H new ATOM 0 HE2 HIS A 148 -18.033 1.845 -1.325 1.00 0.00 H new ATOM 2244 N HIS A 149 -17.141 2.997 -6.234 1.00 0.00 N ATOM 2245 CA HIS A 149 -16.177 4.086 -6.138 1.00 0.00 C ATOM 2246 C HIS A 149 -15.164 4.029 -7.282 1.00 0.00 C ATOM 2247 O HIS A 149 -14.550 5.038 -7.635 1.00 0.00 O ATOM 2248 CB HIS A 149 -15.471 4.014 -4.775 1.00 0.00 C ATOM 2249 CG HIS A 149 -14.247 4.869 -4.649 1.00 0.00 C ATOM 2250 ND1 HIS A 149 -14.286 6.231 -4.482 1.00 0.00 N ATOM 2251 CD2 HIS A 149 -12.940 4.531 -4.658 1.00 0.00 C ATOM 2252 CE1 HIS A 149 -13.054 6.695 -4.389 1.00 0.00 C ATOM 2253 NE2 HIS A 149 -12.214 5.681 -4.491 1.00 0.00 N ATOM 0 H HIS A 149 -16.751 2.074 -6.043 1.00 0.00 H new ATOM 0 HA HIS A 149 -16.704 5.037 -6.221 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -16.180 4.305 -4.000 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -15.194 2.978 -4.581 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -12.539 3.535 -4.776 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -12.779 7.730 -4.252 1.00 0.00 H new ATOM 0 HE2 HIS A 149 -11.197 5.743 -4.452 1.00 0.00 H new ATOM 2262 N HIS A 150 -14.997 2.847 -7.854 1.00 0.00 N ATOM 2263 CA HIS A 150 -14.023 2.636 -8.916 1.00 0.00 C ATOM 2264 C HIS A 150 -14.370 3.447 -10.161 1.00 0.00 C ATOM 2265 O HIS A 150 -15.515 3.470 -10.607 1.00 0.00 O ATOM 2266 CB HIS A 150 -13.932 1.145 -9.267 1.00 0.00 C ATOM 2267 CG HIS A 150 -12.909 0.824 -10.323 1.00 0.00 C ATOM 2268 ND1 HIS A 150 -11.579 1.168 -10.216 1.00 0.00 N ATOM 2269 CD2 HIS A 150 -13.033 0.185 -11.511 1.00 0.00 C ATOM 2270 CE1 HIS A 150 -10.931 0.754 -11.291 1.00 0.00 C ATOM 2271 NE2 HIS A 150 -11.789 0.155 -12.092 1.00 0.00 N ATOM 0 H HIS A 150 -15.527 2.013 -7.599 1.00 0.00 H new ATOM 0 HA HIS A 150 -13.054 2.978 -8.551 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -13.694 0.584 -8.363 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -14.909 0.802 -9.607 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -13.942 -0.225 -11.925 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.876 0.885 -11.481 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -11.566 -0.263 -12.995 1.00 0.00 H new ATOM 2280 N HIS A 151 -13.364 4.117 -10.701 1.00 0.00 N ATOM 2281 CA HIS A 151 -13.493 4.839 -11.958 1.00 0.00 C ATOM 2282 C HIS A 151 -12.564 4.207 -12.982 1.00 0.00 C ATOM 2283 O HIS A 151 -11.736 3.375 -12.623 1.00 0.00 O ATOM 2284 CB HIS A 151 -13.144 6.321 -11.774 1.00 0.00 C ATOM 2285 CG HIS A 151 -14.193 7.105 -11.050 1.00 0.00 C ATOM 2286 ND1 HIS A 151 -14.254 7.197 -9.676 1.00 0.00 N ATOM 2287 CD2 HIS A 151 -15.219 7.848 -11.521 1.00 0.00 C ATOM 2288 CE1 HIS A 151 -15.274 7.963 -9.337 1.00 0.00 C ATOM 2289 NE2 HIS A 151 -15.877 8.370 -10.436 1.00 0.00 N ATOM 0 H HIS A 151 -12.436 4.176 -10.281 1.00 0.00 H new ATOM 0 HA HIS A 151 -14.525 4.778 -12.303 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -12.204 6.398 -11.227 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -12.980 6.770 -12.754 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -15.474 8.002 -12.559 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -15.566 8.214 -8.328 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -16.698 8.974 -10.474 1.00 0.00 H new ATOM 2298 N HIS A 152 -12.692 4.584 -14.242 1.00 0.00 N ATOM 2299 CA HIS A 152 -11.824 4.031 -15.272 1.00 0.00 C ATOM 2300 C HIS A 152 -11.286 5.131 -16.172 1.00 0.00 C ATOM 2301 O HIS A 152 -12.028 5.736 -16.945 1.00 0.00 O ATOM 2302 CB HIS A 152 -12.567 2.989 -16.114 1.00 0.00 C ATOM 2303 CG HIS A 152 -11.653 2.140 -16.945 1.00 0.00 C ATOM 2304 ND1 HIS A 152 -11.233 2.486 -18.214 1.00 0.00 N ATOM 2305 CD2 HIS A 152 -11.072 0.948 -16.674 1.00 0.00 C ATOM 2306 CE1 HIS A 152 -10.436 1.543 -18.682 1.00 0.00 C ATOM 2307 NE2 HIS A 152 -10.321 0.600 -17.767 1.00 0.00 N ATOM 0 H HIS A 152 -13.378 5.261 -14.576 1.00 0.00 H new ATOM 0 HA HIS A 152 -10.987 3.544 -14.772 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -13.149 2.346 -15.454 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -13.275 3.498 -16.769 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -11.180 0.376 -15.764 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -9.959 1.544 -19.651 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -9.764 -0.250 -17.858 1.00 0.00 H new ATOM 2316 N HIS A 153 -9.996 5.384 -16.064 1.00 0.00 N ATOM 2317 CA HIS A 153 -9.333 6.354 -16.916 1.00 0.00 C ATOM 2318 C HIS A 153 -8.468 5.628 -17.940 1.00 0.00 C ATOM 2319 O HIS A 153 -8.943 5.416 -19.074 1.00 0.00 O ATOM 2320 CB HIS A 153 -8.491 7.315 -16.069 1.00 0.00 C ATOM 2321 CG HIS A 153 -7.622 8.238 -16.869 1.00 0.00 C ATOM 2322 ND1 HIS A 153 -6.297 7.974 -17.132 1.00 0.00 N ATOM 2323 CD2 HIS A 153 -7.891 9.425 -17.461 1.00 0.00 C ATOM 2324 CE1 HIS A 153 -5.786 8.956 -17.848 1.00 0.00 C ATOM 2325 NE2 HIS A 153 -6.734 9.849 -18.063 1.00 0.00 N ATOM 2326 OXT HIS A 153 -7.334 5.245 -17.594 1.00 0.00 O ATOM 0 H HIS A 153 -9.382 4.928 -15.389 1.00 0.00 H new ATOM 0 HA HIS A 153 -10.082 6.942 -17.447 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -9.157 7.911 -15.445 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -7.861 6.732 -15.397 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -8.839 9.942 -17.460 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -4.766 9.019 -18.199 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -6.624 10.714 -18.591 1.00 0.00 H new TER 2335 HIS A 153