USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 952 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 133 GLN :FLIP amide:sc= 0.96 F(o=-1.3!,f=2.8) USER MOD Set 1.2: A 137 THR OG1 : rot -135:sc= 1.84 USER MOD Set 2.1: A 131 ASN :FLIP amide:sc= 0.0546 F(o=-1.8!,f=-0.022) USER MOD Set 2.2: A 139 ASN : amide:sc= -0.0769 K(o=-0.022,f=-5!) USER MOD Set 3.1: A 46 HIS : no HD1:sc= -5.07! C(o=-13!,f=-23!) USER MOD Set 3.2: A 48 HIS : no HE2:sc= -0.536 K(o=-13,f=-14) USER MOD Set 3.3: A 63 HIS : no HD1:sc= -3.69 K(o=-13,f=-17!) USER MOD Set 3.4: A 71 HIS : +bothHN:sc= -0.288 K(o=-13,f=-21!) USER MOD Set 3.5: A 80 HIS : no HD1:sc= -2.31 K(o=-13,f=-14) USER MOD Set 3.6: A 120 HIS :FLIP no HD1:sc= -0.998 F(o=-14,f=-13) USER MOD Single : A 3 LYS NZ :NH3+ -132:sc= 0.97 (180deg=-1.11!) USER MOD Single : A 9 LYS NZ :NH3+ -156:sc= 1.14 (180deg=0.784) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 157:sc= -0.0291 (180deg=-0.293) USER MOD Single : A 34 SER OG : rot 180:sc= -0.122 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.0601 USER MOD Single : A 43 HIS : +bothHN:sc= -0.961! C(o=-0.96!,f=-9.7!) USER MOD Single : A 65 ASN : amide:sc= -0.539 K(o=-0.54,f=-1.5) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 0.315 X(o=0.31,f=-0.043) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -175:sc= 0.372 (180deg=0.236) USER MOD Single : A 98 SER OG : rot 180:sc= 0.279 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.128 K(o=-0.13,f=-1.3) USER MOD Single : A 111 SER OG : rot 84:sc= 0.658 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 SER OG : rot 106:sc= 0.226 USER MOD Single : A 135 THR OG1 : rot 14:sc= 0.216 USER MOD Single : A 136 LYS NZ :NH3+ -154:sc= 1.15 (180deg=0.771) USER MOD Single : A 142 SER OG : rot -121:sc= 0.517 USER MOD Single : A 146 CYS SG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 27 N LYS A 3 12.781 6.989 10.510 1.00 0.00 N ATOM 28 CA LYS A 3 11.874 5.989 9.989 1.00 0.00 C ATOM 29 C LYS A 3 10.437 6.417 10.286 1.00 0.00 C ATOM 30 O LYS A 3 10.192 7.134 11.259 1.00 0.00 O ATOM 31 CB LYS A 3 12.217 4.607 10.570 1.00 0.00 C ATOM 32 CG LYS A 3 12.332 4.573 12.105 1.00 0.00 C ATOM 33 CD LYS A 3 12.161 3.137 12.627 1.00 0.00 C ATOM 34 CE LYS A 3 13.455 2.336 12.435 1.00 0.00 C ATOM 35 NZ LYS A 3 13.202 0.890 12.292 1.00 0.00 N ATOM 0 HA LYS A 3 11.979 5.905 8.907 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.452 3.896 10.259 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.160 4.269 10.140 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.302 4.964 12.411 1.00 0.00 H new ATOM 0 HG3 LYS A 3 11.574 5.219 12.547 1.00 0.00 H new ATOM 0 HD2 LYS A 3 11.893 3.158 13.683 1.00 0.00 H new ATOM 0 HD3 LYS A 3 11.342 2.648 12.100 1.00 0.00 H new ATOM 0 HE2 LYS A 3 13.977 2.700 11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 3 14.114 2.505 13.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 13.843 0.362 12.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 12.217 0.683 12.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.367 0.604 11.306 1.00 0.00 H new ATOM 49 N ALA A 4 9.499 5.989 9.441 1.00 0.00 N ATOM 50 CA ALA A 4 8.070 6.188 9.633 1.00 0.00 C ATOM 51 C ALA A 4 7.420 4.853 9.975 1.00 0.00 C ATOM 52 O ALA A 4 8.040 3.799 9.831 1.00 0.00 O ATOM 53 CB ALA A 4 7.432 6.820 8.390 1.00 0.00 C ATOM 0 H ALA A 4 9.722 5.482 8.584 1.00 0.00 H new ATOM 0 HA ALA A 4 7.910 6.880 10.460 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.364 6.958 8.559 1.00 0.00 H new ATOM 0 HB2 ALA A 4 7.896 7.787 8.194 1.00 0.00 H new ATOM 0 HB3 ALA A 4 7.581 6.165 7.532 1.00 0.00 H new ATOM 59 N VAL A 5 6.167 4.901 10.415 1.00 0.00 N ATOM 60 CA VAL A 5 5.350 3.762 10.777 1.00 0.00 C ATOM 61 C VAL A 5 3.922 4.090 10.348 1.00 0.00 C ATOM 62 O VAL A 5 3.539 5.262 10.372 1.00 0.00 O ATOM 63 CB VAL A 5 5.476 3.483 12.291 1.00 0.00 C ATOM 64 CG1 VAL A 5 5.076 4.697 13.145 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.677 2.263 12.767 1.00 0.00 C ATOM 0 H VAL A 5 5.673 5.786 10.533 1.00 0.00 H new ATOM 0 HA VAL A 5 5.672 2.848 10.277 1.00 0.00 H new ATOM 0 HB VAL A 5 6.535 3.268 12.431 1.00 0.00 H new ATOM 0 HG11 VAL A 5 5.182 4.450 14.201 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.722 5.541 12.903 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.040 4.963 12.937 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.816 2.133 13.840 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.619 2.416 12.554 1.00 0.00 H new ATOM 0 HG23 VAL A 5 5.027 1.372 12.245 1.00 0.00 H new ATOM 75 N ALA A 6 3.140 3.086 9.944 1.00 0.00 N ATOM 76 CA ALA A 6 1.707 3.274 9.750 1.00 0.00 C ATOM 77 C ALA A 6 0.959 2.081 10.318 1.00 0.00 C ATOM 78 O ALA A 6 1.072 0.973 9.798 1.00 0.00 O ATOM 79 CB ALA A 6 1.379 3.509 8.276 1.00 0.00 C ATOM 0 H ALA A 6 3.475 2.143 9.747 1.00 0.00 H new ATOM 0 HA ALA A 6 1.384 4.166 10.286 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.304 3.646 8.160 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.898 4.401 7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.700 2.648 7.690 1.00 0.00 H new ATOM 85 N VAL A 7 0.224 2.295 11.406 1.00 0.00 N ATOM 86 CA VAL A 7 -0.582 1.270 12.023 1.00 0.00 C ATOM 87 C VAL A 7 -1.923 1.189 11.286 1.00 0.00 C ATOM 88 O VAL A 7 -2.891 1.865 11.627 1.00 0.00 O ATOM 89 CB VAL A 7 -0.652 1.509 13.541 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.769 1.574 14.127 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.417 2.764 13.988 1.00 0.00 C ATOM 0 H VAL A 7 0.177 3.196 11.881 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.140 0.278 11.928 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.220 0.660 13.921 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.712 1.743 15.202 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.285 0.633 13.935 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.318 2.391 13.660 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.402 2.831 15.076 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.944 3.649 13.563 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.449 2.703 13.643 1.00 0.00 H new ATOM 101 N LEU A 8 -1.977 0.368 10.237 1.00 0.00 N ATOM 102 CA LEU A 8 -3.212 0.001 9.572 1.00 0.00 C ATOM 103 C LEU A 8 -4.172 -0.560 10.609 1.00 0.00 C ATOM 104 O LEU A 8 -3.732 -1.335 11.458 1.00 0.00 O ATOM 105 CB LEU A 8 -2.923 -1.015 8.457 1.00 0.00 C ATOM 106 CG LEU A 8 -2.619 -0.303 7.134 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.364 0.561 7.271 1.00 0.00 C ATOM 108 CD2 LEU A 8 -2.418 -1.337 6.023 1.00 0.00 C ATOM 0 H LEU A 8 -1.149 -0.063 9.825 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.671 0.873 9.107 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.077 -1.641 8.740 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.781 -1.676 8.330 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.462 0.340 6.880 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.161 1.060 6.324 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.520 1.308 8.049 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.516 -0.069 7.538 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.202 -0.826 5.085 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.584 -1.990 6.280 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.324 -1.932 5.912 1.00 0.00 H new ATOM 120 N LYS A 9 -5.451 -0.178 10.540 1.00 0.00 N ATOM 121 CA LYS A 9 -6.492 -0.706 11.401 1.00 0.00 C ATOM 122 C LYS A 9 -7.792 -0.749 10.596 1.00 0.00 C ATOM 123 O LYS A 9 -8.053 0.146 9.793 1.00 0.00 O ATOM 124 CB LYS A 9 -6.598 0.152 12.679 1.00 0.00 C ATOM 125 CG LYS A 9 -6.638 -0.696 13.966 1.00 0.00 C ATOM 126 CD LYS A 9 -8.032 -1.284 14.214 1.00 0.00 C ATOM 127 CE LYS A 9 -8.024 -2.312 15.350 1.00 0.00 C ATOM 128 NZ LYS A 9 -9.372 -2.891 15.574 1.00 0.00 N ATOM 0 H LYS A 9 -5.788 0.516 9.873 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.264 -1.719 11.732 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.749 0.834 12.725 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.497 0.766 12.626 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.910 -1.504 13.892 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.346 -0.080 14.817 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.727 -0.480 14.456 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.395 -1.755 13.301 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.320 -3.110 15.114 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.674 -1.838 16.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.440 -3.245 16.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.094 -2.159 15.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.528 -3.676 14.909 1.00 0.00 H new ATOM 142 N GLY A 10 -8.571 -1.819 10.753 1.00 0.00 N ATOM 143 CA GLY A 10 -9.863 -1.973 10.117 1.00 0.00 C ATOM 144 C GLY A 10 -10.951 -2.212 11.150 1.00 0.00 C ATOM 145 O GLY A 10 -10.711 -2.135 12.357 1.00 0.00 O ATOM 0 H GLY A 10 -8.310 -2.613 11.338 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.096 -1.080 9.537 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -9.831 -2.808 9.417 1.00 0.00 H new ATOM 149 N ASP A 11 -12.140 -2.536 10.641 1.00 0.00 N ATOM 150 CA ASP A 11 -13.326 -2.814 11.436 1.00 0.00 C ATOM 151 C ASP A 11 -13.027 -3.889 12.483 1.00 0.00 C ATOM 152 O ASP A 11 -13.438 -3.797 13.637 1.00 0.00 O ATOM 153 CB ASP A 11 -14.466 -3.262 10.499 1.00 0.00 C ATOM 154 CG ASP A 11 -15.762 -2.511 10.769 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.125 -2.408 11.960 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.364 -2.055 9.774 1.00 0.00 O ATOM 0 H ASP A 11 -12.304 -2.613 9.637 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.632 -1.911 11.965 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.166 -3.104 9.463 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.636 -4.332 10.622 1.00 0.00 H new ATOM 161 N GLY A 12 -12.292 -4.926 12.066 1.00 0.00 N ATOM 162 CA GLY A 12 -12.093 -6.116 12.864 1.00 0.00 C ATOM 163 C GLY A 12 -10.718 -6.101 13.533 1.00 0.00 C ATOM 164 O GLY A 12 -10.228 -5.044 13.960 1.00 0.00 O ATOM 0 H GLY A 12 -11.822 -4.952 11.161 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -12.871 -6.183 13.624 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.186 -7.001 12.234 1.00 0.00 H new ATOM 168 N PRO A 13 -10.075 -7.279 13.608 1.00 0.00 N ATOM 169 CA PRO A 13 -8.726 -7.407 14.115 1.00 0.00 C ATOM 170 C PRO A 13 -7.697 -7.047 13.041 1.00 0.00 C ATOM 171 O PRO A 13 -6.522 -6.927 13.371 1.00 0.00 O ATOM 172 CB PRO A 13 -8.599 -8.866 14.550 1.00 0.00 C ATOM 173 CG PRO A 13 -9.490 -9.599 13.547 1.00 0.00 C ATOM 174 CD PRO A 13 -10.591 -8.585 13.217 1.00 0.00 C ATOM 0 HA PRO A 13 -8.535 -6.725 14.944 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -7.567 -9.213 14.503 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -8.939 -9.013 15.575 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.933 -9.888 12.655 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.904 -10.512 13.974 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -10.832 -8.605 12.154 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.509 -8.818 13.757 1.00 0.00 H new ATOM 182 N VAL A 14 -8.133 -6.862 11.783 1.00 0.00 N ATOM 183 CA VAL A 14 -7.329 -6.347 10.684 1.00 0.00 C ATOM 184 C VAL A 14 -6.504 -5.167 11.187 1.00 0.00 C ATOM 185 O VAL A 14 -7.033 -4.067 11.368 1.00 0.00 O ATOM 186 CB VAL A 14 -8.227 -5.917 9.510 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.347 -5.449 8.347 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.121 -7.044 8.976 1.00 0.00 C ATOM 0 H VAL A 14 -9.090 -7.077 11.504 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.663 -7.131 10.323 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.870 -5.126 9.895 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.979 -5.143 7.513 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.737 -4.605 8.669 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.698 -6.265 8.030 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.726 -6.669 8.150 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.498 -7.867 8.625 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -9.775 -7.398 9.773 1.00 0.00 H new ATOM 198 N GLN A 15 -5.213 -5.412 11.407 1.00 0.00 N ATOM 199 CA GLN A 15 -4.253 -4.409 11.805 1.00 0.00 C ATOM 200 C GLN A 15 -2.959 -4.683 11.050 1.00 0.00 C ATOM 201 O GLN A 15 -2.682 -5.846 10.762 1.00 0.00 O ATOM 202 CB GLN A 15 -4.080 -4.475 13.329 1.00 0.00 C ATOM 203 CG GLN A 15 -2.806 -3.761 13.783 1.00 0.00 C ATOM 204 CD GLN A 15 -2.739 -3.522 15.288 1.00 0.00 C ATOM 205 OE1 GLN A 15 -3.721 -3.681 16.005 1.00 0.00 O ATOM 206 NE2 GLN A 15 -1.569 -3.125 15.783 1.00 0.00 N ATOM 0 H GLN A 15 -4.805 -6.342 11.308 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.581 -3.398 11.561 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.944 -4.021 13.814 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -4.047 -5.517 13.647 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.942 -4.351 13.479 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.734 -2.803 13.269 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -0.769 -3.001 15.163 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -1.473 -2.945 16.782 1.00 0.00 H new ATOM 215 N GLY A 16 -2.166 -3.650 10.737 1.00 0.00 N ATOM 216 CA GLY A 16 -0.836 -3.868 10.177 1.00 0.00 C ATOM 217 C GLY A 16 0.149 -2.773 10.542 1.00 0.00 C ATOM 218 O GLY A 16 -0.109 -1.604 10.293 1.00 0.00 O ATOM 0 H GLY A 16 -2.422 -2.670 10.861 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.452 -4.826 10.529 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.911 -3.934 9.092 1.00 0.00 H new ATOM 222 N ILE A 17 1.288 -3.152 11.117 1.00 0.00 N ATOM 223 CA ILE A 17 2.351 -2.237 11.488 1.00 0.00 C ATOM 224 C ILE A 17 3.262 -2.089 10.266 1.00 0.00 C ATOM 225 O ILE A 17 4.167 -2.894 10.064 1.00 0.00 O ATOM 226 CB ILE A 17 3.072 -2.801 12.728 1.00 0.00 C ATOM 227 CG1 ILE A 17 2.105 -2.941 13.923 1.00 0.00 C ATOM 228 CG2 ILE A 17 4.252 -1.911 13.145 1.00 0.00 C ATOM 229 CD1 ILE A 17 2.393 -4.215 14.721 1.00 0.00 C ATOM 0 H ILE A 17 1.497 -4.125 11.340 1.00 0.00 H new ATOM 0 HA ILE A 17 1.988 -1.247 11.762 1.00 0.00 H new ATOM 0 HB ILE A 17 3.447 -3.786 12.450 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.199 -2.072 14.574 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.077 -2.959 13.562 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.738 -2.338 14.022 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.969 -1.851 12.326 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.888 -0.912 13.383 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.696 -4.286 15.556 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.274 -5.084 14.074 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.414 -4.183 15.102 1.00 0.00 H new ATOM 241 N ILE A 18 3.002 -1.086 9.426 1.00 0.00 N ATOM 242 CA ILE A 18 3.913 -0.691 8.357 1.00 0.00 C ATOM 243 C ILE A 18 5.103 0.016 8.988 1.00 0.00 C ATOM 244 O ILE A 18 4.909 0.742 9.959 1.00 0.00 O ATOM 245 CB ILE A 18 3.188 0.260 7.395 1.00 0.00 C ATOM 246 CG1 ILE A 18 2.045 -0.448 6.658 1.00 0.00 C ATOM 247 CG2 ILE A 18 4.131 0.949 6.405 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.567 -1.269 5.482 1.00 0.00 C ATOM 0 H ILE A 18 2.151 -0.525 9.470 1.00 0.00 H new ATOM 0 HA ILE A 18 4.250 -1.564 7.798 1.00 0.00 H new ATOM 0 HB ILE A 18 2.761 1.046 8.018 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.511 -1.099 7.350 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.328 0.291 6.299 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.557 1.607 5.753 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.869 1.535 6.953 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.640 0.196 5.803 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.732 -1.758 4.981 1.00 0.00 H new ATOM 0 HD12 ILE A 18 3.078 -0.612 4.778 1.00 0.00 H new ATOM 0 HD13 ILE A 18 3.264 -2.024 5.846 1.00 0.00 H new ATOM 260 N ASN A 19 6.299 -0.145 8.412 1.00 0.00 N ATOM 261 CA ASN A 19 7.511 0.573 8.775 1.00 0.00 C ATOM 262 C ASN A 19 8.132 1.106 7.484 1.00 0.00 C ATOM 263 O ASN A 19 8.219 0.370 6.507 1.00 0.00 O ATOM 264 CB ASN A 19 8.519 -0.353 9.470 1.00 0.00 C ATOM 265 CG ASN A 19 7.901 -1.263 10.526 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.756 -2.460 10.312 1.00 0.00 O ATOM 267 ND2 ASN A 19 7.551 -0.719 11.688 1.00 0.00 N ATOM 0 H ASN A 19 6.448 -0.807 7.650 1.00 0.00 H new ATOM 0 HA ASN A 19 7.263 1.379 9.466 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.010 -0.969 8.717 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.293 0.256 9.938 1.00 0.00 H new ATOM 0 HD21 ASN A 19 7.152 -1.301 12.424 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.681 0.281 11.843 1.00 0.00 H new ATOM 274 N PHE A 20 8.578 2.360 7.475 1.00 0.00 N ATOM 275 CA PHE A 20 9.338 2.949 6.377 1.00 0.00 C ATOM 276 C PHE A 20 10.722 3.309 6.902 1.00 0.00 C ATOM 277 O PHE A 20 10.785 4.114 7.826 1.00 0.00 O ATOM 278 CB PHE A 20 8.670 4.236 5.887 1.00 0.00 C ATOM 279 CG PHE A 20 7.276 4.081 5.311 1.00 0.00 C ATOM 280 CD1 PHE A 20 6.155 3.976 6.154 1.00 0.00 C ATOM 281 CD2 PHE A 20 7.096 4.128 3.919 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.863 3.938 5.602 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.808 4.035 3.365 1.00 0.00 C ATOM 284 CZ PHE A 20 4.688 3.946 4.208 1.00 0.00 C ATOM 0 H PHE A 20 8.418 3.007 8.247 1.00 0.00 H new ATOM 0 HA PHE A 20 9.390 2.236 5.554 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.622 4.937 6.720 1.00 0.00 H new ATOM 0 HB3 PHE A 20 9.308 4.687 5.127 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.287 3.925 7.225 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.953 4.236 3.270 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.001 3.903 6.252 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.679 4.032 2.293 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.696 3.884 3.786 1.00 0.00 H new ATOM 294 N GLU A 21 11.810 2.785 6.330 1.00 0.00 N ATOM 295 CA GLU A 21 13.163 3.215 6.695 1.00 0.00 C ATOM 296 C GLU A 21 13.779 4.050 5.571 1.00 0.00 C ATOM 297 O GLU A 21 13.696 3.658 4.406 1.00 0.00 O ATOM 298 CB GLU A 21 14.061 2.022 7.032 1.00 0.00 C ATOM 299 CG GLU A 21 13.554 1.238 8.254 1.00 0.00 C ATOM 300 CD GLU A 21 14.684 0.563 9.033 1.00 0.00 C ATOM 301 OE1 GLU A 21 15.800 0.467 8.484 1.00 0.00 O ATOM 302 OE2 GLU A 21 14.418 0.204 10.204 1.00 0.00 O ATOM 0 H GLU A 21 11.780 2.062 5.612 1.00 0.00 H new ATOM 0 HA GLU A 21 13.085 3.832 7.590 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.114 1.355 6.171 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.074 2.375 7.224 1.00 0.00 H new ATOM 0 HG2 GLU A 21 13.015 1.915 8.917 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.842 0.481 7.925 1.00 0.00 H new ATOM 395 N PRO A 28 16.660 5.693 -1.222 1.00 0.00 N ATOM 396 CA PRO A 28 15.476 4.872 -1.420 1.00 0.00 C ATOM 397 C PRO A 28 14.814 4.530 -0.081 1.00 0.00 C ATOM 398 O PRO A 28 15.468 4.014 0.829 1.00 0.00 O ATOM 399 CB PRO A 28 15.961 3.623 -2.165 1.00 0.00 C ATOM 400 CG PRO A 28 17.438 3.522 -1.784 1.00 0.00 C ATOM 401 CD PRO A 28 17.859 4.984 -1.638 1.00 0.00 C ATOM 0 HA PRO A 28 14.709 5.391 -1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 28 15.407 2.735 -1.860 1.00 0.00 H new ATOM 0 HB3 PRO A 28 15.832 3.724 -3.243 1.00 0.00 H new ATOM 0 HG2 PRO A 28 17.578 2.968 -0.856 1.00 0.00 H new ATOM 0 HG3 PRO A 28 18.018 3.010 -2.552 1.00 0.00 H new ATOM 0 HD2 PRO A 28 18.654 5.092 -0.901 1.00 0.00 H new ATOM 0 HD3 PRO A 28 18.242 5.378 -2.579 1.00 0.00 H new ATOM 409 N VAL A 29 13.511 4.806 0.035 1.00 0.00 N ATOM 410 CA VAL A 29 12.717 4.460 1.189 1.00 0.00 C ATOM 411 C VAL A 29 12.445 2.963 1.089 1.00 0.00 C ATOM 412 O VAL A 29 12.045 2.501 0.024 1.00 0.00 O ATOM 413 CB VAL A 29 11.425 5.310 1.177 1.00 0.00 C ATOM 414 CG1 VAL A 29 10.227 4.664 0.475 1.00 0.00 C ATOM 415 CG2 VAL A 29 11.005 5.659 2.600 1.00 0.00 C ATOM 0 H VAL A 29 12.981 5.286 -0.692 1.00 0.00 H new ATOM 0 HA VAL A 29 13.219 4.668 2.134 1.00 0.00 H new ATOM 0 HB VAL A 29 11.690 6.196 0.601 1.00 0.00 H new ATOM 0 HG11 VAL A 29 9.372 5.338 0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 29 10.479 4.467 -0.567 1.00 0.00 H new ATOM 0 HG13 VAL A 29 9.977 3.726 0.971 1.00 0.00 H new ATOM 0 HG21 VAL A 29 10.094 6.257 2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 29 10.821 4.742 3.160 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.799 6.227 3.085 1.00 0.00 H new ATOM 425 N LYS A 30 12.659 2.205 2.165 1.00 0.00 N ATOM 426 CA LYS A 30 12.295 0.807 2.257 1.00 0.00 C ATOM 427 C LYS A 30 10.965 0.715 2.990 1.00 0.00 C ATOM 428 O LYS A 30 10.889 1.078 4.163 1.00 0.00 O ATOM 429 CB LYS A 30 13.400 0.049 2.989 1.00 0.00 C ATOM 430 CG LYS A 30 14.501 -0.329 1.993 1.00 0.00 C ATOM 431 CD LYS A 30 15.710 -0.972 2.682 1.00 0.00 C ATOM 432 CE LYS A 30 17.000 -0.651 1.920 1.00 0.00 C ATOM 433 NZ LYS A 30 17.376 0.775 2.042 1.00 0.00 N ATOM 0 H LYS A 30 13.101 2.563 3.012 1.00 0.00 H new ATOM 0 HA LYS A 30 12.184 0.358 1.270 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.812 0.666 3.787 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.993 -0.848 3.457 1.00 0.00 H new ATOM 0 HG2 LYS A 30 14.097 -1.020 1.253 1.00 0.00 H new ATOM 0 HG3 LYS A 30 14.823 0.562 1.455 1.00 0.00 H new ATOM 0 HD2 LYS A 30 15.787 -0.609 3.707 1.00 0.00 H new ATOM 0 HD3 LYS A 30 15.573 -2.052 2.736 1.00 0.00 H new ATOM 0 HE2 LYS A 30 17.810 -1.273 2.300 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.872 -0.903 0.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 18.396 0.881 1.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 16.847 1.335 1.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.150 1.113 2.999 1.00 0.00 H new ATOM 447 N VAL A 31 9.942 0.250 2.275 1.00 0.00 N ATOM 448 CA VAL A 31 8.591 0.014 2.740 1.00 0.00 C ATOM 449 C VAL A 31 8.517 -1.428 3.231 1.00 0.00 C ATOM 450 O VAL A 31 8.529 -2.362 2.427 1.00 0.00 O ATOM 451 CB VAL A 31 7.617 0.244 1.573 1.00 0.00 C ATOM 452 CG1 VAL A 31 6.166 -0.072 1.954 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.711 1.692 1.099 1.00 0.00 C ATOM 0 H VAL A 31 10.051 0.014 1.289 1.00 0.00 H new ATOM 0 HA VAL A 31 8.323 0.691 3.551 1.00 0.00 H new ATOM 0 HB VAL A 31 7.906 -0.437 0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.518 0.106 1.096 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.088 -1.116 2.257 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.859 0.569 2.780 1.00 0.00 H new ATOM 0 HG21 VAL A 31 7.019 1.850 0.272 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.454 2.361 1.920 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.728 1.901 0.766 1.00 0.00 H new ATOM 463 N TRP A 32 8.416 -1.596 4.545 1.00 0.00 N ATOM 464 CA TRP A 32 8.141 -2.869 5.182 1.00 0.00 C ATOM 465 C TRP A 32 6.756 -2.837 5.805 1.00 0.00 C ATOM 466 O TRP A 32 6.239 -1.768 6.120 1.00 0.00 O ATOM 467 CB TRP A 32 9.190 -3.175 6.253 1.00 0.00 C ATOM 468 CG TRP A 32 10.406 -3.858 5.731 1.00 0.00 C ATOM 469 CD1 TRP A 32 10.428 -5.131 5.288 1.00 0.00 C ATOM 470 CD2 TRP A 32 11.770 -3.365 5.602 1.00 0.00 C ATOM 471 NE1 TRP A 32 11.669 -5.415 4.765 1.00 0.00 N ATOM 472 CE2 TRP A 32 12.558 -4.385 4.992 1.00 0.00 C ATOM 473 CE3 TRP A 32 12.424 -2.164 5.948 1.00 0.00 C ATOM 474 CZ2 TRP A 32 13.927 -4.221 4.733 1.00 0.00 C ATOM 475 CZ3 TRP A 32 13.808 -2.013 5.749 1.00 0.00 C ATOM 476 CH2 TRP A 32 14.560 -3.040 5.152 1.00 0.00 C ATOM 0 H TRP A 32 8.527 -0.829 5.209 1.00 0.00 H new ATOM 0 HA TRP A 32 8.182 -3.655 4.428 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.487 -2.243 6.733 1.00 0.00 H new ATOM 0 HB3 TRP A 32 8.737 -3.800 7.023 1.00 0.00 H new ATOM 0 HD1 TRP A 32 9.599 -5.822 5.336 1.00 0.00 H new ATOM 0 HE1 TRP A 32 11.902 -6.277 4.272 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.854 -1.350 6.371 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 14.485 -4.990 4.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 14.297 -1.101 6.057 1.00 0.00 H new ATOM 0 HH2 TRP A 32 15.625 -2.920 5.016 1.00 0.00 H new ATOM 487 N GLY A 33 6.160 -4.005 6.031 1.00 0.00 N ATOM 488 CA GLY A 33 4.983 -4.071 6.877 1.00 0.00 C ATOM 489 C GLY A 33 4.615 -5.502 7.199 1.00 0.00 C ATOM 490 O GLY A 33 5.254 -6.424 6.704 1.00 0.00 O ATOM 0 H GLY A 33 6.468 -4.898 5.647 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.167 -3.524 7.802 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.146 -3.582 6.378 1.00 0.00 H new ATOM 494 N SER A 34 3.585 -5.695 8.022 1.00 0.00 N ATOM 495 CA SER A 34 3.148 -7.011 8.440 1.00 0.00 C ATOM 496 C SER A 34 1.714 -6.858 8.915 1.00 0.00 C ATOM 497 O SER A 34 1.489 -6.411 10.040 1.00 0.00 O ATOM 498 CB SER A 34 4.052 -7.549 9.556 1.00 0.00 C ATOM 499 OG SER A 34 5.395 -7.679 9.126 1.00 0.00 O ATOM 0 H SER A 34 3.032 -4.933 8.415 1.00 0.00 H new ATOM 0 HA SER A 34 3.206 -7.728 7.621 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.008 -6.879 10.415 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.681 -8.518 9.889 1.00 0.00 H new ATOM 0 HG SER A 34 5.943 -8.023 9.863 1.00 0.00 H new ATOM 505 N ILE A 35 0.748 -7.160 8.045 1.00 0.00 N ATOM 506 CA ILE A 35 -0.645 -7.173 8.471 1.00 0.00 C ATOM 507 C ILE A 35 -0.884 -8.389 9.358 1.00 0.00 C ATOM 508 O ILE A 35 -0.077 -9.313 9.372 1.00 0.00 O ATOM 509 CB ILE A 35 -1.610 -7.057 7.268 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.622 -5.904 7.451 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.355 -8.358 6.925 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.626 -4.963 6.250 1.00 0.00 C ATOM 0 H ILE A 35 0.902 -7.393 7.064 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.862 -6.291 9.074 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.961 -6.837 6.420 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.621 -6.316 7.595 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.376 -5.343 8.353 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.010 -8.188 6.070 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.633 -9.137 6.680 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.951 -8.673 7.782 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.350 -4.165 6.415 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.633 -4.532 6.123 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.898 -5.519 5.353 1.00 0.00 H new ATOM 524 N LYS A 36 -1.999 -8.400 10.079 1.00 0.00 N ATOM 525 CA LYS A 36 -2.447 -9.559 10.817 1.00 0.00 C ATOM 526 C LYS A 36 -3.955 -9.436 10.973 1.00 0.00 C ATOM 527 O LYS A 36 -4.452 -8.864 11.939 1.00 0.00 O ATOM 528 CB LYS A 36 -1.721 -9.635 12.161 1.00 0.00 C ATOM 529 CG LYS A 36 -1.701 -11.066 12.720 1.00 0.00 C ATOM 530 CD LYS A 36 -1.909 -11.064 14.236 1.00 0.00 C ATOM 531 CE LYS A 36 -1.632 -12.464 14.810 1.00 0.00 C ATOM 532 NZ LYS A 36 -1.225 -12.405 16.228 1.00 0.00 N ATOM 0 H LYS A 36 -2.618 -7.594 10.164 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.217 -10.487 10.293 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.698 -9.277 12.042 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.209 -8.973 12.876 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.482 -11.658 12.243 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.750 -11.541 12.480 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.246 -10.334 14.701 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.930 -10.762 14.470 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.526 -13.080 14.714 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.848 -12.947 14.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.047 -13.368 16.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.357 -11.839 16.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.983 -11.967 16.789 1.00 0.00 H new ATOM 546 N GLY A 37 -4.681 -9.950 9.987 1.00 0.00 N ATOM 547 CA GLY A 37 -6.131 -10.024 10.066 1.00 0.00 C ATOM 548 C GLY A 37 -6.826 -10.105 8.710 1.00 0.00 C ATOM 549 O GLY A 37 -8.042 -10.282 8.670 1.00 0.00 O ATOM 0 H GLY A 37 -4.286 -10.322 9.123 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.408 -10.897 10.657 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.500 -9.148 10.600 1.00 0.00 H new ATOM 553 N LEU A 38 -6.094 -9.947 7.600 1.00 0.00 N ATOM 554 CA LEU A 38 -6.666 -10.125 6.275 1.00 0.00 C ATOM 555 C LEU A 38 -6.978 -11.603 6.029 1.00 0.00 C ATOM 556 O LEU A 38 -6.757 -12.453 6.880 1.00 0.00 O ATOM 557 CB LEU A 38 -5.707 -9.572 5.198 1.00 0.00 C ATOM 558 CG LEU A 38 -5.918 -8.098 4.823 1.00 0.00 C ATOM 559 CD1 LEU A 38 -7.383 -7.713 4.629 1.00 0.00 C ATOM 560 CD2 LEU A 38 -5.317 -7.150 5.849 1.00 0.00 C ATOM 0 H LEU A 38 -5.105 -9.696 7.601 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.600 -9.566 6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.683 -9.697 5.549 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.811 -10.177 4.297 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.403 -7.996 3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.450 -6.657 4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.814 -8.314 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.932 -7.892 5.554 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.492 -6.120 5.539 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.783 -7.321 6.819 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.244 -7.329 5.925 1.00 0.00 H new ATOM 572 N THR A 39 -7.485 -11.900 4.837 1.00 0.00 N ATOM 573 CA THR A 39 -7.647 -13.241 4.312 1.00 0.00 C ATOM 574 C THR A 39 -6.542 -13.514 3.298 1.00 0.00 C ATOM 575 O THR A 39 -6.010 -12.575 2.697 1.00 0.00 O ATOM 576 CB THR A 39 -9.015 -13.318 3.640 1.00 0.00 C ATOM 577 OG1 THR A 39 -9.222 -12.139 2.873 1.00 0.00 O ATOM 578 CG2 THR A 39 -10.090 -13.417 4.723 1.00 0.00 C ATOM 0 H THR A 39 -7.805 -11.181 4.189 1.00 0.00 H new ATOM 0 HA THR A 39 -7.583 -13.985 5.106 1.00 0.00 H new ATOM 0 HB THR A 39 -9.066 -14.190 2.988 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.099 -12.182 2.437 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.073 -13.473 4.256 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.922 -14.312 5.322 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.042 -12.537 5.364 1.00 0.00 H new ATOM 586 N GLU A 40 -6.223 -14.793 3.115 1.00 0.00 N ATOM 587 CA GLU A 40 -5.229 -15.300 2.194 1.00 0.00 C ATOM 588 C GLU A 40 -5.414 -14.723 0.789 1.00 0.00 C ATOM 589 O GLU A 40 -6.538 -14.489 0.342 1.00 0.00 O ATOM 590 CB GLU A 40 -5.263 -16.838 2.183 1.00 0.00 C ATOM 591 CG GLU A 40 -6.662 -17.467 2.054 1.00 0.00 C ATOM 592 CD GLU A 40 -7.341 -17.689 3.402 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.918 -16.700 3.908 1.00 0.00 O ATOM 594 OE2 GLU A 40 -7.248 -18.829 3.903 1.00 0.00 O ATOM 0 H GLU A 40 -6.681 -15.539 3.638 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.246 -14.978 2.536 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.647 -17.192 1.357 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.803 -17.201 3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.289 -16.822 1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.579 -18.421 1.533 1.00 0.00 H new ATOM 601 N GLY A 41 -4.301 -14.503 0.085 1.00 0.00 N ATOM 602 CA GLY A 41 -4.328 -14.039 -1.291 1.00 0.00 C ATOM 603 C GLY A 41 -3.870 -12.591 -1.374 1.00 0.00 C ATOM 604 O GLY A 41 -3.396 -12.010 -0.399 1.00 0.00 O ATOM 0 H GLY A 41 -3.362 -14.643 0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -3.682 -14.667 -1.905 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.337 -14.131 -1.692 1.00 0.00 H new ATOM 608 N LEU A 42 -3.974 -12.019 -2.570 1.00 0.00 N ATOM 609 CA LEU A 42 -3.393 -10.728 -2.885 1.00 0.00 C ATOM 610 C LEU A 42 -4.294 -9.602 -2.372 1.00 0.00 C ATOM 611 O LEU A 42 -5.517 -9.720 -2.417 1.00 0.00 O ATOM 612 CB LEU A 42 -3.137 -10.655 -4.396 1.00 0.00 C ATOM 613 CG LEU A 42 -1.844 -11.355 -4.841 1.00 0.00 C ATOM 614 CD1 LEU A 42 -1.764 -12.835 -4.452 1.00 0.00 C ATOM 615 CD2 LEU A 42 -1.690 -11.234 -6.360 1.00 0.00 C ATOM 0 H LEU A 42 -4.470 -12.447 -3.352 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.435 -10.603 -2.381 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.981 -11.104 -4.920 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.095 -9.608 -4.698 1.00 0.00 H new ATOM 0 HG LEU A 42 -1.035 -10.849 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.821 -13.253 -4.803 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.821 -12.930 -3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.593 -13.376 -4.908 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.772 -11.731 -6.673 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.543 -11.703 -6.851 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -1.646 -10.181 -6.638 1.00 0.00 H new ATOM 627 N HIS A 43 -3.684 -8.529 -1.852 1.00 0.00 N ATOM 628 CA HIS A 43 -4.383 -7.350 -1.343 1.00 0.00 C ATOM 629 C HIS A 43 -3.747 -6.077 -1.905 1.00 0.00 C ATOM 630 O HIS A 43 -2.540 -5.915 -1.751 1.00 0.00 O ATOM 631 CB HIS A 43 -4.300 -7.379 0.185 1.00 0.00 C ATOM 632 CG HIS A 43 -5.303 -8.298 0.820 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.597 -7.962 1.165 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.106 -9.615 1.126 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.182 -9.065 1.660 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.299 -10.074 1.643 1.00 0.00 N ATOM 0 H HIS A 43 -2.669 -8.458 -1.773 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.427 -7.357 -1.655 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.297 -7.688 0.481 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.449 -6.370 0.569 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.030 -7.044 1.063 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.197 -10.183 0.990 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.200 -9.129 2.015 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.480 -11.026 1.961 1.00 0.00 H new ATOM 645 N GLY A 44 -4.520 -5.201 -2.563 1.00 0.00 N ATOM 646 CA GLY A 44 -4.007 -4.023 -3.251 1.00 0.00 C ATOM 647 C GLY A 44 -3.579 -2.947 -2.263 1.00 0.00 C ATOM 648 O GLY A 44 -4.377 -2.552 -1.428 1.00 0.00 O ATOM 0 H GLY A 44 -5.533 -5.299 -2.629 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.159 -4.305 -3.875 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.774 -3.625 -3.916 1.00 0.00 H new ATOM 652 N PHE A 45 -2.350 -2.448 -2.341 1.00 0.00 N ATOM 653 CA PHE A 45 -1.778 -1.598 -1.296 1.00 0.00 C ATOM 654 C PHE A 45 -1.466 -0.225 -1.876 1.00 0.00 C ATOM 655 O PHE A 45 -0.677 -0.147 -2.819 1.00 0.00 O ATOM 656 CB PHE A 45 -0.482 -2.238 -0.774 1.00 0.00 C ATOM 657 CG PHE A 45 -0.594 -2.775 0.634 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.439 -3.864 0.905 1.00 0.00 C ATOM 659 CD2 PHE A 45 0.120 -2.169 1.681 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.496 -4.396 2.205 1.00 0.00 C ATOM 661 CE2 PHE A 45 -0.054 -2.615 2.999 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.807 -3.770 3.252 1.00 0.00 C ATOM 0 H PHE A 45 -1.722 -2.619 -3.126 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.490 -1.494 -0.478 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.194 -3.050 -1.441 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.318 -1.498 -0.809 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.043 -4.291 0.118 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.803 -1.359 1.471 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.072 -5.289 2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.391 -2.070 3.818 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.856 -4.176 4.251 1.00 0.00 H new ATOM 672 N HIS A 46 -2.050 0.864 -1.357 1.00 0.00 N ATOM 673 CA HIS A 46 -1.836 2.161 -1.973 1.00 0.00 C ATOM 674 C HIS A 46 -1.988 3.266 -0.962 1.00 0.00 C ATOM 675 O HIS A 46 -2.736 3.136 0.009 1.00 0.00 O ATOM 676 CB HIS A 46 -2.816 2.452 -3.118 1.00 0.00 C ATOM 677 CG HIS A 46 -3.455 1.242 -3.717 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.776 0.829 -3.536 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.884 0.407 -4.626 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.956 -0.266 -4.304 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.838 -0.477 -5.001 1.00 0.00 N ATOM 0 H HIS A 46 -2.655 0.866 -0.536 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.823 2.127 -2.373 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.599 3.114 -2.748 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.286 2.992 -3.903 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.865 0.442 -4.981 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.851 -0.868 -4.347 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.720 -1.199 -5.712 1.00 0.00 H new ATOM 689 N VAL A 47 -1.327 4.377 -1.257 1.00 0.00 N ATOM 690 CA VAL A 47 -1.453 5.578 -0.471 1.00 0.00 C ATOM 691 C VAL A 47 -2.625 6.409 -1.018 1.00 0.00 C ATOM 692 O VAL A 47 -2.615 6.867 -2.165 1.00 0.00 O ATOM 693 CB VAL A 47 -0.082 6.268 -0.411 1.00 0.00 C ATOM 694 CG1 VAL A 47 0.138 7.276 -1.534 1.00 0.00 C ATOM 695 CG2 VAL A 47 0.096 6.891 0.969 1.00 0.00 C ATOM 0 H VAL A 47 -0.691 4.462 -2.050 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.716 5.389 0.570 1.00 0.00 H new ATOM 0 HB VAL A 47 0.687 5.512 -0.569 1.00 0.00 H new ATOM 0 HG11 VAL A 47 1.126 7.726 -1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.069 6.769 -2.497 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.623 8.055 -1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.067 7.384 1.023 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -0.693 7.623 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 47 0.042 6.112 1.730 1.00 0.00 H new ATOM 705 N HIS A 48 -3.692 6.537 -0.232 1.00 0.00 N ATOM 706 CA HIS A 48 -4.805 7.403 -0.563 1.00 0.00 C ATOM 707 C HIS A 48 -4.440 8.841 -0.222 1.00 0.00 C ATOM 708 O HIS A 48 -3.549 9.068 0.597 1.00 0.00 O ATOM 709 CB HIS A 48 -6.058 6.927 0.169 1.00 0.00 C ATOM 710 CG HIS A 48 -6.618 5.674 -0.456 1.00 0.00 C ATOM 711 ND1 HIS A 48 -7.909 5.524 -0.861 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.887 4.583 -0.838 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.009 4.314 -1.431 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.784 3.767 -1.518 1.00 0.00 N ATOM 0 H HIS A 48 -3.803 6.040 0.652 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.020 7.363 -1.631 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.820 6.738 1.216 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.813 7.713 0.151 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.660 6.205 -0.751 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.840 4.396 -0.652 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.926 3.853 -1.766 1.00 0.00 H new ATOM 722 N GLU A 49 -5.107 9.786 -0.896 1.00 0.00 N ATOM 723 CA GLU A 49 -4.733 11.188 -0.958 1.00 0.00 C ATOM 724 C GLU A 49 -4.263 11.729 0.390 1.00 0.00 C ATOM 725 O GLU A 49 -3.137 12.213 0.480 1.00 0.00 O ATOM 726 CB GLU A 49 -5.894 11.993 -1.557 1.00 0.00 C ATOM 727 CG GLU A 49 -5.439 13.361 -2.086 1.00 0.00 C ATOM 728 CD GLU A 49 -5.843 13.546 -3.545 1.00 0.00 C ATOM 729 OE1 GLU A 49 -5.284 12.796 -4.377 1.00 0.00 O ATOM 730 OE2 GLU A 49 -6.722 14.397 -3.795 1.00 0.00 O ATOM 0 H GLU A 49 -5.951 9.579 -1.430 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.868 11.294 -1.613 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.348 11.424 -2.369 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.664 12.136 -0.799 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.879 14.153 -1.480 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -4.357 13.450 -1.991 1.00 0.00 H new ATOM 876 N PRO A 62 -9.204 9.354 -2.988 1.00 0.00 N ATOM 877 CA PRO A 62 -8.952 8.209 -3.846 1.00 0.00 C ATOM 878 C PRO A 62 -7.442 7.913 -3.862 1.00 0.00 C ATOM 879 O PRO A 62 -6.684 8.461 -3.057 1.00 0.00 O ATOM 880 CB PRO A 62 -9.529 8.612 -5.207 1.00 0.00 C ATOM 881 CG PRO A 62 -9.360 10.131 -5.250 1.00 0.00 C ATOM 882 CD PRO A 62 -9.390 10.563 -3.782 1.00 0.00 C ATOM 0 HA PRO A 62 -9.418 7.281 -3.513 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -8.995 8.128 -6.025 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.577 8.325 -5.296 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -8.421 10.412 -5.727 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -10.161 10.603 -5.819 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -8.602 11.287 -3.575 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -10.337 11.044 -3.539 1.00 0.00 H new ATOM 890 N HIS A 63 -7.000 7.028 -4.767 1.00 0.00 N ATOM 891 CA HIS A 63 -5.578 6.782 -4.994 1.00 0.00 C ATOM 892 C HIS A 63 -4.855 8.101 -5.257 1.00 0.00 C ATOM 893 O HIS A 63 -5.204 8.802 -6.203 1.00 0.00 O ATOM 894 CB HIS A 63 -5.367 5.898 -6.229 1.00 0.00 C ATOM 895 CG HIS A 63 -5.449 4.412 -6.000 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.700 3.414 -6.643 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.345 3.783 -5.190 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.192 2.217 -6.248 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.172 2.447 -5.364 1.00 0.00 N ATOM 0 H HIS A 63 -7.617 6.469 -5.356 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.186 6.289 -4.104 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -6.110 6.172 -6.978 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.389 6.127 -6.652 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -7.059 4.257 -4.533 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.855 1.248 -6.585 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.711 1.723 -4.890 1.00 0.00 H new ATOM 907 N PHE A 64 -3.823 8.398 -4.466 1.00 0.00 N ATOM 908 CA PHE A 64 -3.040 9.609 -4.648 1.00 0.00 C ATOM 909 C PHE A 64 -2.339 9.577 -6.010 1.00 0.00 C ATOM 910 O PHE A 64 -1.584 8.637 -6.281 1.00 0.00 O ATOM 911 CB PHE A 64 -2.026 9.692 -3.502 1.00 0.00 C ATOM 912 CG PHE A 64 -1.276 11.003 -3.367 1.00 0.00 C ATOM 913 CD1 PHE A 64 -1.966 12.230 -3.431 1.00 0.00 C ATOM 914 CD2 PHE A 64 0.091 10.995 -3.030 1.00 0.00 C ATOM 915 CE1 PHE A 64 -1.292 13.437 -3.187 1.00 0.00 C ATOM 916 CE2 PHE A 64 0.764 12.203 -2.779 1.00 0.00 C ATOM 917 CZ PHE A 64 0.074 13.425 -2.856 1.00 0.00 C ATOM 0 H PHE A 64 -3.513 7.810 -3.692 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.680 10.491 -4.630 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -2.550 9.499 -2.566 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.297 8.892 -3.630 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.019 12.242 -3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.624 10.058 -2.964 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.823 14.375 -3.254 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.814 12.192 -2.526 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.592 14.352 -2.661 1.00 0.00 H new ATOM 927 N ASN A 65 -2.596 10.566 -6.878 1.00 0.00 N ATOM 928 CA ASN A 65 -2.074 10.591 -8.245 1.00 0.00 C ATOM 929 C ASN A 65 -1.502 11.943 -8.691 1.00 0.00 C ATOM 930 O ASN A 65 -1.778 12.367 -9.808 1.00 0.00 O ATOM 931 CB ASN A 65 -3.155 10.086 -9.221 1.00 0.00 C ATOM 932 CG ASN A 65 -4.222 11.112 -9.591 1.00 0.00 C ATOM 933 OD1 ASN A 65 -4.620 11.931 -8.771 1.00 0.00 O ATOM 934 ND2 ASN A 65 -4.695 11.065 -10.836 1.00 0.00 N ATOM 0 H ASN A 65 -3.175 11.373 -6.647 1.00 0.00 H new ATOM 0 HA ASN A 65 -1.216 9.919 -8.258 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -2.667 9.746 -10.135 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.645 9.218 -8.779 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.413 11.725 -11.134 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.339 10.369 -11.491 1.00 0.00 H new ATOM 941 N PRO A 66 -0.625 12.593 -7.913 1.00 0.00 N ATOM 942 CA PRO A 66 -0.103 13.909 -8.259 1.00 0.00 C ATOM 943 C PRO A 66 0.717 13.919 -9.562 1.00 0.00 C ATOM 944 O PRO A 66 0.864 14.978 -10.164 1.00 0.00 O ATOM 945 CB PRO A 66 0.701 14.364 -7.036 1.00 0.00 C ATOM 946 CG PRO A 66 1.141 13.051 -6.400 1.00 0.00 C ATOM 947 CD PRO A 66 -0.058 12.137 -6.656 1.00 0.00 C ATOM 0 HA PRO A 66 -0.913 14.604 -8.478 1.00 0.00 H new ATOM 0 HB2 PRO A 66 1.554 14.979 -7.321 1.00 0.00 H new ATOM 0 HB3 PRO A 66 0.094 14.958 -6.353 1.00 0.00 H new ATOM 0 HG2 PRO A 66 2.051 12.664 -6.858 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.344 13.165 -5.335 1.00 0.00 H new ATOM 0 HD2 PRO A 66 0.249 11.093 -6.719 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.786 12.207 -5.848 1.00 0.00 H new ATOM 955 N LEU A 67 1.234 12.768 -10.024 1.00 0.00 N ATOM 956 CA LEU A 67 1.891 12.673 -11.330 1.00 0.00 C ATOM 957 C LEU A 67 0.883 12.535 -12.477 1.00 0.00 C ATOM 958 O LEU A 67 1.250 12.766 -13.626 1.00 0.00 O ATOM 959 CB LEU A 67 2.906 11.515 -11.370 1.00 0.00 C ATOM 960 CG LEU A 67 4.325 11.917 -10.928 1.00 0.00 C ATOM 961 CD1 LEU A 67 5.217 10.669 -10.873 1.00 0.00 C ATOM 962 CD2 LEU A 67 4.985 12.894 -11.915 1.00 0.00 C ATOM 0 H LEU A 67 1.207 11.889 -9.507 1.00 0.00 H new ATOM 0 HA LEU A 67 2.430 13.610 -11.472 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.550 10.710 -10.728 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.950 11.118 -12.384 1.00 0.00 H new ATOM 0 HG LEU A 67 4.228 12.396 -9.954 1.00 0.00 H new ATOM 0 HD11 LEU A 67 6.222 10.953 -10.560 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.803 9.957 -10.159 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.261 10.209 -11.860 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.984 13.149 -11.561 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.056 12.427 -12.897 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.383 13.800 -11.987 1.00 0.00 H new ATOM 974 N SER A 68 -0.366 12.151 -12.191 1.00 0.00 N ATOM 975 CA SER A 68 -1.447 12.136 -13.171 1.00 0.00 C ATOM 976 C SER A 68 -1.231 11.074 -14.249 1.00 0.00 C ATOM 977 O SER A 68 -0.940 11.373 -15.405 1.00 0.00 O ATOM 978 CB SER A 68 -1.680 13.525 -13.780 1.00 0.00 C ATOM 979 OG SER A 68 -1.914 14.462 -12.748 1.00 0.00 O ATOM 0 H SER A 68 -0.653 11.840 -11.263 1.00 0.00 H new ATOM 0 HA SER A 68 -2.356 11.861 -12.635 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.813 13.825 -14.368 1.00 0.00 H new ATOM 0 HB3 SER A 68 -2.532 13.497 -14.460 1.00 0.00 H new ATOM 0 HG SER A 68 -2.061 15.349 -13.138 1.00 0.00 H new ATOM 985 N ARG A 69 -1.453 9.822 -13.863 1.00 0.00 N ATOM 986 CA ARG A 69 -1.527 8.657 -14.727 1.00 0.00 C ATOM 987 C ARG A 69 -2.588 7.772 -14.088 1.00 0.00 C ATOM 988 O ARG A 69 -2.805 7.902 -12.886 1.00 0.00 O ATOM 989 CB ARG A 69 -0.165 7.952 -14.763 1.00 0.00 C ATOM 990 CG ARG A 69 0.752 8.525 -15.853 1.00 0.00 C ATOM 991 CD ARG A 69 1.496 7.407 -16.603 1.00 0.00 C ATOM 992 NE ARG A 69 1.852 7.820 -17.968 1.00 0.00 N ATOM 993 CZ ARG A 69 1.004 7.860 -19.012 1.00 0.00 C ATOM 994 NH1 ARG A 69 -0.272 7.466 -18.882 1.00 0.00 N ATOM 995 NH2 ARG A 69 1.441 8.311 -20.193 1.00 0.00 N ATOM 0 H ARG A 69 -1.594 9.583 -12.881 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.779 8.905 -15.758 1.00 0.00 H new ATOM 0 HB2 ARG A 69 0.320 8.052 -13.792 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.313 6.886 -14.938 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.161 9.108 -16.559 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.474 9.206 -15.403 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.399 7.139 -16.055 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.871 6.515 -16.643 1.00 0.00 H new ATOM 0 HE ARG A 69 2.819 8.098 -18.137 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.613 7.130 -17.981 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.901 7.503 -19.684 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.408 8.620 -20.295 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.807 8.346 -20.992 1.00 0.00 H new ATOM 1009 N LYS A 70 -3.291 6.930 -14.850 1.00 0.00 N ATOM 1010 CA LYS A 70 -4.284 6.050 -14.275 1.00 0.00 C ATOM 1011 C LYS A 70 -3.607 4.998 -13.391 1.00 0.00 C ATOM 1012 O LYS A 70 -2.383 4.863 -13.394 1.00 0.00 O ATOM 1013 CB LYS A 70 -5.057 5.413 -15.426 1.00 0.00 C ATOM 1014 CG LYS A 70 -6.030 6.405 -16.076 1.00 0.00 C ATOM 1015 CD LYS A 70 -6.555 5.835 -17.398 1.00 0.00 C ATOM 1016 CE LYS A 70 -7.626 6.762 -17.988 1.00 0.00 C ATOM 1017 NZ LYS A 70 -8.064 6.317 -19.327 1.00 0.00 N ATOM 0 H LYS A 70 -3.184 6.847 -15.861 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.975 6.601 -13.636 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.356 5.047 -16.176 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.610 4.549 -15.058 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.862 6.606 -15.401 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.528 7.356 -16.254 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.733 5.721 -18.105 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.974 4.842 -17.233 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.485 6.796 -17.318 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.232 7.776 -18.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.788 6.970 -19.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.249 6.308 -19.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.464 5.359 -19.261 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.415 4.266 -12.620 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.915 3.208 -11.763 1.00 0.00 C ATOM 1033 C HIS A 71 -3.144 2.192 -12.588 1.00 0.00 C ATOM 1034 O HIS A 71 -3.495 1.920 -13.733 1.00 0.00 O ATOM 1035 CB HIS A 71 -5.044 2.467 -11.036 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.507 1.564 -9.953 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.617 1.904 -8.932 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.710 0.222 -9.849 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.190 0.768 -8.358 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -3.937 -0.231 -8.822 1.00 0.00 N ATOM 0 H HIS A 71 -5.426 4.395 -12.578 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.271 3.682 -11.022 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.733 3.190 -10.599 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.614 1.877 -11.754 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -3.340 2.850 -8.669 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.364 -0.375 -10.467 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.383 0.680 -7.646 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -3.932 -1.186 -8.465 1.00 0.00 H new ATOM 1048 N GLY A 72 -2.139 1.595 -11.965 1.00 0.00 N ATOM 1049 CA GLY A 72 -1.385 0.517 -12.541 1.00 0.00 C ATOM 1050 C GLY A 72 -0.213 0.221 -11.627 1.00 0.00 C ATOM 1051 O GLY A 72 -0.144 0.755 -10.520 1.00 0.00 O ATOM 0 H GLY A 72 -1.828 1.858 -11.030 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.012 -0.368 -12.655 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -1.033 0.788 -13.536 1.00 0.00 H new ATOM 1055 N GLY A 73 0.656 -0.678 -12.058 1.00 0.00 N ATOM 1056 CA GLY A 73 1.653 -1.309 -11.217 1.00 0.00 C ATOM 1057 C GLY A 73 2.970 -0.546 -11.199 1.00 0.00 C ATOM 1058 O GLY A 73 3.272 0.231 -12.105 1.00 0.00 O ATOM 0 H GLY A 73 0.686 -0.995 -13.027 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.269 -1.387 -10.200 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.831 -2.325 -11.570 1.00 0.00 H new ATOM 1062 N PRO A 74 3.810 -0.806 -10.188 1.00 0.00 N ATOM 1063 CA PRO A 74 5.119 -0.185 -10.079 1.00 0.00 C ATOM 1064 C PRO A 74 5.933 -0.432 -11.357 1.00 0.00 C ATOM 1065 O PRO A 74 6.612 0.466 -11.860 1.00 0.00 O ATOM 1066 CB PRO A 74 5.750 -0.779 -8.814 1.00 0.00 C ATOM 1067 CG PRO A 74 4.999 -2.093 -8.584 1.00 0.00 C ATOM 1068 CD PRO A 74 3.612 -1.814 -9.159 1.00 0.00 C ATOM 0 HA PRO A 74 5.074 0.900 -9.987 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.818 -0.952 -8.948 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.640 -0.106 -7.963 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.484 -2.927 -9.091 1.00 0.00 H new ATOM 0 HG3 PRO A 74 4.951 -2.348 -7.525 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.172 -2.719 -9.577 1.00 0.00 H new ATOM 0 HD3 PRO A 74 2.932 -1.456 -8.386 1.00 0.00 H new ATOM 1076 N LYS A 75 5.815 -1.635 -11.924 1.00 0.00 N ATOM 1077 CA LYS A 75 6.503 -2.021 -13.149 1.00 0.00 C ATOM 1078 C LYS A 75 5.677 -1.802 -14.429 1.00 0.00 C ATOM 1079 O LYS A 75 6.112 -2.262 -15.483 1.00 0.00 O ATOM 1080 CB LYS A 75 6.976 -3.476 -13.005 1.00 0.00 C ATOM 1081 CG LYS A 75 8.159 -3.588 -12.026 1.00 0.00 C ATOM 1082 CD LYS A 75 9.317 -4.395 -12.640 1.00 0.00 C ATOM 1083 CE LYS A 75 10.030 -3.673 -13.799 1.00 0.00 C ATOM 1084 NZ LYS A 75 10.936 -2.603 -13.334 1.00 0.00 N ATOM 0 H LYS A 75 5.230 -2.375 -11.537 1.00 0.00 H new ATOM 0 HA LYS A 75 7.361 -1.361 -13.275 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.151 -4.095 -12.653 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.271 -3.862 -13.981 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.509 -2.591 -11.759 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.827 -4.067 -11.105 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.045 -4.619 -11.861 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.932 -5.349 -13.000 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.600 -4.400 -14.378 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.284 -3.246 -14.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.389 -2.151 -14.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 10.391 -1.893 -12.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.666 -3.011 -12.716 1.00 0.00 H new ATOM 1098 N ASP A 76 4.556 -1.075 -14.374 1.00 0.00 N ATOM 1099 CA ASP A 76 3.713 -0.822 -15.539 1.00 0.00 C ATOM 1100 C ASP A 76 3.958 0.593 -16.048 1.00 0.00 C ATOM 1101 O ASP A 76 4.473 1.447 -15.326 1.00 0.00 O ATOM 1102 CB ASP A 76 2.235 -0.950 -15.163 1.00 0.00 C ATOM 1103 CG ASP A 76 1.779 -2.314 -14.682 1.00 0.00 C ATOM 1104 OD1 ASP A 76 2.559 -3.286 -14.766 1.00 0.00 O ATOM 1105 OD2 ASP A 76 0.628 -2.334 -14.198 1.00 0.00 O ATOM 0 H ASP A 76 4.210 -0.646 -13.516 1.00 0.00 H new ATOM 0 HA ASP A 76 3.960 -1.552 -16.310 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.016 -0.221 -14.382 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.636 -0.676 -16.032 1.00 0.00 H new ATOM 1110 N GLU A 77 3.540 0.866 -17.284 1.00 0.00 N ATOM 1111 CA GLU A 77 3.593 2.202 -17.863 1.00 0.00 C ATOM 1112 C GLU A 77 2.641 3.137 -17.112 1.00 0.00 C ATOM 1113 O GLU A 77 2.965 4.307 -16.899 1.00 0.00 O ATOM 1114 CB GLU A 77 3.252 2.166 -19.360 1.00 0.00 C ATOM 1115 CG GLU A 77 4.367 1.514 -20.190 1.00 0.00 C ATOM 1116 CD GLU A 77 4.562 0.042 -19.846 1.00 0.00 C ATOM 1117 OE1 GLU A 77 3.520 -0.640 -19.706 1.00 0.00 O ATOM 1118 OE2 GLU A 77 5.733 -0.350 -19.657 1.00 0.00 O ATOM 0 H GLU A 77 3.154 0.161 -17.912 1.00 0.00 H new ATOM 0 HA GLU A 77 4.609 2.583 -17.763 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.322 1.616 -19.507 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.081 3.182 -19.717 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.130 1.608 -21.250 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.301 2.050 -20.023 1.00 0.00 H new ATOM 1125 N GLU A 78 1.469 2.618 -16.720 1.00 0.00 N ATOM 1126 CA GLU A 78 0.499 3.352 -15.915 1.00 0.00 C ATOM 1127 C GLU A 78 0.611 2.936 -14.452 1.00 0.00 C ATOM 1128 O GLU A 78 0.955 1.807 -14.132 1.00 0.00 O ATOM 1129 CB GLU A 78 -0.927 3.254 -16.489 1.00 0.00 C ATOM 1130 CG GLU A 78 -1.101 4.359 -17.544 1.00 0.00 C ATOM 1131 CD GLU A 78 -2.530 4.592 -18.017 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -3.271 3.603 -18.186 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -2.846 5.797 -18.179 1.00 0.00 O ATOM 0 H GLU A 78 1.171 1.672 -16.957 1.00 0.00 H new ATOM 0 HA GLU A 78 0.736 4.415 -15.959 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -1.089 2.273 -16.936 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.665 3.368 -15.695 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -0.715 5.293 -17.135 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.486 4.112 -18.409 1.00 0.00 H new ATOM 1140 N ARG A 79 0.383 3.904 -13.569 1.00 0.00 N ATOM 1141 CA ARG A 79 0.524 3.875 -12.123 1.00 0.00 C ATOM 1142 C ARG A 79 0.304 5.337 -11.719 1.00 0.00 C ATOM 1143 O ARG A 79 0.834 6.214 -12.395 1.00 0.00 O ATOM 1144 CB ARG A 79 1.893 3.365 -11.651 1.00 0.00 C ATOM 1145 CG ARG A 79 3.097 3.781 -12.505 1.00 0.00 C ATOM 1146 CD ARG A 79 4.394 3.509 -11.725 1.00 0.00 C ATOM 1147 NE ARG A 79 5.405 2.802 -12.523 1.00 0.00 N ATOM 1148 CZ ARG A 79 5.993 3.229 -13.646 1.00 0.00 C ATOM 1149 NH1 ARG A 79 5.679 4.429 -14.147 1.00 0.00 N ATOM 1150 NH2 ARG A 79 6.897 2.447 -14.242 1.00 0.00 N ATOM 0 H ARG A 79 0.063 4.819 -13.885 1.00 0.00 H new ATOM 0 HA ARG A 79 -0.180 3.181 -11.664 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.057 3.715 -10.632 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.859 2.276 -11.612 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.101 3.226 -13.443 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.028 4.838 -12.760 1.00 0.00 H new ATOM 0 HD2 ARG A 79 4.809 4.456 -11.379 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.162 2.920 -10.838 1.00 0.00 H new ATOM 0 HE ARG A 79 5.690 1.884 -12.183 1.00 0.00 H new ATOM 0 HH11 ARG A 79 4.993 5.016 -13.673 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.126 4.757 -15.003 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.130 1.539 -13.840 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.354 2.758 -15.099 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.489 5.614 -10.684 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.731 6.958 -10.169 1.00 0.00 C ATOM 1166 C HIS A 80 0.573 7.563 -9.597 1.00 0.00 C ATOM 1167 O HIS A 80 1.367 8.145 -10.334 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.869 6.906 -9.128 1.00 0.00 C ATOM 1169 CG HIS A 80 -3.218 6.394 -9.586 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.898 5.288 -9.068 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -4.109 7.031 -10.403 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -5.168 5.349 -9.499 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -5.267 6.313 -10.411 1.00 0.00 N ATOM 0 H HIS A 80 -0.992 4.891 -10.169 1.00 0.00 H new ATOM 0 HA HIS A 80 -1.048 7.617 -10.977 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.537 6.281 -8.299 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.009 7.912 -8.733 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -3.927 7.945 -10.948 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.977 4.719 -9.161 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -6.072 6.485 -11.013 1.00 0.00 H new ATOM 1181 N VAL A 81 0.798 7.445 -8.283 1.00 0.00 N ATOM 1182 CA VAL A 81 2.107 7.517 -7.637 1.00 0.00 C ATOM 1183 C VAL A 81 2.251 6.326 -6.694 1.00 0.00 C ATOM 1184 O VAL A 81 3.012 5.401 -6.967 1.00 0.00 O ATOM 1185 CB VAL A 81 2.293 8.855 -6.894 1.00 0.00 C ATOM 1186 CG1 VAL A 81 3.461 8.851 -5.893 1.00 0.00 C ATOM 1187 CG2 VAL A 81 2.574 9.942 -7.930 1.00 0.00 C ATOM 0 H VAL A 81 0.041 7.291 -7.617 1.00 0.00 H new ATOM 0 HA VAL A 81 2.890 7.473 -8.394 1.00 0.00 H new ATOM 0 HB VAL A 81 1.379 9.032 -6.328 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.529 9.826 -5.410 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.291 8.083 -5.139 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.392 8.642 -6.421 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.709 10.899 -7.426 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.479 9.692 -8.483 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.734 10.012 -8.621 1.00 0.00 H new ATOM 1197 N GLY A 82 1.535 6.344 -5.564 1.00 0.00 N ATOM 1198 CA GLY A 82 1.767 5.380 -4.495 1.00 0.00 C ATOM 1199 C GLY A 82 1.000 4.086 -4.736 1.00 0.00 C ATOM 1200 O GLY A 82 0.274 3.625 -3.857 1.00 0.00 O ATOM 0 H GLY A 82 0.793 7.016 -5.371 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.833 5.165 -4.423 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.464 5.812 -3.541 1.00 0.00 H new ATOM 1204 N ASP A 83 1.149 3.525 -5.935 1.00 0.00 N ATOM 1205 CA ASP A 83 0.528 2.301 -6.394 1.00 0.00 C ATOM 1206 C ASP A 83 1.490 1.160 -6.097 1.00 0.00 C ATOM 1207 O ASP A 83 2.162 0.659 -6.997 1.00 0.00 O ATOM 1208 CB ASP A 83 0.274 2.390 -7.906 1.00 0.00 C ATOM 1209 CG ASP A 83 -0.410 3.674 -8.325 1.00 0.00 C ATOM 1210 OD1 ASP A 83 0.183 4.743 -8.094 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.507 3.592 -8.911 1.00 0.00 O ATOM 0 H ASP A 83 1.744 3.945 -6.649 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.425 2.137 -5.892 1.00 0.00 H new ATOM 0 HB2 ASP A 83 1.225 2.305 -8.432 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -0.339 1.543 -8.215 1.00 0.00 H new ATOM 1216 N LEU A 84 1.578 0.740 -4.837 1.00 0.00 N ATOM 1217 CA LEU A 84 2.578 -0.239 -4.431 1.00 0.00 C ATOM 1218 C LEU A 84 2.043 -1.645 -4.714 1.00 0.00 C ATOM 1219 O LEU A 84 2.018 -2.498 -3.829 1.00 0.00 O ATOM 1220 CB LEU A 84 2.964 -0.005 -2.965 1.00 0.00 C ATOM 1221 CG LEU A 84 3.335 1.461 -2.669 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.840 1.567 -1.228 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.405 2.014 -3.620 1.00 0.00 C ATOM 0 H LEU A 84 0.970 1.062 -4.084 1.00 0.00 H new ATOM 0 HA LEU A 84 3.496 -0.129 -5.008 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.133 -0.301 -2.324 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.807 -0.647 -2.710 1.00 0.00 H new ATOM 0 HG LEU A 84 2.435 2.058 -2.817 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.105 2.602 -1.010 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.057 1.241 -0.543 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.718 0.934 -1.103 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.623 3.050 -3.360 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.314 1.419 -3.531 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.040 1.967 -4.646 1.00 0.00 H new ATOM 1235 N GLY A 85 1.610 -1.851 -5.967 1.00 0.00 N ATOM 1236 CA GLY A 85 0.801 -2.962 -6.438 1.00 0.00 C ATOM 1237 C GLY A 85 -0.065 -3.555 -5.331 1.00 0.00 C ATOM 1238 O GLY A 85 -0.831 -2.845 -4.677 1.00 0.00 O ATOM 0 H GLY A 85 1.835 -1.199 -6.718 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.163 -2.624 -7.254 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.452 -3.737 -6.842 1.00 0.00 H new ATOM 1242 N ASN A 86 0.125 -4.852 -5.096 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.532 -5.616 -4.054 1.00 0.00 C ATOM 1244 C ASN A 86 0.522 -6.318 -3.210 1.00 0.00 C ATOM 1245 O ASN A 86 1.667 -6.463 -3.631 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.483 -6.653 -4.675 1.00 0.00 C ATOM 1247 CG ASN A 86 -0.743 -7.601 -5.610 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -0.739 -7.423 -6.823 1.00 0.00 O ATOM 1249 ND2 ASN A 86 -0.098 -8.624 -5.063 1.00 0.00 N ATOM 0 H ASN A 86 0.768 -5.416 -5.652 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.115 -4.943 -3.426 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -1.966 -7.225 -3.883 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.272 -6.141 -5.225 1.00 0.00 H new ATOM 0 HD21 ASN A 86 0.413 -9.279 -5.654 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -0.114 -8.755 -4.052 1.00 0.00 H new ATOM 1256 N VAL A 87 0.101 -6.799 -2.040 1.00 0.00 N ATOM 1257 CA VAL A 87 0.868 -7.703 -1.199 1.00 0.00 C ATOM 1258 C VAL A 87 0.286 -9.104 -1.383 1.00 0.00 C ATOM 1259 O VAL A 87 -0.440 -9.344 -2.348 1.00 0.00 O ATOM 1260 CB VAL A 87 0.859 -7.203 0.255 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.395 -5.767 0.325 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.538 -7.257 0.880 1.00 0.00 C ATOM 0 H VAL A 87 -0.809 -6.561 -1.645 1.00 0.00 H new ATOM 0 HA VAL A 87 1.920 -7.738 -1.483 1.00 0.00 H new ATOM 0 HB VAL A 87 1.505 -7.870 0.825 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.384 -5.424 1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.416 -5.741 -0.055 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.766 -5.114 -0.280 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.492 -6.894 1.907 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.219 -6.630 0.304 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.899 -8.285 0.875 1.00 0.00 H new ATOM 1272 N THR A 88 0.576 -10.043 -0.482 1.00 0.00 N ATOM 1273 CA THR A 88 0.009 -11.386 -0.489 1.00 0.00 C ATOM 1274 C THR A 88 -0.075 -11.848 0.957 1.00 0.00 C ATOM 1275 O THR A 88 0.959 -11.977 1.605 1.00 0.00 O ATOM 1276 CB THR A 88 0.876 -12.308 -1.357 1.00 0.00 C ATOM 1277 OG1 THR A 88 0.824 -11.867 -2.699 1.00 0.00 O ATOM 1278 CG2 THR A 88 0.396 -13.762 -1.308 1.00 0.00 C ATOM 0 H THR A 88 1.226 -9.885 0.288 1.00 0.00 H new ATOM 0 HA THR A 88 -0.991 -11.404 -0.923 1.00 0.00 H new ATOM 0 HB THR A 88 1.893 -12.268 -0.966 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.378 -12.452 -3.257 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.038 -14.379 -1.937 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.437 -14.124 -0.281 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.630 -13.819 -1.672 1.00 0.00 H new ATOM 1286 N ALA A 89 -1.292 -12.050 1.466 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.489 -12.567 2.806 1.00 0.00 C ATOM 1288 C ALA A 89 -1.402 -14.088 2.786 1.00 0.00 C ATOM 1289 O ALA A 89 -1.880 -14.723 1.840 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.825 -12.106 3.382 1.00 0.00 C ATOM 0 H ALA A 89 -2.157 -11.859 0.960 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.703 -12.176 3.451 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.946 -12.509 4.388 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.848 -11.017 3.422 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.637 -12.463 2.748 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.800 -14.643 3.836 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.743 -16.067 4.106 1.00 0.00 C ATOM 1298 C ASP A 90 -2.084 -16.595 4.607 1.00 0.00 C ATOM 1299 O ASP A 90 -3.055 -15.860 4.787 1.00 0.00 O ATOM 1300 CB ASP A 90 0.426 -16.373 5.059 1.00 0.00 C ATOM 1301 CG ASP A 90 0.192 -15.926 6.495 1.00 0.00 C ATOM 1302 OD1 ASP A 90 -0.923 -15.433 6.774 1.00 0.00 O ATOM 1303 OD2 ASP A 90 1.118 -16.138 7.301 1.00 0.00 O ATOM 0 H ASP A 90 -0.322 -14.087 4.545 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.549 -16.601 3.176 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.616 -17.446 5.051 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.325 -15.887 4.681 1.00 0.00 H new ATOM 1308 N LYS A 91 -2.097 -17.899 4.874 1.00 0.00 N ATOM 1309 CA LYS A 91 -3.215 -18.631 5.424 1.00 0.00 C ATOM 1310 C LYS A 91 -3.568 -18.180 6.843 1.00 0.00 C ATOM 1311 O LYS A 91 -4.602 -18.583 7.370 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.845 -20.118 5.407 1.00 0.00 C ATOM 1313 CG LYS A 91 -1.594 -20.427 6.255 1.00 0.00 C ATOM 1314 CD LYS A 91 -1.738 -21.777 6.966 1.00 0.00 C ATOM 1315 CE LYS A 91 -0.629 -21.972 8.009 1.00 0.00 C ATOM 1316 NZ LYS A 91 -0.923 -21.292 9.291 1.00 0.00 N ATOM 0 H LYS A 91 -1.286 -18.494 4.702 1.00 0.00 H new ATOM 0 HA LYS A 91 -4.101 -18.440 4.819 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -3.686 -20.702 5.780 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.669 -20.433 4.378 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.711 -20.440 5.617 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.444 -19.637 6.991 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.712 -21.834 7.451 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.699 -22.583 6.234 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.491 -23.038 8.191 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.311 -21.593 7.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -0.106 -21.385 9.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -1.112 -20.285 9.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -1.758 -21.729 9.732 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.686 -17.409 7.487 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.921 -16.875 8.818 1.00 0.00 C ATOM 1332 C ASP A 92 -3.545 -15.484 8.701 1.00 0.00 C ATOM 1333 O ASP A 92 -4.030 -14.939 9.691 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.596 -16.839 9.592 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.550 -17.884 10.690 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -1.422 -19.072 10.316 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.636 -17.499 11.874 1.00 0.00 O ATOM 0 H ASP A 92 -1.785 -17.140 7.091 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.615 -17.511 9.367 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.768 -17.002 8.902 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.457 -15.849 10.027 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.535 -14.903 7.497 1.00 0.00 N ATOM 1343 CA GLY A 93 -4.049 -13.569 7.266 1.00 0.00 C ATOM 1344 C GLY A 93 -2.985 -12.509 7.532 1.00 0.00 C ATOM 1345 O GLY A 93 -3.327 -11.365 7.859 1.00 0.00 O ATOM 0 H GLY A 93 -3.167 -15.354 6.660 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.399 -13.485 6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.910 -13.392 7.911 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.707 -12.883 7.387 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.560 -12.005 7.530 1.00 0.00 C ATOM 1351 C VAL A 94 0.046 -11.783 6.150 1.00 0.00 C ATOM 1352 O VAL A 94 0.449 -12.736 5.491 1.00 0.00 O ATOM 1353 CB VAL A 94 0.470 -12.598 8.505 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.718 -11.698 8.621 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.158 -12.796 9.889 1.00 0.00 C ATOM 0 H VAL A 94 -1.444 -13.842 7.159 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.874 -11.049 7.949 1.00 0.00 H new ATOM 0 HB VAL A 94 0.782 -13.565 8.109 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.426 -12.146 9.318 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.186 -11.598 7.642 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.424 -10.714 8.985 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.584 -13.217 10.568 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.500 -11.835 10.274 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -1.005 -13.477 9.810 1.00 0.00 H new ATOM 1365 N ALA A 95 0.103 -10.523 5.709 1.00 0.00 N ATOM 1366 CA ALA A 95 0.799 -10.103 4.508 1.00 0.00 C ATOM 1367 C ALA A 95 2.005 -9.305 4.977 1.00 0.00 C ATOM 1368 O ALA A 95 1.837 -8.225 5.549 1.00 0.00 O ATOM 1369 CB ALA A 95 -0.114 -9.265 3.608 1.00 0.00 C ATOM 0 H ALA A 95 -0.350 -9.751 6.198 1.00 0.00 H new ATOM 0 HA ALA A 95 1.108 -10.959 3.908 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.433 -8.963 2.715 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.983 -9.857 3.319 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.443 -8.378 4.149 1.00 0.00 H new ATOM 1375 N ASP A 96 3.191 -9.877 4.777 1.00 0.00 N ATOM 1376 CA ASP A 96 4.468 -9.255 5.065 1.00 0.00 C ATOM 1377 C ASP A 96 4.874 -8.453 3.824 1.00 0.00 C ATOM 1378 O ASP A 96 4.831 -8.985 2.715 1.00 0.00 O ATOM 1379 CB ASP A 96 5.472 -10.355 5.433 1.00 0.00 C ATOM 1380 CG ASP A 96 6.774 -9.806 5.999 1.00 0.00 C ATOM 1381 OD1 ASP A 96 7.107 -8.653 5.660 1.00 0.00 O ATOM 1382 OD2 ASP A 96 7.417 -10.562 6.756 1.00 0.00 O ATOM 0 H ASP A 96 3.285 -10.819 4.397 1.00 0.00 H new ATOM 0 HA ASP A 96 4.426 -8.569 5.911 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.018 -11.024 6.164 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.690 -10.951 4.547 1.00 0.00 H new ATOM 1387 N VAL A 97 5.177 -7.165 3.990 1.00 0.00 N ATOM 1388 CA VAL A 97 5.576 -6.265 2.913 1.00 0.00 C ATOM 1389 C VAL A 97 7.062 -5.998 3.087 1.00 0.00 C ATOM 1390 O VAL A 97 7.512 -5.868 4.219 1.00 0.00 O ATOM 1391 CB VAL A 97 4.800 -4.935 2.958 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.901 -4.213 1.608 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.338 -5.147 3.351 1.00 0.00 C ATOM 0 H VAL A 97 5.150 -6.709 4.902 1.00 0.00 H new ATOM 0 HA VAL A 97 5.357 -6.726 1.950 1.00 0.00 H new ATOM 0 HB VAL A 97 5.255 -4.309 3.726 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.348 -3.275 1.655 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.947 -4.006 1.383 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.480 -4.844 0.825 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.824 -4.186 3.372 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.857 -5.800 2.623 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.290 -5.606 4.339 1.00 0.00 H new ATOM 1403 N SER A 98 7.797 -5.890 1.979 1.00 0.00 N ATOM 1404 CA SER A 98 9.241 -5.697 1.944 1.00 0.00 C ATOM 1405 C SER A 98 9.635 -5.227 0.539 1.00 0.00 C ATOM 1406 O SER A 98 10.053 -6.040 -0.282 1.00 0.00 O ATOM 1407 CB SER A 98 9.930 -7.020 2.332 1.00 0.00 C ATOM 1408 OG SER A 98 11.338 -6.874 2.418 1.00 0.00 O ATOM 0 H SER A 98 7.384 -5.937 1.048 1.00 0.00 H new ATOM 0 HA SER A 98 9.560 -4.936 2.656 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.541 -7.365 3.290 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.688 -7.786 1.595 1.00 0.00 H new ATOM 0 HG SER A 98 11.741 -7.732 2.667 1.00 0.00 H new ATOM 1414 N ILE A 99 9.484 -3.931 0.253 1.00 0.00 N ATOM 1415 CA ILE A 99 9.806 -3.314 -1.035 1.00 0.00 C ATOM 1416 C ILE A 99 10.494 -1.967 -0.769 1.00 0.00 C ATOM 1417 O ILE A 99 10.633 -1.578 0.388 1.00 0.00 O ATOM 1418 CB ILE A 99 8.521 -3.218 -1.890 1.00 0.00 C ATOM 1419 CG1 ILE A 99 8.811 -2.865 -3.359 1.00 0.00 C ATOM 1420 CG2 ILE A 99 7.501 -2.232 -1.303 1.00 0.00 C ATOM 1421 CD1 ILE A 99 7.685 -3.305 -4.301 1.00 0.00 C ATOM 0 H ILE A 99 9.123 -3.262 0.933 1.00 0.00 H new ATOM 0 HA ILE A 99 10.506 -3.915 -1.616 1.00 0.00 H new ATOM 0 HB ILE A 99 8.083 -4.216 -1.866 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.956 -1.788 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE A 99 9.743 -3.339 -3.666 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.617 -2.201 -1.940 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.216 -2.556 -0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.945 -1.238 -1.250 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.940 -3.032 -5.325 1.00 0.00 H new ATOM 0 HD12 ILE A 99 7.556 -4.385 -4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.757 -2.811 -4.014 1.00 0.00 H new ATOM 1433 N GLU A 100 10.932 -1.247 -1.805 1.00 0.00 N ATOM 1434 CA GLU A 100 11.497 0.086 -1.684 1.00 0.00 C ATOM 1435 C GLU A 100 11.124 0.918 -2.904 1.00 0.00 C ATOM 1436 O GLU A 100 10.842 0.358 -3.964 1.00 0.00 O ATOM 1437 CB GLU A 100 13.016 0.016 -1.516 1.00 0.00 C ATOM 1438 CG GLU A 100 13.783 -0.776 -2.577 1.00 0.00 C ATOM 1439 CD GLU A 100 15.277 -0.493 -2.436 1.00 0.00 C ATOM 1440 OE1 GLU A 100 15.785 -0.697 -1.309 1.00 0.00 O ATOM 1441 OE2 GLU A 100 15.868 -0.028 -3.434 1.00 0.00 O ATOM 0 H GLU A 100 10.900 -1.587 -2.766 1.00 0.00 H new ATOM 0 HA GLU A 100 11.085 0.564 -0.795 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.405 1.034 -1.502 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.232 -0.421 -0.541 1.00 0.00 H new ATOM 0 HG2 GLU A 100 13.591 -1.843 -2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.441 -0.497 -3.574 1.00 0.00 H new ATOM 1448 N ASP A 101 11.153 2.246 -2.745 1.00 0.00 N ATOM 1449 CA ASP A 101 10.993 3.203 -3.830 1.00 0.00 C ATOM 1450 C ASP A 101 11.916 4.394 -3.594 1.00 0.00 C ATOM 1451 O ASP A 101 12.293 4.680 -2.460 1.00 0.00 O ATOM 1452 CB ASP A 101 9.535 3.674 -3.903 1.00 0.00 C ATOM 1453 CG ASP A 101 8.780 3.071 -5.074 1.00 0.00 C ATOM 1454 OD1 ASP A 101 9.158 3.435 -6.208 1.00 0.00 O ATOM 1455 OD2 ASP A 101 7.826 2.308 -4.812 1.00 0.00 O ATOM 0 H ASP A 101 11.292 2.688 -1.836 1.00 0.00 H new ATOM 0 HA ASP A 101 11.254 2.726 -4.775 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.026 3.412 -2.975 1.00 0.00 H new ATOM 0 HB3 ASP A 101 9.513 4.761 -3.983 1.00 0.00 H new ATOM 1460 N SER A 102 12.240 5.109 -4.673 1.00 0.00 N ATOM 1461 CA SER A 102 12.916 6.398 -4.646 1.00 0.00 C ATOM 1462 C SER A 102 11.941 7.559 -4.876 1.00 0.00 C ATOM 1463 O SER A 102 12.368 8.711 -4.911 1.00 0.00 O ATOM 1464 CB SER A 102 14.046 6.407 -5.684 1.00 0.00 C ATOM 1465 OG SER A 102 15.172 5.719 -5.173 1.00 0.00 O ATOM 0 H SER A 102 12.030 4.792 -5.619 1.00 0.00 H new ATOM 0 HA SER A 102 13.343 6.542 -3.654 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.708 5.935 -6.607 1.00 0.00 H new ATOM 0 HB3 SER A 102 14.317 7.433 -5.931 1.00 0.00 H new ATOM 0 HG SER A 102 15.890 5.726 -5.840 1.00 0.00 H new ATOM 1471 N VAL A 103 10.649 7.272 -5.068 1.00 0.00 N ATOM 1472 CA VAL A 103 9.641 8.278 -5.377 1.00 0.00 C ATOM 1473 C VAL A 103 8.929 8.721 -4.097 1.00 0.00 C ATOM 1474 O VAL A 103 8.868 9.913 -3.800 1.00 0.00 O ATOM 1475 CB VAL A 103 8.667 7.730 -6.433 1.00 0.00 C ATOM 1476 CG1 VAL A 103 7.627 8.792 -6.802 1.00 0.00 C ATOM 1477 CG2 VAL A 103 9.425 7.317 -7.701 1.00 0.00 C ATOM 0 H VAL A 103 10.276 6.324 -5.012 1.00 0.00 H new ATOM 0 HA VAL A 103 10.117 9.163 -5.800 1.00 0.00 H new ATOM 0 HB VAL A 103 8.167 6.860 -6.008 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.945 8.389 -7.551 1.00 0.00 H new ATOM 0 HG12 VAL A 103 7.064 9.074 -5.912 1.00 0.00 H new ATOM 0 HG13 VAL A 103 8.131 9.670 -7.206 1.00 0.00 H new ATOM 0 HG21 VAL A 103 8.720 6.932 -8.437 1.00 0.00 H new ATOM 0 HG22 VAL A 103 9.943 8.183 -8.113 1.00 0.00 H new ATOM 0 HG23 VAL A 103 10.152 6.543 -7.455 1.00 0.00 H new ATOM 1487 N ILE A 104 8.359 7.778 -3.342 1.00 0.00 N ATOM 1488 CA ILE A 104 7.800 8.070 -2.041 1.00 0.00 C ATOM 1489 C ILE A 104 8.952 8.321 -1.062 1.00 0.00 C ATOM 1490 O ILE A 104 9.902 7.544 -1.010 1.00 0.00 O ATOM 1491 CB ILE A 104 6.903 6.901 -1.618 1.00 0.00 C ATOM 1492 CG1 ILE A 104 7.544 5.558 -2.002 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.519 7.031 -2.270 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.013 4.432 -1.151 1.00 0.00 C ATOM 0 H ILE A 104 8.278 6.801 -3.622 1.00 0.00 H new ATOM 0 HA ILE A 104 7.180 8.967 -2.058 1.00 0.00 H new ATOM 0 HB ILE A 104 6.788 6.931 -0.535 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.347 5.346 -3.053 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.626 5.624 -1.888 1.00 0.00 H new ATOM 0 HG21 ILE A 104 4.892 6.195 -1.962 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.056 7.967 -1.957 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.626 7.024 -3.355 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.487 3.496 -1.448 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.233 4.633 -0.103 1.00 0.00 H new ATOM 0 HD13 ILE A 104 5.934 4.351 -1.286 1.00 0.00 H new ATOM 1506 N SER A 105 8.862 9.405 -0.289 1.00 0.00 N ATOM 1507 CA SER A 105 9.831 9.797 0.718 1.00 0.00 C ATOM 1508 C SER A 105 9.037 10.345 1.892 1.00 0.00 C ATOM 1509 O SER A 105 7.816 10.441 1.816 1.00 0.00 O ATOM 1510 CB SER A 105 10.812 10.818 0.124 1.00 0.00 C ATOM 1511 OG SER A 105 11.590 10.181 -0.869 1.00 0.00 O ATOM 0 H SER A 105 8.079 10.055 -0.356 1.00 0.00 H new ATOM 0 HA SER A 105 10.441 8.961 1.059 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.267 11.659 -0.306 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.455 11.222 0.906 1.00 0.00 H new ATOM 0 HG SER A 105 12.219 10.826 -1.256 1.00 0.00 H new ATOM 1517 N LEU A 106 9.722 10.714 2.972 1.00 0.00 N ATOM 1518 CA LEU A 106 9.116 11.308 4.152 1.00 0.00 C ATOM 1519 C LEU A 106 9.091 12.832 4.014 1.00 0.00 C ATOM 1520 O LEU A 106 8.726 13.537 4.952 1.00 0.00 O ATOM 1521 CB LEU A 106 9.886 10.883 5.414 1.00 0.00 C ATOM 1522 CG LEU A 106 9.948 9.361 5.652 1.00 0.00 C ATOM 1523 CD1 LEU A 106 11.035 8.663 4.825 1.00 0.00 C ATOM 1524 CD2 LEU A 106 10.272 9.106 7.126 1.00 0.00 C ATOM 0 H LEU A 106 10.733 10.605 3.049 1.00 0.00 H new ATOM 0 HA LEU A 106 8.089 10.954 4.245 1.00 0.00 H new ATOM 0 HB2 LEU A 106 10.904 11.268 5.348 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.422 11.354 6.281 1.00 0.00 H new ATOM 0 HG LEU A 106 8.979 8.959 5.355 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.025 7.594 5.039 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.843 8.822 3.764 1.00 0.00 H new ATOM 0 HD13 LEU A 106 12.010 9.076 5.083 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.319 8.032 7.308 1.00 0.00 H new ATOM 0 HD22 LEU A 106 11.233 9.558 7.371 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.495 9.546 7.751 1.00 0.00 H new ATOM 1566 N HIS A 110 6.212 14.307 -2.075 1.00 0.00 N ATOM 1567 CA HIS A 110 5.455 13.084 -1.888 1.00 0.00 C ATOM 1568 C HIS A 110 5.518 12.553 -0.445 1.00 0.00 C ATOM 1569 O HIS A 110 4.986 11.468 -0.229 1.00 0.00 O ATOM 1570 CB HIS A 110 5.910 12.030 -2.908 1.00 0.00 C ATOM 1571 CG HIS A 110 5.628 12.348 -4.360 1.00 0.00 C ATOM 1572 ND1 HIS A 110 5.767 11.448 -5.389 1.00 0.00 N ATOM 1573 CD2 HIS A 110 5.156 13.516 -4.906 1.00 0.00 C ATOM 1574 CE1 HIS A 110 5.402 12.057 -6.528 1.00 0.00 C ATOM 1575 NE2 HIS A 110 5.014 13.316 -6.284 1.00 0.00 N ATOM 0 HA HIS A 110 4.404 13.314 -2.065 1.00 0.00 H new ATOM 0 HB2 HIS A 110 6.983 11.880 -2.791 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.427 11.084 -2.663 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.934 14.426 -4.368 1.00 0.00 H new ATOM 0 HE1 HIS A 110 5.419 11.597 -7.505 1.00 0.00 H new ATOM 0 HE2 HIS A 110 4.681 13.995 -6.968 1.00 0.00 H new ATOM 1583 N SER A 111 6.052 13.318 0.523 1.00 0.00 N ATOM 1584 CA SER A 111 6.078 13.052 1.963 1.00 0.00 C ATOM 1585 C SER A 111 4.920 12.168 2.411 1.00 0.00 C ATOM 1586 O SER A 111 3.820 12.666 2.627 1.00 0.00 O ATOM 1587 CB SER A 111 6.011 14.367 2.752 1.00 0.00 C ATOM 1588 OG SER A 111 6.139 14.130 4.145 1.00 0.00 O ATOM 0 H SER A 111 6.509 14.202 0.298 1.00 0.00 H new ATOM 0 HA SER A 111 7.014 12.530 2.163 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.804 15.036 2.419 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.065 14.869 2.550 1.00 0.00 H new ATOM 0 HG SER A 111 7.088 14.069 4.381 1.00 0.00 H new ATOM 1594 N ILE A 112 5.139 10.860 2.555 1.00 0.00 N ATOM 1595 CA ILE A 112 4.053 9.964 2.924 1.00 0.00 C ATOM 1596 C ILE A 112 3.535 10.260 4.337 1.00 0.00 C ATOM 1597 O ILE A 112 2.420 9.865 4.674 1.00 0.00 O ATOM 1598 CB ILE A 112 4.410 8.484 2.695 1.00 0.00 C ATOM 1599 CG1 ILE A 112 5.202 7.816 3.829 1.00 0.00 C ATOM 1600 CG2 ILE A 112 5.062 8.252 1.329 1.00 0.00 C ATOM 1601 CD1 ILE A 112 6.611 8.348 4.075 1.00 0.00 C ATOM 0 H ILE A 112 6.044 10.408 2.423 1.00 0.00 H new ATOM 0 HA ILE A 112 3.220 10.163 2.249 1.00 0.00 H new ATOM 0 HB ILE A 112 3.446 7.975 2.702 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.631 7.920 4.752 1.00 0.00 H new ATOM 0 HG13 ILE A 112 5.272 6.749 3.615 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.296 7.194 1.213 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.375 8.561 0.541 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.980 8.836 1.260 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.069 7.799 4.898 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.211 8.219 3.174 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.561 9.407 4.329 1.00 0.00 H new ATOM 1613 N ILE A 113 4.325 10.971 5.151 1.00 0.00 N ATOM 1614 CA ILE A 113 3.962 11.379 6.494 1.00 0.00 C ATOM 1615 C ILE A 113 2.674 12.189 6.388 1.00 0.00 C ATOM 1616 O ILE A 113 2.662 13.262 5.787 1.00 0.00 O ATOM 1617 CB ILE A 113 5.115 12.192 7.116 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.400 11.364 7.291 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.703 12.834 8.450 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.238 10.161 8.224 1.00 0.00 C ATOM 0 H ILE A 113 5.257 11.282 4.877 1.00 0.00 H new ATOM 0 HA ILE A 113 3.793 10.523 7.147 1.00 0.00 H new ATOM 0 HB ILE A 113 5.337 12.988 6.405 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.730 11.012 6.314 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.187 12.010 7.680 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.542 13.398 8.857 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.860 13.505 8.286 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.414 12.055 9.155 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.185 9.627 8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.939 10.506 9.214 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.474 9.492 7.826 1.00 0.00 H new ATOM 1632 N GLY A 114 1.588 11.653 6.939 1.00 0.00 N ATOM 1633 CA GLY A 114 0.289 12.293 6.932 1.00 0.00 C ATOM 1634 C GLY A 114 -0.721 11.571 6.041 1.00 0.00 C ATOM 1635 O GLY A 114 -1.925 11.675 6.267 1.00 0.00 O ATOM 0 H GLY A 114 1.593 10.748 7.409 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.096 12.334 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.398 13.322 6.590 1.00 0.00 H new ATOM 1639 N ARG A 115 -0.258 10.849 5.015 1.00 0.00 N ATOM 1640 CA ARG A 115 -1.155 10.151 4.108 1.00 0.00 C ATOM 1641 C ARG A 115 -1.615 8.834 4.737 1.00 0.00 C ATOM 1642 O ARG A 115 -0.998 8.354 5.689 1.00 0.00 O ATOM 1643 CB ARG A 115 -0.481 9.935 2.747 1.00 0.00 C ATOM 1644 CG ARG A 115 -0.368 11.219 1.914 1.00 0.00 C ATOM 1645 CD ARG A 115 0.613 12.262 2.455 1.00 0.00 C ATOM 1646 NE ARG A 115 0.918 13.320 1.471 1.00 0.00 N ATOM 1647 CZ ARG A 115 1.924 13.254 0.581 1.00 0.00 C ATOM 1648 NH1 ARG A 115 2.396 12.043 0.259 1.00 0.00 N ATOM 1649 NH2 ARG A 115 2.441 14.382 0.064 1.00 0.00 N ATOM 0 H ARG A 115 0.732 10.737 4.798 1.00 0.00 H new ATOM 0 HA ARG A 115 -2.041 10.762 3.935 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.516 9.524 2.905 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -1.046 9.193 2.183 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -0.067 10.951 0.901 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -1.355 11.675 1.843 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.195 12.716 3.354 1.00 0.00 H new ATOM 0 HD3 ARG A 115 1.538 11.767 2.749 1.00 0.00 H new ATOM 0 HE ARG A 115 0.329 14.153 1.466 1.00 0.00 H new ATOM 0 HH11 ARG A 115 1.993 11.209 0.685 1.00 0.00 H new ATOM 0 HH12 ARG A 115 3.159 11.955 -0.413 1.00 0.00 H new ATOM 0 HH21 ARG A 115 2.070 15.289 0.347 1.00 0.00 H new ATOM 0 HH22 ARG A 115 3.204 14.331 -0.611 1.00 0.00 H new ATOM 1663 N THR A 116 -2.699 8.255 4.202 1.00 0.00 N ATOM 1664 CA THR A 116 -3.257 6.988 4.638 1.00 0.00 C ATOM 1665 C THR A 116 -2.905 5.878 3.657 1.00 0.00 C ATOM 1666 O THR A 116 -3.175 5.994 2.461 1.00 0.00 O ATOM 1667 CB THR A 116 -4.766 7.105 4.908 1.00 0.00 C ATOM 1668 OG1 THR A 116 -4.947 7.287 6.297 1.00 0.00 O ATOM 1669 CG2 THR A 116 -5.600 5.882 4.519 1.00 0.00 C ATOM 0 H THR A 116 -3.220 8.676 3.432 1.00 0.00 H new ATOM 0 HA THR A 116 -2.804 6.715 5.591 1.00 0.00 H new ATOM 0 HB THR A 116 -5.109 7.936 4.292 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.904 7.366 6.495 1.00 0.00 H new ATOM 0 HG21 THR A 116 -6.649 6.068 4.751 1.00 0.00 H new ATOM 0 HG22 THR A 116 -5.492 5.693 3.451 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.254 5.013 5.078 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.338 4.789 4.180 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.084 3.579 3.420 1.00 0.00 C ATOM 1679 C LEU A 117 -3.308 2.668 3.587 1.00 0.00 C ATOM 1680 O LEU A 117 -3.759 2.430 4.710 1.00 0.00 O ATOM 1681 CB LEU A 117 -0.767 2.937 3.894 1.00 0.00 C ATOM 1682 CG LEU A 117 0.064 2.219 2.813 1.00 0.00 C ATOM 1683 CD1 LEU A 117 -0.732 1.158 2.054 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.710 3.202 1.831 1.00 0.00 C ATOM 0 H LEU A 117 -2.042 4.729 5.154 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.951 3.779 2.357 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.148 3.714 4.343 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.999 2.220 4.681 1.00 0.00 H new ATOM 0 HG LEU A 117 0.858 1.705 3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.092 0.688 1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.089 0.402 2.753 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.583 1.626 1.560 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.285 2.649 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.067 3.781 1.331 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.372 3.876 2.374 1.00 0.00 H new ATOM 1696 N VAL A 118 -3.871 2.210 2.467 1.00 0.00 N ATOM 1697 CA VAL A 118 -4.990 1.281 2.392 1.00 0.00 C ATOM 1698 C VAL A 118 -4.482 -0.041 1.814 1.00 0.00 C ATOM 1699 O VAL A 118 -3.570 -0.033 0.990 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.075 1.898 1.496 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -7.137 0.896 1.045 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.778 3.045 2.228 1.00 0.00 C ATOM 0 H VAL A 118 -3.539 2.494 1.545 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.417 1.091 3.377 1.00 0.00 H new ATOM 0 HB VAL A 118 -5.555 2.256 0.607 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.870 1.401 0.416 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -6.664 0.094 0.478 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -7.636 0.477 1.919 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.544 3.473 1.582 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -7.242 2.666 3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -6.049 3.814 2.485 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.100 -1.147 2.250 1.00 0.00 N ATOM 1713 CA VAL A 119 -4.737 -2.540 1.954 1.00 0.00 C ATOM 1714 C VAL A 119 -5.676 -3.234 0.947 1.00 0.00 C ATOM 1715 O VAL A 119 -5.332 -4.253 0.356 1.00 0.00 O ATOM 1716 CB VAL A 119 -4.655 -3.312 3.294 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -5.696 -2.867 4.329 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.836 -4.825 3.139 1.00 0.00 C ATOM 0 H VAL A 119 -5.918 -1.089 2.857 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.768 -2.539 1.455 1.00 0.00 H new ATOM 0 HB VAL A 119 -3.649 -3.076 3.640 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.576 -3.453 5.241 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -5.555 -1.810 4.555 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.697 -3.022 3.927 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.767 -5.302 4.117 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.813 -5.032 2.703 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.057 -5.220 2.487 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.878 -2.696 0.783 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.002 -3.207 0.011 1.00 0.00 C ATOM 1730 C HIS A 120 -8.412 -4.637 0.323 1.00 0.00 C ATOM 1731 O HIS A 120 -7.699 -5.427 0.938 1.00 0.00 O ATOM 1732 CB HIS A 120 -7.858 -2.984 -1.499 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.043 -1.542 -1.855 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -6.987 -0.717 -2.026 1.00 0.00 N flip ATOM 1735 CD2 HIS A 120 -9.211 -0.835 -1.956 1.00 0.00 C flip ATOM 1736 CE1 HIS A 120 -7.544 0.519 -2.331 1.00 0.00 C flip ATOM 1737 NE2 HIS A 120 -8.890 0.423 -2.274 1.00 0.00 N flip ATOM 0 H HIS A 120 -7.111 -1.809 1.229 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.830 -2.589 0.358 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -6.873 -3.318 -1.826 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.593 -3.589 -2.030 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -10.208 -1.222 -1.806 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -6.989 1.413 -2.575 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -9.550 1.182 -2.445 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.637 -4.952 -0.084 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.212 -6.242 0.194 1.00 0.00 C ATOM 1747 C GLU A 121 -9.551 -7.326 -0.660 1.00 0.00 C ATOM 1748 O GLU A 121 -9.177 -8.378 -0.152 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.716 -6.170 -0.073 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.438 -7.487 0.229 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.918 -7.235 0.489 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.411 -6.201 -0.021 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.508 -8.071 1.202 1.00 0.00 O ATOM 0 H GLU A 121 -10.244 -4.322 -0.608 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.041 -6.507 1.237 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.150 -5.376 0.534 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.882 -5.901 -1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.321 -8.173 -0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -11.986 -7.966 1.098 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.420 -7.070 -1.963 1.00 0.00 N ATOM 1761 CA LYS A 122 -8.792 -7.982 -2.916 1.00 0.00 C ATOM 1762 C LYS A 122 -7.503 -7.361 -3.466 1.00 0.00 C ATOM 1763 O LYS A 122 -7.112 -6.253 -3.084 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.777 -8.295 -4.057 1.00 0.00 C ATOM 1765 CG LYS A 122 -11.126 -8.886 -3.609 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.222 -10.413 -3.746 1.00 0.00 C ATOM 1767 CE LYS A 122 -10.205 -11.154 -2.866 1.00 0.00 C ATOM 1768 NZ LYS A 122 -10.413 -12.617 -2.899 1.00 0.00 N ATOM 0 H LYS A 122 -9.754 -6.207 -2.392 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.534 -8.913 -2.411 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.967 -7.378 -4.615 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.302 -8.994 -4.745 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.301 -8.614 -2.568 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.923 -8.429 -4.196 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.229 -10.735 -3.479 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.064 -10.690 -4.788 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.195 -10.923 -3.205 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -10.286 -10.798 -1.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -9.707 -13.082 -2.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.368 -12.840 -2.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.311 -12.960 -3.875 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.861 -8.089 -4.381 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.764 -7.614 -5.202 1.00 0.00 C ATOM 1784 C ALA A 123 -6.246 -6.419 -6.012 1.00 0.00 C ATOM 1785 O ALA A 123 -7.427 -6.343 -6.342 1.00 0.00 O ATOM 1786 CB ALA A 123 -5.362 -8.724 -6.175 1.00 0.00 C ATOM 0 H ALA A 123 -7.106 -9.061 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 123 -4.918 -7.334 -4.574 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -4.537 -8.380 -6.799 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -5.049 -9.604 -5.614 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -6.213 -8.980 -6.807 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.333 -5.516 -6.354 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.604 -4.452 -7.302 1.00 0.00 C ATOM 1794 C ASP A 124 -5.135 -4.866 -8.703 1.00 0.00 C ATOM 1795 O ASP A 124 -3.971 -5.192 -8.917 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.978 -3.150 -6.795 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.471 -3.118 -6.769 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -2.857 -4.139 -6.409 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -3.000 -1.991 -7.044 1.00 0.00 O ATOM 0 H ASP A 124 -4.385 -5.505 -5.979 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.675 -4.270 -7.387 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.330 -2.331 -7.422 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.345 -2.960 -5.786 1.00 0.00 H new ATOM 1804 N ASP A 125 -6.033 -4.816 -9.689 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.840 -5.319 -11.049 1.00 0.00 C ATOM 1806 C ASP A 125 -4.931 -4.421 -11.879 1.00 0.00 C ATOM 1807 O ASP A 125 -5.010 -4.426 -13.106 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.204 -5.429 -11.760 1.00 0.00 C ATOM 1809 CG ASP A 125 -8.188 -6.418 -11.152 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -7.753 -7.248 -10.327 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -9.369 -6.326 -11.553 1.00 0.00 O ATOM 0 H ASP A 125 -6.957 -4.405 -9.554 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.364 -6.296 -10.963 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.668 -4.443 -11.770 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.030 -5.710 -12.799 1.00 0.00 H new ATOM 1816 N LEU A 126 -4.095 -3.611 -11.230 1.00 0.00 N ATOM 1817 CA LEU A 126 -3.196 -2.671 -11.866 1.00 0.00 C ATOM 1818 C LEU A 126 -3.870 -1.925 -13.032 1.00 0.00 C ATOM 1819 O LEU A 126 -3.291 -1.731 -14.096 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.924 -3.419 -12.269 1.00 0.00 C ATOM 1821 CG LEU A 126 -1.324 -4.268 -11.132 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.015 -4.853 -11.585 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -1.161 -3.498 -9.816 1.00 0.00 C ATOM 0 H LEU A 126 -4.029 -3.597 -10.212 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.922 -1.883 -11.165 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.146 -4.067 -13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.179 -2.698 -12.605 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.032 -5.070 -10.922 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.440 -5.454 -10.781 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.140 -5.480 -12.463 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.700 -4.043 -11.834 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.734 -4.156 -9.060 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.499 -2.647 -9.972 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -2.135 -3.143 -9.479 1.00 0.00 H new ATOM 1835 N GLY A 127 -5.120 -1.512 -12.817 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.894 -0.710 -13.759 1.00 0.00 C ATOM 1837 C GLY A 127 -6.362 -1.482 -14.998 1.00 0.00 C ATOM 1838 O GLY A 127 -7.113 -0.947 -15.818 1.00 0.00 O ATOM 0 H GLY A 127 -5.632 -1.732 -11.963 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.766 -0.305 -13.245 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -5.290 0.139 -14.079 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.943 -2.743 -15.146 1.00 0.00 N ATOM 1843 CA LYS A 128 -6.108 -3.514 -16.368 1.00 0.00 C ATOM 1844 C LYS A 128 -7.579 -3.817 -16.661 1.00 0.00 C ATOM 1845 O LYS A 128 -7.898 -4.199 -17.784 1.00 0.00 O ATOM 1846 CB LYS A 128 -5.296 -4.817 -16.276 1.00 0.00 C ATOM 1847 CG LYS A 128 -3.794 -4.611 -16.003 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.901 -4.892 -17.218 1.00 0.00 C ATOM 1849 CE LYS A 128 -3.044 -3.802 -18.290 1.00 0.00 C ATOM 1850 NZ LYS A 128 -2.210 -4.083 -19.478 1.00 0.00 N ATOM 0 H LYS A 128 -5.472 -3.259 -14.403 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.734 -2.912 -17.196 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.715 -5.437 -15.484 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -5.411 -5.370 -17.208 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.631 -3.585 -15.674 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -3.491 -5.261 -15.182 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -1.861 -4.955 -16.899 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.162 -5.860 -17.646 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -4.089 -3.723 -18.591 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -2.761 -2.838 -17.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -2.335 -3.324 -20.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -1.210 -4.133 -19.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -2.497 -4.991 -19.897 1.00 0.00 H new ATOM 1864 N GLY A 129 -8.475 -3.637 -15.683 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.900 -3.836 -15.887 1.00 0.00 C ATOM 1866 C GLY A 129 -10.456 -2.903 -16.965 1.00 0.00 C ATOM 1867 O GLY A 129 -11.466 -3.219 -17.588 1.00 0.00 O ATOM 0 H GLY A 129 -8.226 -3.351 -14.736 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -10.085 -4.872 -16.172 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -10.429 -3.664 -14.950 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.811 -1.752 -17.195 1.00 0.00 N ATOM 1872 CA GLY A 130 -10.217 -0.855 -18.268 1.00 0.00 C ATOM 1873 C GLY A 130 -11.563 -0.205 -17.961 1.00 0.00 C ATOM 1874 O GLY A 130 -12.421 -0.085 -18.833 1.00 0.00 O ATOM 0 H GLY A 130 -9.011 -1.427 -16.652 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.460 -0.083 -18.407 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -10.282 -1.409 -19.204 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.732 0.255 -16.720 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.873 1.049 -16.296 1.00 0.00 C ATOM 1880 C ASN A 131 -12.462 1.998 -15.193 1.00 0.00 C ATOM 1881 O ASN A 131 -11.531 1.657 -14.465 1.00 0.00 O ATOM 1882 CB ASN A 131 -14.115 0.219 -15.965 1.00 0.00 C ATOM 1883 CG ASN A 131 -13.814 -0.896 -14.989 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -12.959 -0.636 -14.012 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -14.321 -2.003 -15.120 1.00 0.00 N flip ATOM 0 H ASN A 131 -11.063 0.079 -15.971 1.00 0.00 H new ATOM 0 HA ASN A 131 -13.192 1.650 -17.148 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.883 0.869 -15.546 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -14.522 -0.204 -16.883 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -14.977 -2.177 -15.882 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.087 -2.751 -14.467 1.00 0.00 H new ATOM 1892 N GLU A 132 -13.178 3.119 -15.045 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.931 4.126 -14.020 1.00 0.00 C ATOM 1894 C GLU A 132 -12.565 3.446 -12.703 1.00 0.00 C ATOM 1895 O GLU A 132 -11.499 3.711 -12.162 1.00 0.00 O ATOM 1896 CB GLU A 132 -14.136 5.080 -13.896 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.713 6.555 -13.821 1.00 0.00 C ATOM 1898 CD GLU A 132 -13.146 6.929 -12.462 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -13.966 7.064 -11.529 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -11.911 7.059 -12.358 1.00 0.00 O ATOM 0 H GLU A 132 -13.964 3.352 -15.653 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.081 4.745 -14.307 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.797 4.938 -14.751 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.708 4.824 -13.004 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.967 6.755 -14.590 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.573 7.188 -14.039 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.408 2.497 -12.268 1.00 0.00 N ATOM 1908 CA GLN A 133 -13.192 1.678 -11.081 1.00 0.00 C ATOM 1909 C GLN A 133 -11.737 1.178 -11.011 1.00 0.00 C ATOM 1910 O GLN A 133 -10.954 1.779 -10.297 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.273 0.576 -10.973 1.00 0.00 C ATOM 1912 CG GLN A 133 -15.011 0.575 -9.625 1.00 0.00 C ATOM 1913 CD GLN A 133 -14.196 -0.049 -8.498 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -12.967 0.411 -8.316 1.00 0.00 O flip ATOM 1915 NE2 GLN A 133 -14.660 -0.939 -7.795 1.00 0.00 N flip ATOM 0 H GLN A 133 -14.280 2.278 -12.750 1.00 0.00 H new ATOM 0 HA GLN A 133 -13.318 2.287 -10.186 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.998 0.709 -11.776 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.806 -0.397 -11.124 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.266 1.600 -9.356 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.949 0.030 -9.732 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -15.610 -1.274 -7.957 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -14.097 -1.344 -7.048 1.00 0.00 H new ATOM 1924 N SER A 134 -11.361 0.104 -11.703 1.00 0.00 N ATOM 1925 CA SER A 134 -9.993 -0.364 -11.924 1.00 0.00 C ATOM 1926 C SER A 134 -8.982 0.776 -12.025 1.00 0.00 C ATOM 1927 O SER A 134 -8.033 0.816 -11.242 1.00 0.00 O ATOM 1928 CB SER A 134 -9.904 -1.284 -13.159 1.00 0.00 C ATOM 1929 OG SER A 134 -8.706 -2.042 -13.173 1.00 0.00 O ATOM 0 H SER A 134 -12.047 -0.502 -12.153 1.00 0.00 H new ATOM 0 HA SER A 134 -9.727 -0.944 -11.041 1.00 0.00 H new ATOM 0 HB2 SER A 134 -10.760 -1.959 -13.170 1.00 0.00 H new ATOM 0 HB3 SER A 134 -9.962 -0.681 -14.065 1.00 0.00 H new ATOM 0 HG SER A 134 -8.905 -2.973 -12.940 1.00 0.00 H new ATOM 1935 N THR A 135 -9.176 1.713 -12.956 1.00 0.00 N ATOM 1936 CA THR A 135 -8.174 2.722 -13.265 1.00 0.00 C ATOM 1937 C THR A 135 -8.048 3.752 -12.134 1.00 0.00 C ATOM 1938 O THR A 135 -7.138 4.584 -12.154 1.00 0.00 O ATOM 1939 CB THR A 135 -8.490 3.363 -14.619 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.804 3.855 -14.652 1.00 0.00 O ATOM 1941 CG2 THR A 135 -8.334 2.334 -15.747 1.00 0.00 C ATOM 0 H THR A 135 -10.028 1.789 -13.511 1.00 0.00 H new ATOM 0 HA THR A 135 -7.197 2.246 -13.343 1.00 0.00 H new ATOM 0 HB THR A 135 -7.790 4.186 -14.759 1.00 0.00 H new ATOM 0 HG1 THR A 135 -10.165 3.884 -13.742 1.00 0.00 H new ATOM 0 HG21 THR A 135 -8.562 2.805 -16.703 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.310 1.962 -15.761 1.00 0.00 H new ATOM 0 HG23 THR A 135 -9.019 1.503 -15.579 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.938 3.688 -11.141 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.940 4.529 -9.967 1.00 0.00 C ATOM 1951 C LYS A 136 -8.585 3.717 -8.729 1.00 0.00 C ATOM 1952 O LYS A 136 -7.985 4.295 -7.826 1.00 0.00 O ATOM 1953 CB LYS A 136 -10.325 5.154 -9.836 1.00 0.00 C ATOM 1954 CG LYS A 136 -10.417 6.161 -8.688 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.702 6.992 -8.807 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.969 6.124 -8.749 1.00 0.00 C ATOM 1957 NZ LYS A 136 -14.184 6.928 -8.971 1.00 0.00 N ATOM 0 H LYS A 136 -9.705 3.016 -11.144 1.00 0.00 H new ATOM 0 HA LYS A 136 -8.190 5.315 -10.063 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.584 5.652 -10.771 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -11.061 4.365 -9.681 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -10.403 5.636 -7.733 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.548 6.819 -8.702 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.732 7.727 -8.003 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.687 7.546 -9.745 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.908 5.339 -9.502 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -13.030 5.631 -7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.995 6.465 -8.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.052 7.876 -8.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.364 7.010 -9.992 1.00 0.00 H new ATOM 1971 N THR A 137 -8.968 2.431 -8.643 1.00 0.00 N ATOM 1972 CA THR A 137 -8.795 1.711 -7.375 1.00 0.00 C ATOM 1973 C THR A 137 -7.940 0.465 -7.506 1.00 0.00 C ATOM 1974 O THR A 137 -7.315 0.052 -6.527 1.00 0.00 O ATOM 1975 CB THR A 137 -10.121 1.359 -6.686 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.623 0.109 -7.120 1.00 0.00 O ATOM 1977 CG2 THR A 137 -11.171 2.468 -6.815 1.00 0.00 C ATOM 0 H THR A 137 -9.382 1.890 -9.402 1.00 0.00 H new ATOM 0 HA THR A 137 -8.265 2.421 -6.740 1.00 0.00 H new ATOM 0 HB THR A 137 -9.898 1.271 -5.623 1.00 0.00 H new ATOM 0 HG1 THR A 137 -11.582 0.188 -7.307 1.00 0.00 H new ATOM 0 HG21 THR A 137 -12.087 2.163 -6.309 1.00 0.00 H new ATOM 0 HG22 THR A 137 -10.792 3.383 -6.359 1.00 0.00 H new ATOM 0 HG23 THR A 137 -11.382 2.649 -7.869 1.00 0.00 H new ATOM 1985 N GLY A 138 -8.008 -0.184 -8.667 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.584 -1.554 -8.824 1.00 0.00 C ATOM 1987 C GLY A 138 -8.751 -2.500 -9.022 1.00 0.00 C ATOM 1988 O GLY A 138 -8.516 -3.672 -9.269 1.00 0.00 O ATOM 0 H GLY A 138 -8.363 0.238 -9.525 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -6.911 -1.628 -9.678 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -7.017 -1.859 -7.944 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.002 -2.042 -8.884 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.164 -2.898 -9.108 1.00 0.00 C ATOM 1994 C ASN A 139 -11.331 -3.914 -7.968 1.00 0.00 C ATOM 1995 O ASN A 139 -12.192 -4.784 -8.039 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.056 -3.622 -10.465 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.360 -3.616 -11.245 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -12.700 -2.604 -11.864 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.068 -4.740 -11.255 1.00 0.00 N ATOM 0 H ASN A 139 -10.231 -1.084 -8.619 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.049 -2.261 -9.126 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.279 -3.147 -11.063 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -10.744 -4.653 -10.297 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -13.934 -4.792 -11.791 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -12.745 -5.551 -10.727 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.492 -3.801 -6.928 1.00 0.00 N ATOM 2007 CA ALA A 140 -10.333 -4.785 -5.878 1.00 0.00 C ATOM 2008 C ALA A 140 -11.642 -5.012 -5.136 1.00 0.00 C ATOM 2009 O ALA A 140 -12.125 -6.133 -5.020 1.00 0.00 O ATOM 2010 CB ALA A 140 -9.252 -4.283 -4.910 1.00 0.00 C ATOM 0 H ALA A 140 -9.889 -2.988 -6.802 1.00 0.00 H new ATOM 0 HA ALA A 140 -10.037 -5.739 -6.315 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -9.115 -5.010 -4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -8.313 -4.155 -5.448 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.560 -3.328 -4.484 1.00 0.00 H new ATOM 2016 N GLY A 141 -12.176 -3.933 -4.569 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.270 -3.987 -3.623 1.00 0.00 C ATOM 2018 C GLY A 141 -13.008 -2.946 -2.548 1.00 0.00 C ATOM 2019 O GLY A 141 -12.284 -1.971 -2.786 1.00 0.00 O ATOM 0 H GLY A 141 -11.851 -2.986 -4.762 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.218 -3.789 -4.124 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.344 -4.981 -3.182 1.00 0.00 H new ATOM 2023 N SER A 142 -13.594 -3.144 -1.367 1.00 0.00 N ATOM 2024 CA SER A 142 -13.551 -2.129 -0.334 1.00 0.00 C ATOM 2025 C SER A 142 -12.176 -2.064 0.338 1.00 0.00 C ATOM 2026 O SER A 142 -11.189 -2.624 -0.147 1.00 0.00 O ATOM 2027 CB SER A 142 -14.690 -2.344 0.667 1.00 0.00 C ATOM 2028 OG SER A 142 -14.877 -1.145 1.405 1.00 0.00 O ATOM 0 H SER A 142 -14.098 -3.993 -1.111 1.00 0.00 H new ATOM 0 HA SER A 142 -13.703 -1.154 -0.797 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.608 -2.613 0.144 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.452 -3.169 1.339 1.00 0.00 H new ATOM 0 HG SER A 142 -14.752 -1.326 2.360 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.125 -1.320 1.441 1.00 0.00 N ATOM 2035 CA ARG A 143 -10.950 -1.049 2.249 1.00 0.00 C ATOM 2036 C ARG A 143 -11.082 -1.801 3.576 1.00 0.00 C ATOM 2037 O ARG A 143 -11.637 -1.261 4.528 1.00 0.00 O ATOM 2038 CB ARG A 143 -10.816 0.466 2.479 1.00 0.00 C ATOM 2039 CG ARG A 143 -10.602 1.287 1.196 1.00 0.00 C ATOM 2040 CD ARG A 143 -11.886 1.588 0.409 1.00 0.00 C ATOM 2041 NE ARG A 143 -11.709 2.749 -0.480 1.00 0.00 N ATOM 2042 CZ ARG A 143 -12.462 3.022 -1.560 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -13.453 2.198 -1.918 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -12.208 4.117 -2.290 1.00 0.00 N ATOM 0 H ARG A 143 -12.958 -0.864 1.813 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.050 -1.391 1.737 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.714 0.826 2.980 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -9.980 0.646 3.155 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.123 2.230 1.459 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -9.911 0.749 0.547 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -12.167 0.715 -0.181 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -12.704 1.780 1.103 1.00 0.00 H new ATOM 0 HE ARG A 143 -10.954 3.398 -0.258 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -13.640 1.358 -1.371 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -14.021 2.410 -2.738 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -11.445 4.740 -2.026 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -12.777 4.327 -3.110 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.564 -3.034 3.649 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.549 -3.831 4.881 1.00 0.00 C ATOM 2060 C LEU A 144 -9.995 -3.022 6.056 1.00 0.00 C ATOM 2061 O LEU A 144 -10.514 -3.114 7.165 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.706 -5.110 4.701 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.438 -6.372 4.197 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.866 -7.264 5.364 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.703 -6.050 3.400 1.00 0.00 C ATOM 0 H LEU A 144 -10.142 -3.508 2.851 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.580 -4.109 5.097 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.898 -4.887 4.004 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.244 -5.348 5.659 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.720 -6.878 3.552 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -11.379 -8.145 4.979 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.986 -7.574 5.927 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.539 -6.709 6.018 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.173 -6.978 3.073 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.398 -5.493 4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.441 -5.449 2.529 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.928 -2.256 5.815 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.344 -1.373 6.804 1.00 0.00 C ATOM 2079 C ALA A 145 -7.767 -0.147 6.121 1.00 0.00 C ATOM 2080 O ALA A 145 -7.554 -0.138 4.904 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.275 -2.109 7.611 1.00 0.00 C ATOM 0 H ALA A 145 -8.447 -2.238 4.916 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.120 -1.048 7.497 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.846 -1.432 8.350 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.725 -2.962 8.119 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.490 -2.459 6.941 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.525 0.872 6.940 1.00 0.00 N ATOM 2088 CA CYS A 146 -6.966 2.158 6.576 1.00 0.00 C ATOM 2089 C CYS A 146 -6.042 2.552 7.729 1.00 0.00 C ATOM 2090 O CYS A 146 -6.250 2.110 8.859 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.099 3.177 6.350 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.290 3.389 7.716 1.00 0.00 S ATOM 0 H CYS A 146 -7.729 0.812 7.938 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.404 2.124 5.643 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.648 4.146 6.137 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.652 2.880 5.459 1.00 0.00 H new ATOM 0 HG CYS A 146 -10.180 4.276 7.382 1.00 0.00 H new ATOM 2097 N GLY A 147 -4.978 3.311 7.459 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.122 3.805 8.530 1.00 0.00 C ATOM 2099 C GLY A 147 -3.220 4.940 8.069 1.00 0.00 C ATOM 2100 O GLY A 147 -2.562 4.827 7.033 1.00 0.00 O ATOM 0 H GLY A 147 -4.694 3.592 6.520 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.742 4.149 9.358 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.509 2.987 8.909 1.00 0.00 H new ATOM 2104 N VAL A 148 -3.184 6.015 8.861 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.327 7.168 8.642 1.00 0.00 C ATOM 2106 C VAL A 148 -0.866 6.816 8.930 1.00 0.00 C ATOM 2107 O VAL A 148 -0.572 6.060 9.858 1.00 0.00 O ATOM 2108 CB VAL A 148 -2.832 8.375 9.452 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -2.914 8.125 10.964 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -1.978 9.619 9.180 1.00 0.00 C ATOM 0 H VAL A 148 -3.768 6.103 9.692 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.372 7.458 7.592 1.00 0.00 H new ATOM 0 HB VAL A 148 -3.852 8.542 9.107 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -3.278 9.023 11.462 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -3.598 7.299 11.160 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -1.924 7.875 11.346 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -2.358 10.456 9.766 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -0.944 9.419 9.461 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -2.024 9.867 8.120 1.00 0.00 H new ATOM 2120 N ILE A 149 0.045 7.358 8.120 1.00 0.00 N ATOM 2121 CA ILE A 149 1.479 7.157 8.247 1.00 0.00 C ATOM 2122 C ILE A 149 2.069 8.328 9.042 1.00 0.00 C ATOM 2123 O ILE A 149 1.760 9.482 8.742 1.00 0.00 O ATOM 2124 CB ILE A 149 2.109 7.072 6.845 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.415 6.071 5.896 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.596 6.728 7.008 1.00 0.00 C ATOM 2127 CD1 ILE A 149 1.634 6.436 4.428 1.00 0.00 C ATOM 0 H ILE A 149 -0.207 7.964 7.339 1.00 0.00 H new ATOM 0 HA ILE A 149 1.691 6.227 8.774 1.00 0.00 H new ATOM 0 HB ILE A 149 1.978 8.043 6.367 1.00 0.00 H new ATOM 0 HG12 ILE A 149 1.798 5.068 6.082 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.346 6.049 6.110 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.064 6.662 6.026 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.087 7.506 7.593 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.694 5.771 7.521 1.00 0.00 H new ATOM 0 HD11 ILE A 149 1.130 5.708 3.793 1.00 0.00 H new ATOM 0 HD12 ILE A 149 1.227 7.429 4.235 1.00 0.00 H new ATOM 0 HD13 ILE A 149 2.701 6.433 4.208 1.00 0.00 H new ATOM 2139 N GLY A 150 2.929 8.052 10.031 1.00 0.00 N ATOM 2140 CA GLY A 150 3.561 9.055 10.873 1.00 0.00 C ATOM 2141 C GLY A 150 4.992 8.631 11.192 1.00 0.00 C ATOM 2142 O GLY A 150 5.398 7.519 10.873 1.00 0.00 O ATOM 0 H GLY A 150 3.206 7.099 10.267 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.562 10.020 10.367 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.994 9.179 11.796 1.00 0.00 H new ATOM 2146 N ILE A 151 5.773 9.524 11.798 1.00 0.00 N ATOM 2147 CA ILE A 151 7.149 9.277 12.192 1.00 0.00 C ATOM 2148 C ILE A 151 7.156 8.203 13.286 1.00 0.00 C ATOM 2149 O ILE A 151 6.264 8.181 14.133 1.00 0.00 O ATOM 2150 CB ILE A 151 7.809 10.586 12.671 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.524 11.767 11.723 1.00 0.00 C ATOM 2152 CG2 ILE A 151 9.329 10.397 12.782 1.00 0.00 C ATOM 2153 CD1 ILE A 151 6.497 12.747 12.299 1.00 0.00 C ATOM 0 H ILE A 151 5.452 10.463 12.033 1.00 0.00 H new ATOM 0 HA ILE A 151 7.730 8.918 11.342 1.00 0.00 H new ATOM 0 HB ILE A 151 7.379 10.820 13.645 1.00 0.00 H new ATOM 0 HG12 ILE A 151 8.454 12.298 11.520 1.00 0.00 H new ATOM 0 HG13 ILE A 151 7.161 11.384 10.769 1.00 0.00 H new ATOM 0 HG21 ILE A 151 9.787 11.326 13.121 1.00 0.00 H new ATOM 0 HG22 ILE A 151 9.546 9.604 13.497 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.734 10.127 11.807 1.00 0.00 H new ATOM 0 HD11 ILE A 151 6.333 13.560 11.591 1.00 0.00 H new ATOM 0 HD12 ILE A 151 5.557 12.226 12.477 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.870 13.154 13.239 1.00 0.00 H new ATOM 2165 N ALA A 152 8.145 7.312 13.249 1.00 0.00 N ATOM 2166 CA ALA A 152 8.336 6.264 14.247 1.00 0.00 C ATOM 2167 C ALA A 152 9.487 6.606 15.185 1.00 0.00 C ATOM 2168 O ALA A 152 10.049 7.698 15.109 1.00 0.00 O ATOM 2169 CB ALA A 152 8.560 4.922 13.546 1.00 0.00 C ATOM 0 H ALA A 152 8.848 7.299 12.510 1.00 0.00 H new ATOM 0 HA ALA A 152 7.438 6.188 14.860 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.702 4.141 14.293 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.692 4.683 12.932 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.446 4.985 12.914 1.00 0.00 H new ATOM 2175 N GLN A 153 9.810 5.673 16.084 1.00 0.00 N ATOM 2176 CA GLN A 153 10.927 5.835 16.994 1.00 0.00 C ATOM 2177 C GLN A 153 12.237 5.719 16.204 1.00 0.00 C ATOM 2178 O GLN A 153 13.196 6.435 16.562 1.00 0.00 O ATOM 2179 CB GLN A 153 10.856 4.777 18.107 1.00 0.00 C ATOM 2180 CG GLN A 153 11.741 5.171 19.300 1.00 0.00 C ATOM 2181 CD GLN A 153 12.371 3.959 19.981 1.00 0.00 C ATOM 2182 OE1 GLN A 153 13.587 3.808 20.001 1.00 0.00 O ATOM 2183 NE2 GLN A 153 11.556 3.078 20.556 1.00 0.00 N ATOM 2184 OXT GLN A 153 12.262 4.891 15.266 1.00 0.00 O ATOM 0 H GLN A 153 9.304 4.794 16.195 1.00 0.00 H new ATOM 0 HA GLN A 153 10.885 6.818 17.464 1.00 0.00 H new ATOM 0 HB2 GLN A 153 9.824 4.661 18.438 1.00 0.00 H new ATOM 0 HB3 GLN A 153 11.176 3.811 17.716 1.00 0.00 H new ATOM 0 HG2 GLN A 153 12.528 5.843 18.959 1.00 0.00 H new ATOM 0 HG3 GLN A 153 11.144 5.723 20.026 1.00 0.00 H new ATOM 0 HE21 GLN A 153 10.547 3.223 20.528 1.00 0.00 H new ATOM 0 HE22 GLN A 153 11.941 2.258 21.025 1.00 0.00 H new