USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1224 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 125 LYS NZ :NH3+ 153:sc= 0.312 (180deg=0) USER MOD Set 1.2: A 129 TYR OH : rot -44:sc= -2.4 USER MOD Set 2.1: A 110 TYR OH : rot 135:sc= -0.385 USER MOD Set 2.2: A 122 MET CE :methyl -122:sc= -11.2! (180deg=-13.2!) USER MOD Single : A 1 MET CE :methyl -158:sc= -1.26 (180deg=-3.04!) USER MOD Single : A 1 MET N :NH3+ 176:sc= -2.91! (180deg=-3.47!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.674 X(o=-0.67,f=-1) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 166:sc= 0.835 (180deg=0.692) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -2.29! C(o=-2.3!,f=-2.5!) USER MOD Single : A 35 ASN : amide:sc= -3.67 K(o=-3.7,f=-9.2!) USER MOD Single : A 40 SER OG : rot 180:sc= 0.0465 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0.191 K(o=0.19,f=-3) USER MOD Single : A 49 GLN : amide:sc= -0.0182 K(o=-0.018,f=-1.5!) USER MOD Single : A 50 GLN : amide:sc= -0.182 K(o=-0.18,f=-0.93) USER MOD Single : A 54 GLN : amide:sc=-0.00155 X(o=-0.0015,f=-0.0065) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.492 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 174:sc= 0 (180deg=-0.0386) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 113:sc= 1.11 USER MOD Single : A 77 CYS SG : rot 164:sc= -7.51! USER MOD Single : A 84 ASN : amide:sc= -2.77! C(o=-2.8!,f=-7!) USER MOD Single : A 89 ASN :FLIP amide:sc= -1.39! C(o=-2.1!,f=-1.4!) USER MOD Single : A 90 ASN :FLIP amide:sc= -0.737 F(o=-1.8!,f=-0.74) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -164:sc=-0.00347 (180deg=-0.0171) USER MOD Single : A 102 HIS :FLIP no HD1:sc= -0.158 F(o=-1,f=-0.16) USER MOD Single : A 106 HIS : no HD1:sc= -0.442 K(o=-0.44,f=-1.5) USER MOD Single : A 112 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-1.3) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.171 X(o=-0.17,f=-0.45) USER MOD Single : A 119 SER OG : rot 180:sc= -1.23 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -2.86! C(o=-2.9!,f=-5.6!) USER MOD Single : A 127 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 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN :FLIP amide:sc= -0.0803 F(o=-0.88,f=-0.08) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.210 -0.463 14.070 1.00 0.00 N ATOM 2 CA MET A 1 -0.114 -1.913 14.060 1.00 0.00 C ATOM 3 C MET A 1 0.327 -2.424 12.687 1.00 0.00 C ATOM 4 O MET A 1 -0.214 -3.407 12.184 1.00 0.00 O ATOM 5 CB MET A 1 -1.473 -2.517 14.418 1.00 0.00 C ATOM 6 CG MET A 1 -1.422 -4.046 14.374 1.00 0.00 C ATOM 7 SD MET A 1 -2.532 -4.658 13.116 1.00 0.00 S ATOM 8 CE MET A 1 -4.033 -3.817 13.591 1.00 0.00 C ATOM 0 H1 MET A 1 -0.576 -0.146 14.990 1.00 0.00 H new ATOM 0 H2 MET A 1 0.732 -0.052 13.911 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.855 -0.153 13.316 1.00 0.00 H new ATOM 0 HA MET A 1 0.632 -2.214 14.795 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.770 -2.188 15.414 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.231 -2.155 13.723 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.405 -4.378 14.166 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.699 -4.455 15.345 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.893 -4.353 13.189 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.103 -3.783 14.678 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.021 -2.801 13.196 1.00 0.00 H new ATOM 18 N ILE A 2 1.306 -1.734 12.121 1.00 0.00 N ATOM 19 CA ILE A 2 1.826 -2.106 10.816 1.00 0.00 C ATOM 20 C ILE A 2 3.351 -2.207 10.889 1.00 0.00 C ATOM 21 O ILE A 2 4.000 -1.392 11.543 1.00 0.00 O ATOM 22 CB ILE A 2 1.324 -1.137 9.743 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.204 -1.139 9.674 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.960 -1.444 8.386 1.00 0.00 C ATOM 25 CD1 ILE A 2 -0.787 0.079 10.394 1.00 0.00 C ATOM 0 H ILE A 2 1.753 -0.919 12.542 1.00 0.00 H new ATOM 0 HA ILE A 2 1.455 -3.088 10.524 1.00 0.00 H new ATOM 0 HB ILE A 2 1.632 -0.129 10.022 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -0.525 -1.138 8.632 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.591 -2.053 10.126 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.586 -0.741 7.642 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.043 -1.350 8.462 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.704 -2.460 8.086 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -1.875 0.053 10.330 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.485 0.062 11.441 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -0.417 0.991 9.924 1.00 0.00 H new ATOM 37 N ARG A 3 3.878 -3.214 10.208 1.00 0.00 N ATOM 38 CA ARG A 3 5.315 -3.432 10.188 1.00 0.00 C ATOM 39 C ARG A 3 5.935 -2.767 8.957 1.00 0.00 C ATOM 40 O ARG A 3 5.595 -3.109 7.826 1.00 0.00 O ATOM 41 CB ARG A 3 5.645 -4.926 10.174 1.00 0.00 C ATOM 42 CG ARG A 3 6.520 -5.305 11.370 1.00 0.00 C ATOM 43 CD ARG A 3 5.921 -6.488 12.134 1.00 0.00 C ATOM 44 NE ARG A 3 6.879 -6.969 13.154 1.00 0.00 N ATOM 45 CZ ARG A 3 6.734 -8.118 13.847 1.00 0.00 C ATOM 46 NH1 ARG A 3 5.666 -8.916 13.634 1.00 0.00 N ATOM 47 NH2 ARG A 3 7.652 -8.451 14.735 1.00 0.00 N ATOM 0 H ARG A 3 3.336 -3.888 9.666 1.00 0.00 H new ATOM 0 HA ARG A 3 5.731 -2.989 11.093 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.722 -5.506 10.195 1.00 0.00 H new ATOM 0 HB3 ARG A 3 6.160 -5.180 9.247 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.522 -5.560 11.026 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.620 -4.449 12.038 1.00 0.00 H new ATOM 0 HD2 ARG A 3 4.988 -6.188 12.612 1.00 0.00 H new ATOM 0 HD3 ARG A 3 5.679 -7.294 11.441 1.00 0.00 H new ATOM 0 HE ARG A 3 7.701 -6.396 13.345 1.00 0.00 H new ATOM 0 HH11 ARG A 3 4.961 -8.652 12.945 1.00 0.00 H new ATOM 0 HH12 ARG A 3 5.564 -9.783 14.162 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.456 -7.843 14.889 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.557 -9.316 15.267 1.00 0.00 H new ATOM 60 N ILE A 4 6.834 -1.830 9.220 1.00 0.00 N ATOM 61 CA ILE A 4 7.505 -1.115 8.148 1.00 0.00 C ATOM 62 C ILE A 4 8.980 -1.521 8.114 1.00 0.00 C ATOM 63 O ILE A 4 9.761 -1.108 8.969 1.00 0.00 O ATOM 64 CB ILE A 4 7.286 0.393 8.290 1.00 0.00 C ATOM 65 CG1 ILE A 4 5.937 0.691 8.948 1.00 0.00 C ATOM 66 CG2 ILE A 4 7.433 1.098 6.941 1.00 0.00 C ATOM 67 CD1 ILE A 4 5.769 2.191 9.200 1.00 0.00 C ATOM 0 H ILE A 4 7.113 -1.549 10.160 1.00 0.00 H new ATOM 0 HA ILE A 4 7.077 -1.387 7.183 1.00 0.00 H new ATOM 0 HB ILE A 4 8.060 0.790 8.947 1.00 0.00 H new ATOM 0 HG12 ILE A 4 5.130 0.333 8.309 1.00 0.00 H new ATOM 0 HG13 ILE A 4 5.861 0.149 9.891 1.00 0.00 H new ATOM 0 HG21 ILE A 4 7.272 2.168 7.070 1.00 0.00 H new ATOM 0 HG22 ILE A 4 8.435 0.926 6.548 1.00 0.00 H new ATOM 0 HG23 ILE A 4 6.696 0.703 6.242 1.00 0.00 H new ATOM 0 HD11 ILE A 4 4.802 2.375 9.668 1.00 0.00 H new ATOM 0 HD12 ILE A 4 6.564 2.540 9.859 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.821 2.727 8.252 1.00 0.00 H new ATOM 79 N LEU A 5 9.316 -2.327 7.117 1.00 0.00 N ATOM 80 CA LEU A 5 10.683 -2.793 6.961 1.00 0.00 C ATOM 81 C LEU A 5 11.219 -2.342 5.600 1.00 0.00 C ATOM 82 O LEU A 5 10.448 -1.955 4.723 1.00 0.00 O ATOM 83 CB LEU A 5 10.761 -4.305 7.182 1.00 0.00 C ATOM 84 CG LEU A 5 9.640 -5.134 6.552 1.00 0.00 C ATOM 85 CD1 LEU A 5 10.128 -6.541 6.201 1.00 0.00 C ATOM 86 CD2 LEU A 5 8.406 -5.165 7.457 1.00 0.00 C ATOM 0 H LEU A 5 8.665 -2.669 6.410 1.00 0.00 H new ATOM 0 HA LEU A 5 11.326 -2.349 7.720 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.714 -4.661 6.789 1.00 0.00 H new ATOM 0 HB3 LEU A 5 10.767 -4.495 8.255 1.00 0.00 H new ATOM 0 HG LEU A 5 9.344 -4.654 5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.311 -7.109 5.755 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.953 -6.474 5.492 1.00 0.00 H new ATOM 0 HD13 LEU A 5 10.468 -7.045 7.106 1.00 0.00 H new ATOM 0 HD21 LEU A 5 7.624 -5.761 6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 5 8.670 -5.607 8.417 1.00 0.00 H new ATOM 0 HD23 LEU A 5 8.044 -4.149 7.613 1.00 0.00 H new ATOM 98 N GLY A 6 12.535 -2.407 5.468 1.00 0.00 N ATOM 99 CA GLY A 6 13.183 -2.010 4.229 1.00 0.00 C ATOM 100 C GLY A 6 13.538 -0.521 4.249 1.00 0.00 C ATOM 101 O GLY A 6 13.750 0.056 5.314 1.00 0.00 O ATOM 0 H GLY A 6 13.171 -2.728 6.198 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.087 -2.601 4.081 1.00 0.00 H new ATOM 0 HA3 GLY A 6 12.524 -2.219 3.386 1.00 0.00 H new ATOM 105 N GLU A 7 13.590 0.057 3.058 1.00 0.00 N ATOM 106 CA GLU A 7 13.915 1.467 2.925 1.00 0.00 C ATOM 107 C GLU A 7 13.383 2.011 1.597 1.00 0.00 C ATOM 108 O GLU A 7 13.341 1.293 0.600 1.00 0.00 O ATOM 109 CB GLU A 7 15.423 1.696 3.046 1.00 0.00 C ATOM 110 CG GLU A 7 16.203 0.630 2.273 1.00 0.00 C ATOM 111 CD GLU A 7 17.465 0.216 3.034 1.00 0.00 C ATOM 112 OE1 GLU A 7 18.002 1.008 3.821 1.00 0.00 O ATOM 113 OE2 GLU A 7 17.885 -0.978 2.783 1.00 0.00 O ATOM 0 H GLU A 7 13.413 -0.425 2.177 1.00 0.00 H new ATOM 0 HA GLU A 7 13.432 2.009 3.738 1.00 0.00 H new ATOM 0 HB2 GLU A 7 15.676 2.685 2.664 1.00 0.00 H new ATOM 0 HB3 GLU A 7 15.715 1.675 4.096 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.570 -0.242 2.109 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.476 1.015 1.290 1.00 0.00 H new ATOM 121 N GLY A 8 12.989 3.276 1.629 1.00 0.00 N ATOM 122 CA GLY A 8 12.461 3.925 0.440 1.00 0.00 C ATOM 123 C GLY A 8 11.340 4.901 0.802 1.00 0.00 C ATOM 124 O GLY A 8 10.471 4.583 1.612 1.00 0.00 O ATOM 0 H GLY A 8 13.025 3.868 2.459 1.00 0.00 H new ATOM 0 HA2 GLY A 8 13.261 4.458 -0.073 1.00 0.00 H new ATOM 0 HA3 GLY A 8 12.084 3.173 -0.253 1.00 0.00 H new ATOM 128 N LYS A 9 11.396 6.071 0.182 1.00 0.00 N ATOM 129 CA LYS A 9 10.396 7.097 0.428 1.00 0.00 C ATOM 130 C LYS A 9 9.015 6.445 0.520 1.00 0.00 C ATOM 131 O LYS A 9 8.456 6.021 -0.490 1.00 0.00 O ATOM 132 CB LYS A 9 10.487 8.198 -0.630 1.00 0.00 C ATOM 133 CG LYS A 9 10.343 9.583 0.006 1.00 0.00 C ATOM 134 CD LYS A 9 10.216 10.667 -1.066 1.00 0.00 C ATOM 135 CE LYS A 9 8.794 11.230 -1.111 1.00 0.00 C ATOM 136 NZ LYS A 9 8.740 12.435 -1.967 1.00 0.00 N ATOM 0 H LYS A 9 12.118 6.331 -0.490 1.00 0.00 H new ATOM 0 HA LYS A 9 10.581 7.589 1.383 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.443 8.130 -1.149 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.707 8.054 -1.378 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.466 9.601 0.652 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.208 9.789 0.637 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.923 11.471 -0.861 1.00 0.00 H new ATOM 0 HD3 LYS A 9 10.478 10.253 -2.040 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.109 10.474 -1.494 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.463 11.478 -0.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.768 12.804 -1.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 9.378 13.161 -1.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.036 12.188 -2.933 1.00 0.00 H new ATOM 149 N GLY A 10 8.505 6.385 1.742 1.00 0.00 N ATOM 150 CA GLY A 10 7.200 5.792 1.979 1.00 0.00 C ATOM 151 C GLY A 10 7.042 5.381 3.444 1.00 0.00 C ATOM 152 O GLY A 10 5.928 5.332 3.963 1.00 0.00 O ATOM 0 H GLY A 10 8.972 6.737 2.578 1.00 0.00 H new ATOM 0 HA2 GLY A 10 6.419 6.504 1.711 1.00 0.00 H new ATOM 0 HA3 GLY A 10 7.071 4.921 1.337 1.00 0.00 H new ATOM 156 N SER A 11 8.175 5.096 4.071 1.00 0.00 N ATOM 157 CA SER A 11 8.177 4.691 5.466 1.00 0.00 C ATOM 158 C SER A 11 7.474 5.749 6.319 1.00 0.00 C ATOM 159 O SER A 11 6.540 5.436 7.056 1.00 0.00 O ATOM 160 CB SER A 11 9.603 4.463 5.971 1.00 0.00 C ATOM 161 OG SER A 11 9.657 4.369 7.392 1.00 0.00 O ATOM 0 H SER A 11 9.097 5.138 3.638 1.00 0.00 H new ATOM 0 HA SER A 11 7.636 3.748 5.550 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.001 3.548 5.532 1.00 0.00 H new ATOM 0 HB3 SER A 11 10.241 5.281 5.637 1.00 0.00 H new ATOM 0 HG SER A 11 10.584 4.222 7.675 1.00 0.00 H new ATOM 167 N LYS A 12 7.950 6.978 6.191 1.00 0.00 N ATOM 168 CA LYS A 12 7.379 8.084 6.941 1.00 0.00 C ATOM 169 C LYS A 12 5.959 8.356 6.439 1.00 0.00 C ATOM 170 O LYS A 12 5.048 8.578 7.234 1.00 0.00 O ATOM 171 CB LYS A 12 8.298 9.306 6.878 1.00 0.00 C ATOM 172 CG LYS A 12 8.914 9.457 5.486 1.00 0.00 C ATOM 173 CD LYS A 12 9.247 10.920 5.189 1.00 0.00 C ATOM 174 CE LYS A 12 9.745 11.089 3.752 1.00 0.00 C ATOM 175 NZ LYS A 12 11.221 11.188 3.724 1.00 0.00 N ATOM 0 H LYS A 12 8.725 7.233 5.579 1.00 0.00 H new ATOM 0 HA LYS A 12 7.301 7.827 7.997 1.00 0.00 H new ATOM 0 HB2 LYS A 12 7.733 10.204 7.129 1.00 0.00 H new ATOM 0 HB3 LYS A 12 9.089 9.209 7.621 1.00 0.00 H new ATOM 0 HG2 LYS A 12 9.819 8.853 5.418 1.00 0.00 H new ATOM 0 HG3 LYS A 12 8.221 9.078 4.735 1.00 0.00 H new ATOM 0 HD2 LYS A 12 8.362 11.537 5.346 1.00 0.00 H new ATOM 0 HD3 LYS A 12 10.008 11.272 5.885 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.420 10.243 3.146 1.00 0.00 H new ATOM 0 HE3 LYS A 12 9.306 11.984 3.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 11.543 11.302 2.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 11.525 12.009 4.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 11.635 10.322 4.125 1.00 0.00 H new ATOM 188 N LEU A 13 5.816 8.329 5.122 1.00 0.00 N ATOM 189 CA LEU A 13 4.523 8.569 4.505 1.00 0.00 C ATOM 190 C LEU A 13 3.488 7.619 5.111 1.00 0.00 C ATOM 191 O LEU A 13 2.305 7.948 5.183 1.00 0.00 O ATOM 192 CB LEU A 13 4.630 8.471 2.982 1.00 0.00 C ATOM 193 CG LEU A 13 3.717 7.442 2.310 1.00 0.00 C ATOM 194 CD1 LEU A 13 2.244 7.807 2.505 1.00 0.00 C ATOM 195 CD2 LEU A 13 4.075 7.273 0.832 1.00 0.00 C ATOM 0 H LEU A 13 6.574 8.145 4.465 1.00 0.00 H new ATOM 0 HA LEU A 13 4.184 9.584 4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.413 9.452 2.559 1.00 0.00 H new ATOM 0 HB3 LEU A 13 5.662 8.234 2.725 1.00 0.00 H new ATOM 0 HG LEU A 13 3.877 6.477 2.792 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.617 7.060 2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.014 7.835 3.570 1.00 0.00 H new ATOM 0 HD13 LEU A 13 2.050 8.786 2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 13 3.411 6.537 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.962 8.228 0.319 1.00 0.00 H new ATOM 0 HD23 LEU A 13 5.107 6.934 0.744 1.00 0.00 H new ATOM 207 N LEU A 14 3.972 6.460 5.532 1.00 0.00 N ATOM 208 CA LEU A 14 3.104 5.460 6.131 1.00 0.00 C ATOM 209 C LEU A 14 2.785 5.864 7.572 1.00 0.00 C ATOM 210 O LEU A 14 1.623 5.872 7.975 1.00 0.00 O ATOM 211 CB LEU A 14 3.724 4.067 6.005 1.00 0.00 C ATOM 212 CG LEU A 14 2.740 2.898 5.937 1.00 0.00 C ATOM 213 CD1 LEU A 14 1.397 3.275 6.564 1.00 0.00 C ATOM 214 CD2 LEU A 14 2.582 2.397 4.500 1.00 0.00 C ATOM 0 H LEU A 14 4.954 6.191 5.470 1.00 0.00 H new ATOM 0 HA LEU A 14 2.155 5.410 5.597 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.344 4.047 5.109 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.388 3.908 6.855 1.00 0.00 H new ATOM 0 HG LEU A 14 3.148 2.074 6.522 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.716 2.426 6.503 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.547 3.545 7.609 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.970 4.122 6.028 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.877 1.566 4.480 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.208 3.205 3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.548 2.062 4.123 1.00 0.00 H new ATOM 226 N GLU A 15 3.837 6.189 8.308 1.00 0.00 N ATOM 227 CA GLU A 15 3.684 6.593 9.695 1.00 0.00 C ATOM 228 C GLU A 15 2.639 7.704 9.812 1.00 0.00 C ATOM 229 O GLU A 15 2.083 7.927 10.886 1.00 0.00 O ATOM 230 CB GLU A 15 5.024 7.035 10.288 1.00 0.00 C ATOM 231 CG GLU A 15 6.050 5.902 10.228 1.00 0.00 C ATOM 232 CD GLU A 15 7.074 6.029 11.359 1.00 0.00 C ATOM 233 OE1 GLU A 15 6.690 6.136 12.533 1.00 0.00 O ATOM 234 OE2 GLU A 15 8.307 6.014 10.982 1.00 0.00 O ATOM 0 H GLU A 15 4.799 6.181 7.970 1.00 0.00 H new ATOM 0 HA GLU A 15 3.337 5.733 10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.400 7.900 9.742 1.00 0.00 H new ATOM 0 HB3 GLU A 15 4.883 7.348 11.322 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.541 4.941 10.300 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.562 5.920 9.266 1.00 0.00 H new ATOM 242 N ASN A 16 2.403 8.371 8.692 1.00 0.00 N ATOM 243 CA ASN A 16 1.435 9.454 8.656 1.00 0.00 C ATOM 244 C ASN A 16 0.022 8.870 8.707 1.00 0.00 C ATOM 245 O ASN A 16 -0.798 9.289 9.523 1.00 0.00 O ATOM 246 CB ASN A 16 1.564 10.265 7.365 1.00 0.00 C ATOM 247 CG ASN A 16 2.663 11.323 7.490 1.00 0.00 C ATOM 248 OD1 ASN A 16 2.855 11.935 8.528 1.00 0.00 O ATOM 249 ND2 ASN A 16 3.370 11.503 6.378 1.00 0.00 N ATOM 0 H ASN A 16 2.865 8.182 7.803 1.00 0.00 H new ATOM 0 HA ASN A 16 1.623 10.104 9.511 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.789 9.598 6.533 1.00 0.00 H new ATOM 0 HB3 ASN A 16 0.613 10.748 7.138 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.126 12.187 6.360 1.00 0.00 H new ATOM 0 HD22 ASN A 16 3.156 10.957 5.544 1.00 0.00 H new ATOM 256 N LEU A 17 -0.221 7.911 7.825 1.00 0.00 N ATOM 257 CA LEU A 17 -1.521 7.265 7.760 1.00 0.00 C ATOM 258 C LEU A 17 -1.387 5.812 8.219 1.00 0.00 C ATOM 259 O LEU A 17 -1.983 4.913 7.628 1.00 0.00 O ATOM 260 CB LEU A 17 -2.124 7.416 6.362 1.00 0.00 C ATOM 261 CG LEU A 17 -1.126 7.472 5.204 1.00 0.00 C ATOM 262 CD1 LEU A 17 -0.402 6.134 5.038 1.00 0.00 C ATOM 263 CD2 LEU A 17 -1.813 7.916 3.910 1.00 0.00 C ATOM 0 H LEU A 17 0.461 7.566 7.149 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.223 7.750 8.439 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.804 6.582 6.189 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.724 8.326 6.343 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.369 8.220 5.441 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.301 6.201 4.208 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.139 5.897 5.954 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.130 5.349 4.833 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.082 7.948 3.102 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -2.603 7.209 3.657 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.244 8.908 4.049 1.00 0.00 H new ATOM 275 N LYS A 18 -0.601 5.627 9.270 1.00 0.00 N ATOM 276 CA LYS A 18 -0.382 4.298 9.815 1.00 0.00 C ATOM 277 C LYS A 18 -1.598 3.885 10.647 1.00 0.00 C ATOM 278 O LYS A 18 -2.029 2.734 10.595 1.00 0.00 O ATOM 279 CB LYS A 18 0.938 4.247 10.588 1.00 0.00 C ATOM 280 CG LYS A 18 1.861 3.164 10.025 1.00 0.00 C ATOM 281 CD LYS A 18 2.536 2.379 11.152 1.00 0.00 C ATOM 282 CE LYS A 18 3.551 3.249 11.895 1.00 0.00 C ATOM 283 NZ LYS A 18 4.207 2.475 12.973 1.00 0.00 N ATOM 0 H LYS A 18 -0.108 6.375 9.758 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.283 3.568 9.011 1.00 0.00 H new ATOM 0 HB2 LYS A 18 1.433 5.216 10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 18 0.739 4.049 11.641 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.288 2.483 9.396 1.00 0.00 H new ATOM 0 HG3 LYS A 18 2.620 3.622 9.390 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.781 2.017 11.851 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.036 1.502 10.740 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.302 3.619 11.197 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.051 4.121 12.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.893 3.081 13.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.489 2.143 13.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.701 1.657 12.562 1.00 0.00 H new ATOM 296 N GLU A 19 -2.117 4.848 11.395 1.00 0.00 N ATOM 297 CA GLU A 19 -3.275 4.599 12.237 1.00 0.00 C ATOM 298 C GLU A 19 -4.549 4.563 11.390 1.00 0.00 C ATOM 299 O GLU A 19 -5.552 3.978 11.796 1.00 0.00 O ATOM 300 CB GLU A 19 -3.383 5.648 13.345 1.00 0.00 C ATOM 301 CG GLU A 19 -3.469 7.059 12.758 1.00 0.00 C ATOM 302 CD GLU A 19 -4.291 7.979 13.663 1.00 0.00 C ATOM 303 OE1 GLU A 19 -3.829 8.353 14.751 1.00 0.00 O ATOM 304 OE2 GLU A 19 -5.449 8.307 13.199 1.00 0.00 O ATOM 0 H GLU A 19 -1.757 5.802 11.435 1.00 0.00 H new ATOM 0 HA GLU A 19 -3.151 3.627 12.714 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -4.265 5.449 13.954 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -2.518 5.577 14.004 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -2.466 7.467 12.633 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -3.922 7.018 11.767 1.00 0.00 H new ATOM 312 N LYS A 20 -4.467 5.195 10.229 1.00 0.00 N ATOM 313 CA LYS A 20 -5.601 5.243 9.322 1.00 0.00 C ATOM 314 C LYS A 20 -5.920 3.827 8.836 1.00 0.00 C ATOM 315 O LYS A 20 -7.084 3.484 8.633 1.00 0.00 O ATOM 316 CB LYS A 20 -5.339 6.237 8.189 1.00 0.00 C ATOM 317 CG LYS A 20 -6.495 7.230 8.053 1.00 0.00 C ATOM 318 CD LYS A 20 -7.822 6.501 7.834 1.00 0.00 C ATOM 319 CE LYS A 20 -9.008 7.408 8.168 1.00 0.00 C ATOM 320 NZ LYS A 20 -9.665 6.964 9.418 1.00 0.00 N ATOM 0 H LYS A 20 -3.633 5.678 9.895 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.487 5.611 9.839 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.412 6.777 8.381 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.206 5.698 7.251 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.558 7.845 8.951 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.304 7.904 7.218 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.893 6.171 6.798 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.857 5.607 8.457 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.667 8.438 8.276 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.726 7.394 7.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.305 7.710 9.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.210 6.097 9.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.942 6.772 10.141 1.00 0.00 H new ATOM 333 N LEU A 21 -4.866 3.044 8.664 1.00 0.00 N ATOM 334 CA LEU A 21 -5.019 1.673 8.206 1.00 0.00 C ATOM 335 C LEU A 21 -5.437 0.790 9.383 1.00 0.00 C ATOM 336 O LEU A 21 -6.094 -0.232 9.195 1.00 0.00 O ATOM 337 CB LEU A 21 -3.746 1.198 7.503 1.00 0.00 C ATOM 338 CG LEU A 21 -3.190 2.128 6.422 1.00 0.00 C ATOM 339 CD1 LEU A 21 -1.661 2.075 6.387 1.00 0.00 C ATOM 340 CD2 LEU A 21 -3.805 1.812 5.057 1.00 0.00 C ATOM 0 H LEU A 21 -3.902 3.332 8.833 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.811 1.607 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.973 1.047 8.257 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -3.945 0.226 7.051 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.472 3.150 6.673 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.291 2.745 5.610 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.264 2.386 7.353 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.337 1.057 6.172 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.393 2.487 4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.575 0.782 4.784 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -4.886 1.941 5.106 1.00 0.00 H new ATOM 352 N GLU A 22 -5.038 1.217 10.573 1.00 0.00 N ATOM 353 CA GLU A 22 -5.363 0.478 11.781 1.00 0.00 C ATOM 354 C GLU A 22 -6.880 0.379 11.950 1.00 0.00 C ATOM 355 O GLU A 22 -7.372 -0.473 12.688 1.00 0.00 O ATOM 356 CB GLU A 22 -4.715 1.122 13.008 1.00 0.00 C ATOM 357 CG GLU A 22 -3.227 0.776 13.088 1.00 0.00 C ATOM 358 CD GLU A 22 -2.843 0.326 14.499 1.00 0.00 C ATOM 359 OE1 GLU A 22 -3.396 -0.661 15.007 1.00 0.00 O ATOM 360 OE2 GLU A 22 -1.936 1.042 15.072 1.00 0.00 O ATOM 0 H GLU A 22 -4.493 2.065 10.726 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.961 -0.531 11.686 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -4.838 2.204 12.963 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.220 0.781 13.912 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -2.995 -0.015 12.375 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.632 1.645 12.805 1.00 0.00 H new ATOM 368 N GLU A 23 -7.580 1.263 11.254 1.00 0.00 N ATOM 369 CA GLU A 23 -9.032 1.286 11.318 1.00 0.00 C ATOM 370 C GLU A 23 -9.620 0.194 10.422 1.00 0.00 C ATOM 371 O GLU A 23 -10.397 -0.641 10.883 1.00 0.00 O ATOM 372 CB GLU A 23 -9.576 2.663 10.934 1.00 0.00 C ATOM 373 CG GLU A 23 -8.632 3.774 11.397 1.00 0.00 C ATOM 374 CD GLU A 23 -9.416 4.963 11.955 1.00 0.00 C ATOM 375 OE1 GLU A 23 -10.553 4.793 12.420 1.00 0.00 O ATOM 376 OE2 GLU A 23 -8.804 6.097 11.895 1.00 0.00 O ATOM 0 H GLU A 23 -7.169 1.969 10.643 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.334 1.087 12.346 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -9.706 2.718 9.853 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.560 2.807 11.381 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.957 3.388 12.161 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.013 4.102 10.562 1.00 0.00 H new ATOM 384 N ILE A 24 -9.227 0.236 9.157 1.00 0.00 N ATOM 385 CA ILE A 24 -9.705 -0.739 8.192 1.00 0.00 C ATOM 386 C ILE A 24 -9.490 -2.148 8.747 1.00 0.00 C ATOM 387 O ILE A 24 -10.411 -2.963 8.756 1.00 0.00 O ATOM 388 CB ILE A 24 -9.051 -0.509 6.828 1.00 0.00 C ATOM 389 CG1 ILE A 24 -7.530 -0.412 6.959 1.00 0.00 C ATOM 390 CG2 ILE A 24 -9.645 0.719 6.135 1.00 0.00 C ATOM 391 CD1 ILE A 24 -6.873 -0.208 5.592 1.00 0.00 C ATOM 0 H ILE A 24 -8.583 0.930 8.778 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.776 -0.620 8.030 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.266 -1.371 6.197 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -7.270 0.416 7.618 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.143 -1.320 7.421 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.163 0.860 5.168 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.715 0.572 5.989 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.481 1.601 6.754 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -5.792 -0.142 5.714 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.114 -1.050 4.943 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.244 0.714 5.144 1.00 0.00 H new ATOM 403 N VAL A 25 -8.268 -2.392 9.198 1.00 0.00 N ATOM 404 CA VAL A 25 -7.920 -3.688 9.753 1.00 0.00 C ATOM 405 C VAL A 25 -8.865 -4.012 10.912 1.00 0.00 C ATOM 406 O VAL A 25 -9.266 -5.162 11.087 1.00 0.00 O ATOM 407 CB VAL A 25 -6.445 -3.703 10.163 1.00 0.00 C ATOM 408 CG1 VAL A 25 -5.541 -3.928 8.950 1.00 0.00 C ATOM 409 CG2 VAL A 25 -6.068 -2.415 10.897 1.00 0.00 C ATOM 0 H VAL A 25 -7.507 -1.713 9.190 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.044 -4.470 9.004 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.296 -4.536 10.850 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.499 -3.934 9.269 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.785 -4.884 8.487 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.695 -3.126 8.228 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.015 -2.451 11.177 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.241 -1.560 10.243 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -6.679 -2.315 11.794 1.00 0.00 H new ATOM 419 N LYS A 26 -9.195 -2.979 11.672 1.00 0.00 N ATOM 420 CA LYS A 26 -10.086 -3.139 12.808 1.00 0.00 C ATOM 421 C LYS A 26 -11.457 -3.605 12.313 1.00 0.00 C ATOM 422 O LYS A 26 -12.011 -4.574 12.829 1.00 0.00 O ATOM 423 CB LYS A 26 -10.135 -1.854 13.636 1.00 0.00 C ATOM 424 CG LYS A 26 -10.296 -2.167 15.125 1.00 0.00 C ATOM 425 CD LYS A 26 -9.498 -1.182 15.982 1.00 0.00 C ATOM 426 CE LYS A 26 -9.046 -1.834 17.290 1.00 0.00 C ATOM 427 NZ LYS A 26 -10.079 -1.666 18.336 1.00 0.00 N ATOM 0 H LYS A 26 -8.861 -2.027 11.523 1.00 0.00 H new ATOM 0 HA LYS A 26 -9.711 -3.910 13.481 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -9.222 -1.280 13.478 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -10.964 -1.232 13.300 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.350 -2.121 15.398 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -9.959 -3.184 15.325 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.628 -0.833 15.426 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -10.109 -0.306 16.200 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.854 -2.894 17.127 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.109 -1.387 17.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.757 -2.114 19.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.243 -0.653 18.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -10.965 -2.113 18.024 1.00 0.00 H new ATOM 440 N LYS A 27 -11.966 -2.892 11.319 1.00 0.00 N ATOM 441 CA LYS A 27 -13.262 -3.220 10.749 1.00 0.00 C ATOM 442 C LYS A 27 -13.277 -4.695 10.344 1.00 0.00 C ATOM 443 O LYS A 27 -14.247 -5.404 10.606 1.00 0.00 O ATOM 444 CB LYS A 27 -13.600 -2.264 9.604 1.00 0.00 C ATOM 445 CG LYS A 27 -14.964 -2.599 8.995 1.00 0.00 C ATOM 446 CD LYS A 27 -15.439 -1.480 8.066 1.00 0.00 C ATOM 447 CE LYS A 27 -16.052 -0.328 8.865 1.00 0.00 C ATOM 448 NZ LYS A 27 -16.385 0.803 7.970 1.00 0.00 N ATOM 0 H LYS A 27 -11.504 -2.088 10.894 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.050 -3.085 11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -13.604 -1.238 9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.830 -2.325 8.835 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -14.898 -3.535 8.439 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -15.694 -2.751 9.790 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -14.600 -1.112 7.475 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -16.175 -1.873 7.364 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -16.951 -0.671 9.378 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -15.353 0.002 9.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.800 1.577 8.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -15.521 1.140 7.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -17.069 0.488 7.252 1.00 0.00 H new ATOM 461 N GLU A 28 -12.190 -5.113 9.712 1.00 0.00 N ATOM 462 CA GLU A 28 -12.067 -6.491 9.268 1.00 0.00 C ATOM 463 C GLU A 28 -11.949 -7.428 10.472 1.00 0.00 C ATOM 464 O GLU A 28 -12.796 -8.298 10.671 1.00 0.00 O ATOM 465 CB GLU A 28 -10.874 -6.659 8.325 1.00 0.00 C ATOM 466 CG GLU A 28 -10.985 -7.959 7.526 1.00 0.00 C ATOM 467 CD GLU A 28 -10.843 -9.178 8.439 1.00 0.00 C ATOM 468 OE1 GLU A 28 -11.844 -9.840 8.750 1.00 0.00 O ATOM 469 OE2 GLU A 28 -9.639 -9.429 8.829 1.00 0.00 O ATOM 0 H GLU A 28 -11.387 -4.522 9.497 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.967 -6.755 8.713 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -10.824 -5.811 7.642 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -9.948 -6.660 8.901 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -11.946 -7.994 7.014 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.213 -7.984 6.757 1.00 0.00 H new ATOM 477 N ILE A 29 -10.893 -7.219 11.244 1.00 0.00 N ATOM 478 CA ILE A 29 -10.653 -8.034 12.423 1.00 0.00 C ATOM 479 C ILE A 29 -9.886 -7.211 13.459 1.00 0.00 C ATOM 480 O ILE A 29 -10.314 -7.095 14.606 1.00 0.00 O ATOM 481 CB ILE A 29 -9.958 -9.341 12.038 1.00 0.00 C ATOM 482 CG1 ILE A 29 -9.739 -10.227 13.266 1.00 0.00 C ATOM 483 CG2 ILE A 29 -8.653 -9.068 11.288 1.00 0.00 C ATOM 484 CD1 ILE A 29 -9.086 -11.554 12.875 1.00 0.00 C ATOM 0 H ILE A 29 -10.193 -6.496 11.076 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.597 -8.326 12.883 1.00 0.00 H new ATOM 0 HB ILE A 29 -10.611 -9.888 11.358 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.109 -9.706 13.987 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -10.694 -10.418 13.756 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.179 -10.014 11.026 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -8.866 -8.505 10.379 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.982 -8.490 11.924 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.941 -12.165 13.766 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.730 -12.083 12.173 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -8.121 -11.361 12.407 1.00 0.00 H new ATOM 496 N GLY A 30 -8.764 -6.660 13.017 1.00 0.00 N ATOM 497 CA GLY A 30 -7.933 -5.851 13.892 1.00 0.00 C ATOM 498 C GLY A 30 -6.666 -6.608 14.299 1.00 0.00 C ATOM 499 O GLY A 30 -5.678 -5.999 14.706 1.00 0.00 O ATOM 0 H GLY A 30 -8.412 -6.758 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.661 -4.924 13.387 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -8.498 -5.574 14.782 1.00 0.00 H new ATOM 503 N ASP A 31 -6.737 -7.925 14.175 1.00 0.00 N ATOM 504 CA ASP A 31 -5.609 -8.771 14.524 1.00 0.00 C ATOM 505 C ASP A 31 -4.917 -9.246 13.245 1.00 0.00 C ATOM 506 O ASP A 31 -5.083 -10.394 12.835 1.00 0.00 O ATOM 507 CB ASP A 31 -6.067 -10.008 15.301 1.00 0.00 C ATOM 508 CG ASP A 31 -5.915 -9.910 16.820 1.00 0.00 C ATOM 509 OD1 ASP A 31 -6.908 -9.902 17.562 1.00 0.00 O ATOM 510 OD2 ASP A 31 -4.698 -9.840 17.242 1.00 0.00 O ATOM 0 H ASP A 31 -7.558 -8.427 13.838 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.929 -8.187 15.144 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -7.115 -10.198 15.067 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -5.500 -10.870 14.949 1.00 0.00 H new ATOM 516 N VAL A 32 -4.157 -8.339 12.649 1.00 0.00 N ATOM 517 CA VAL A 32 -3.440 -8.650 11.425 1.00 0.00 C ATOM 518 C VAL A 32 -2.030 -8.061 11.501 1.00 0.00 C ATOM 519 O VAL A 32 -1.706 -7.336 12.440 1.00 0.00 O ATOM 520 CB VAL A 32 -4.231 -8.153 10.214 1.00 0.00 C ATOM 521 CG1 VAL A 32 -3.960 -6.670 9.953 1.00 0.00 C ATOM 522 CG2 VAL A 32 -3.922 -8.994 8.974 1.00 0.00 C ATOM 0 H VAL A 32 -4.022 -7.388 12.992 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.336 -9.729 11.307 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.292 -8.265 10.438 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.535 -6.342 9.087 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.255 -6.087 10.826 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.897 -6.523 9.760 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.498 -8.619 8.128 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -2.858 -8.929 8.746 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -4.190 -10.033 9.163 1.00 0.00 H new ATOM 532 N HIS A 33 -1.229 -8.394 10.499 1.00 0.00 N ATOM 533 CA HIS A 33 0.139 -7.907 10.441 1.00 0.00 C ATOM 534 C HIS A 33 0.604 -7.859 8.984 1.00 0.00 C ATOM 535 O HIS A 33 0.853 -8.898 8.374 1.00 0.00 O ATOM 536 CB HIS A 33 1.055 -8.752 11.329 1.00 0.00 C ATOM 537 CG HIS A 33 0.470 -9.075 12.683 1.00 0.00 C ATOM 538 ND1 HIS A 33 0.609 -8.241 13.778 1.00 0.00 N ATOM 539 CD2 HIS A 33 -0.258 -10.149 13.106 1.00 0.00 C ATOM 540 CE1 HIS A 33 -0.010 -8.798 14.809 1.00 0.00 C ATOM 541 NE2 HIS A 33 -0.546 -9.980 14.390 1.00 0.00 N ATOM 0 H HIS A 33 -1.501 -8.995 9.721 1.00 0.00 H new ATOM 0 HA HIS A 33 0.185 -6.892 10.835 1.00 0.00 H new ATOM 0 HB2 HIS A 33 1.286 -9.684 10.813 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.998 -8.223 11.469 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -0.550 -10.993 12.499 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -0.078 -8.388 15.806 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -1.081 -10.628 14.969 1.00 0.00 H new ATOM 549 N VAL A 34 0.709 -6.643 8.469 1.00 0.00 N ATOM 550 CA VAL A 34 1.140 -6.446 7.096 1.00 0.00 C ATOM 551 C VAL A 34 2.530 -5.805 7.090 1.00 0.00 C ATOM 552 O VAL A 34 2.670 -4.616 7.369 1.00 0.00 O ATOM 553 CB VAL A 34 0.100 -5.624 6.333 1.00 0.00 C ATOM 554 CG1 VAL A 34 0.774 -4.609 5.407 1.00 0.00 C ATOM 555 CG2 VAL A 34 -0.851 -6.532 5.552 1.00 0.00 C ATOM 0 H VAL A 34 0.503 -5.784 8.979 1.00 0.00 H new ATOM 0 HA VAL A 34 1.220 -7.403 6.580 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.490 -5.070 7.063 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.012 -4.038 4.877 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.390 -3.931 5.997 1.00 0.00 H new ATOM 0 HG13 VAL A 34 1.401 -5.134 4.686 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.580 -5.922 5.019 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.282 -7.126 4.837 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.370 -7.196 6.243 1.00 0.00 H new ATOM 565 N ASN A 35 3.522 -6.623 6.768 1.00 0.00 N ATOM 566 CA ASN A 35 4.895 -6.151 6.721 1.00 0.00 C ATOM 567 C ASN A 35 5.219 -5.676 5.303 1.00 0.00 C ATOM 568 O ASN A 35 5.200 -6.466 4.361 1.00 0.00 O ATOM 569 CB ASN A 35 5.875 -7.270 7.080 1.00 0.00 C ATOM 570 CG ASN A 35 5.844 -7.566 8.581 1.00 0.00 C ATOM 571 OD1 ASN A 35 4.819 -7.474 9.237 1.00 0.00 O ATOM 572 ND2 ASN A 35 7.021 -7.925 9.086 1.00 0.00 N ATOM 0 H ASN A 35 3.402 -7.609 6.537 1.00 0.00 H new ATOM 0 HA ASN A 35 4.996 -5.338 7.440 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.622 -8.172 6.523 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.884 -6.984 6.783 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.105 -8.143 10.079 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.840 -7.982 8.480 1.00 0.00 H new ATOM 579 N VAL A 36 5.508 -4.388 5.197 1.00 0.00 N ATOM 580 CA VAL A 36 5.836 -3.798 3.910 1.00 0.00 C ATOM 581 C VAL A 36 7.352 -3.627 3.803 1.00 0.00 C ATOM 582 O VAL A 36 7.997 -3.172 4.747 1.00 0.00 O ATOM 583 CB VAL A 36 5.072 -2.485 3.726 1.00 0.00 C ATOM 584 CG1 VAL A 36 3.661 -2.586 4.310 1.00 0.00 C ATOM 585 CG2 VAL A 36 5.838 -1.314 4.343 1.00 0.00 C ATOM 0 H VAL A 36 5.522 -3.736 5.981 1.00 0.00 H new ATOM 0 HA VAL A 36 5.525 -4.456 3.099 1.00 0.00 H new ATOM 0 HB VAL A 36 4.980 -2.298 2.656 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.139 -1.640 4.166 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.114 -3.382 3.805 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.723 -2.808 5.375 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.273 -0.393 4.198 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.976 -1.491 5.410 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.812 -1.222 3.861 1.00 0.00 H new ATOM 595 N ILE A 37 7.878 -3.999 2.645 1.00 0.00 N ATOM 596 CA ILE A 37 9.307 -3.893 2.403 1.00 0.00 C ATOM 597 C ILE A 37 9.560 -2.830 1.332 1.00 0.00 C ATOM 598 O ILE A 37 9.287 -3.054 0.154 1.00 0.00 O ATOM 599 CB ILE A 37 9.896 -5.263 2.062 1.00 0.00 C ATOM 600 CG1 ILE A 37 9.507 -6.304 3.113 1.00 0.00 C ATOM 601 CG2 ILE A 37 11.412 -5.176 1.874 1.00 0.00 C ATOM 602 CD1 ILE A 37 8.368 -7.193 2.609 1.00 0.00 C ATOM 0 H ILE A 37 7.340 -4.374 1.864 1.00 0.00 H new ATOM 0 HA ILE A 37 9.824 -3.566 3.306 1.00 0.00 H new ATOM 0 HB ILE A 37 9.472 -5.591 1.113 1.00 0.00 H new ATOM 0 HG12 ILE A 37 10.372 -6.920 3.358 1.00 0.00 H new ATOM 0 HG13 ILE A 37 9.202 -5.802 4.032 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.806 -6.163 1.632 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.639 -4.486 1.061 1.00 0.00 H new ATOM 0 HG23 ILE A 37 11.873 -4.817 2.794 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.111 -7.924 3.375 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.496 -6.577 2.388 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.684 -7.712 1.704 1.00 0.00 H new ATOM 614 N LEU A 38 10.079 -1.696 1.780 1.00 0.00 N ATOM 615 CA LEU A 38 10.373 -0.599 0.874 1.00 0.00 C ATOM 616 C LEU A 38 11.702 -0.868 0.167 1.00 0.00 C ATOM 617 O LEU A 38 12.738 -1.005 0.816 1.00 0.00 O ATOM 618 CB LEU A 38 10.332 0.737 1.620 1.00 0.00 C ATOM 619 CG LEU A 38 9.110 0.971 2.510 1.00 0.00 C ATOM 620 CD1 LEU A 38 9.384 2.069 3.540 1.00 0.00 C ATOM 621 CD2 LEU A 38 7.868 1.271 1.669 1.00 0.00 C ATOM 0 H LEU A 38 10.303 -1.513 2.758 1.00 0.00 H new ATOM 0 HA LEU A 38 9.609 -0.530 0.100 1.00 0.00 H new ATOM 0 HB2 LEU A 38 11.227 0.813 2.238 1.00 0.00 H new ATOM 0 HB3 LEU A 38 10.382 1.542 0.887 1.00 0.00 H new ATOM 0 HG LEU A 38 8.910 0.053 3.063 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.499 2.215 4.160 1.00 0.00 H new ATOM 0 HD12 LEU A 38 10.224 1.776 4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.624 2.999 3.025 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.014 1.433 2.326 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.041 2.166 1.071 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.663 0.428 1.009 1.00 0.00 H new ATOM 633 N VAL A 39 11.630 -0.935 -1.154 1.00 0.00 N ATOM 634 CA VAL A 39 12.816 -1.186 -1.957 1.00 0.00 C ATOM 635 C VAL A 39 12.726 -0.383 -3.256 1.00 0.00 C ATOM 636 O VAL A 39 11.656 -0.283 -3.855 1.00 0.00 O ATOM 637 CB VAL A 39 12.980 -2.689 -2.193 1.00 0.00 C ATOM 638 CG1 VAL A 39 13.034 -3.449 -0.866 1.00 0.00 C ATOM 639 CG2 VAL A 39 11.863 -3.228 -3.089 1.00 0.00 C ATOM 0 H VAL A 39 10.769 -0.820 -1.689 1.00 0.00 H new ATOM 0 HA VAL A 39 13.711 -0.854 -1.431 1.00 0.00 H new ATOM 0 HB VAL A 39 13.928 -2.846 -2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 39 13.151 -4.515 -1.062 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.879 -3.093 -0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 39 12.110 -3.281 -0.313 1.00 0.00 H new ATOM 0 HG21 VAL A 39 12.003 -4.298 -3.241 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.898 -3.052 -2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.891 -2.718 -4.052 1.00 0.00 H new ATOM 649 N SER A 40 13.863 0.169 -3.653 1.00 0.00 N ATOM 650 CA SER A 40 13.926 0.960 -4.870 1.00 0.00 C ATOM 651 C SER A 40 13.831 0.046 -6.094 1.00 0.00 C ATOM 652 O SER A 40 13.492 -1.130 -5.970 1.00 0.00 O ATOM 653 CB SER A 40 15.213 1.786 -4.924 1.00 0.00 C ATOM 654 OG SER A 40 16.373 0.963 -5.011 1.00 0.00 O ATOM 0 H SER A 40 14.748 0.084 -3.153 1.00 0.00 H new ATOM 0 HA SER A 40 13.082 1.650 -4.873 1.00 0.00 H new ATOM 0 HB2 SER A 40 15.178 2.455 -5.784 1.00 0.00 H new ATOM 0 HB3 SER A 40 15.279 2.413 -4.035 1.00 0.00 H new ATOM 0 HG SER A 40 17.173 1.528 -5.045 1.00 0.00 H new ATOM 660 N GLU A 41 14.136 0.621 -7.248 1.00 0.00 N ATOM 661 CA GLU A 41 14.089 -0.127 -8.492 1.00 0.00 C ATOM 662 C GLU A 41 15.288 -1.072 -8.590 1.00 0.00 C ATOM 663 O GLU A 41 15.149 -2.214 -9.022 1.00 0.00 O ATOM 664 CB GLU A 41 14.034 0.816 -9.697 1.00 0.00 C ATOM 665 CG GLU A 41 14.049 0.029 -11.009 1.00 0.00 C ATOM 666 CD GLU A 41 13.977 0.971 -12.213 1.00 0.00 C ATOM 667 OE1 GLU A 41 14.487 2.099 -12.149 1.00 0.00 O ATOM 668 OE2 GLU A 41 13.364 0.493 -13.243 1.00 0.00 O ATOM 0 H GLU A 41 14.417 1.597 -7.347 1.00 0.00 H new ATOM 0 HA GLU A 41 13.178 -0.726 -8.498 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.132 1.426 -9.645 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.883 1.499 -9.668 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.956 -0.572 -11.067 1.00 0.00 H new ATOM 0 HG3 GLU A 41 13.207 -0.662 -11.032 1.00 0.00 H new ATOM 676 N ASP A 42 16.439 -0.559 -8.180 1.00 0.00 N ATOM 677 CA ASP A 42 17.662 -1.343 -8.215 1.00 0.00 C ATOM 678 C ASP A 42 17.635 -2.374 -7.084 1.00 0.00 C ATOM 679 O ASP A 42 18.231 -3.444 -7.201 1.00 0.00 O ATOM 680 CB ASP A 42 18.892 -0.455 -8.015 1.00 0.00 C ATOM 681 CG ASP A 42 19.825 -0.362 -9.224 1.00 0.00 C ATOM 682 OD1 ASP A 42 19.472 0.220 -10.261 1.00 0.00 O ATOM 683 OD2 ASP A 42 20.975 -0.926 -9.069 1.00 0.00 O ATOM 0 H ASP A 42 16.550 0.390 -7.822 1.00 0.00 H new ATOM 0 HA ASP A 42 17.722 -1.829 -9.189 1.00 0.00 H new ATOM 0 HB2 ASP A 42 18.558 0.549 -7.754 1.00 0.00 H new ATOM 0 HB3 ASP A 42 19.460 -0.833 -7.165 1.00 0.00 H new ATOM 689 N GLU A 43 16.937 -2.015 -6.016 1.00 0.00 N ATOM 690 CA GLU A 43 16.825 -2.896 -4.866 1.00 0.00 C ATOM 691 C GLU A 43 15.758 -3.963 -5.117 1.00 0.00 C ATOM 692 O GLU A 43 15.934 -5.122 -4.745 1.00 0.00 O ATOM 693 CB GLU A 43 16.517 -2.101 -3.595 1.00 0.00 C ATOM 694 CG GLU A 43 17.757 -1.349 -3.105 1.00 0.00 C ATOM 695 CD GLU A 43 18.694 -2.281 -2.335 1.00 0.00 C ATOM 696 OE1 GLU A 43 18.256 -2.966 -1.399 1.00 0.00 O ATOM 697 OE2 GLU A 43 19.919 -2.279 -2.740 1.00 0.00 O ATOM 0 H GLU A 43 16.444 -1.127 -5.923 1.00 0.00 H new ATOM 0 HA GLU A 43 17.783 -3.395 -4.720 1.00 0.00 H new ATOM 0 HB2 GLU A 43 15.712 -1.393 -3.791 1.00 0.00 H new ATOM 0 HB3 GLU A 43 16.165 -2.777 -2.815 1.00 0.00 H new ATOM 0 HG2 GLU A 43 18.285 -0.918 -3.956 1.00 0.00 H new ATOM 0 HG3 GLU A 43 17.455 -0.521 -2.464 1.00 0.00 H new ATOM 705 N ILE A 44 14.673 -3.534 -5.746 1.00 0.00 N ATOM 706 CA ILE A 44 13.578 -4.438 -6.050 1.00 0.00 C ATOM 707 C ILE A 44 14.002 -5.385 -7.175 1.00 0.00 C ATOM 708 O ILE A 44 13.817 -6.597 -7.073 1.00 0.00 O ATOM 709 CB ILE A 44 12.303 -3.650 -6.358 1.00 0.00 C ATOM 710 CG1 ILE A 44 11.085 -4.576 -6.408 1.00 0.00 C ATOM 711 CG2 ILE A 44 12.457 -2.836 -7.644 1.00 0.00 C ATOM 712 CD1 ILE A 44 9.891 -3.950 -5.686 1.00 0.00 C ATOM 0 H ILE A 44 14.530 -2.572 -6.053 1.00 0.00 H new ATOM 0 HA ILE A 44 13.342 -5.056 -5.184 1.00 0.00 H new ATOM 0 HB ILE A 44 12.136 -2.941 -5.547 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.821 -4.780 -7.446 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.332 -5.533 -5.948 1.00 0.00 H new ATOM 0 HG21 ILE A 44 11.536 -2.286 -7.839 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.283 -2.133 -7.533 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.662 -3.508 -8.478 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.039 -4.628 -5.736 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.150 -3.770 -4.643 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.631 -3.005 -6.164 1.00 0.00 H new ATOM 724 N LYS A 45 14.561 -4.797 -8.222 1.00 0.00 N ATOM 725 CA LYS A 45 15.013 -5.573 -9.364 1.00 0.00 C ATOM 726 C LYS A 45 15.842 -6.761 -8.872 1.00 0.00 C ATOM 727 O LYS A 45 15.625 -7.893 -9.301 1.00 0.00 O ATOM 728 CB LYS A 45 15.752 -4.678 -10.361 1.00 0.00 C ATOM 729 CG LYS A 45 17.165 -4.359 -9.868 1.00 0.00 C ATOM 730 CD LYS A 45 17.991 -3.688 -10.968 1.00 0.00 C ATOM 731 CE LYS A 45 19.296 -3.122 -10.405 1.00 0.00 C ATOM 732 NZ LYS A 45 20.438 -3.987 -10.776 1.00 0.00 N ATOM 0 H LYS A 45 14.711 -3.791 -8.304 1.00 0.00 H new ATOM 0 HA LYS A 45 14.162 -5.982 -9.908 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.804 -5.173 -11.331 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.196 -3.752 -10.506 1.00 0.00 H new ATOM 0 HG2 LYS A 45 17.111 -3.705 -8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 45 17.658 -5.277 -9.547 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.213 -4.411 -11.753 1.00 0.00 H new ATOM 0 HD3 LYS A 45 17.411 -2.887 -11.426 1.00 0.00 H new ATOM 0 HE2 LYS A 45 19.457 -2.114 -10.787 1.00 0.00 H new ATOM 0 HE3 LYS A 45 19.228 -3.045 -9.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 21.316 -3.589 -10.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 20.290 -4.942 -10.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 20.512 -4.039 -11.812 1.00 0.00 H new ATOM 745 N GLU A 46 16.773 -6.463 -7.979 1.00 0.00 N ATOM 746 CA GLU A 46 17.635 -7.492 -7.424 1.00 0.00 C ATOM 747 C GLU A 46 16.859 -8.354 -6.426 1.00 0.00 C ATOM 748 O GLU A 46 16.884 -9.581 -6.508 1.00 0.00 O ATOM 749 CB GLU A 46 18.874 -6.876 -6.769 1.00 0.00 C ATOM 750 CG GLU A 46 19.741 -6.157 -7.805 1.00 0.00 C ATOM 751 CD GLU A 46 21.196 -6.620 -7.718 1.00 0.00 C ATOM 752 OE1 GLU A 46 21.635 -7.444 -8.535 1.00 0.00 O ATOM 753 OE2 GLU A 46 21.880 -6.093 -6.760 1.00 0.00 O ATOM 0 H GLU A 46 16.950 -5.523 -7.625 1.00 0.00 H new ATOM 0 HA GLU A 46 17.975 -8.131 -8.239 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.569 -6.173 -5.994 1.00 0.00 H new ATOM 0 HB3 GLU A 46 19.457 -7.656 -6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 46 19.354 -6.350 -8.805 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.688 -5.080 -7.645 1.00 0.00 H new ATOM 761 N LEU A 47 16.187 -7.677 -5.506 1.00 0.00 N ATOM 762 CA LEU A 47 15.405 -8.365 -4.493 1.00 0.00 C ATOM 763 C LEU A 47 14.519 -9.416 -5.166 1.00 0.00 C ATOM 764 O LEU A 47 14.401 -10.538 -4.677 1.00 0.00 O ATOM 765 CB LEU A 47 14.627 -7.360 -3.641 1.00 0.00 C ATOM 766 CG LEU A 47 13.884 -7.936 -2.435 1.00 0.00 C ATOM 767 CD1 LEU A 47 12.860 -8.985 -2.872 1.00 0.00 C ATOM 768 CD2 LEU A 47 14.864 -8.489 -1.399 1.00 0.00 C ATOM 0 H LEU A 47 16.168 -6.659 -5.441 1.00 0.00 H new ATOM 0 HA LEU A 47 16.060 -8.894 -3.801 1.00 0.00 H new ATOM 0 HB2 LEU A 47 15.323 -6.600 -3.285 1.00 0.00 H new ATOM 0 HB3 LEU A 47 13.904 -6.855 -4.281 1.00 0.00 H new ATOM 0 HG LEU A 47 13.332 -7.127 -1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 47 12.346 -9.379 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU A 47 12.134 -8.527 -3.544 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.370 -9.798 -3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.309 -8.892 -0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 47 15.463 -9.280 -1.850 1.00 0.00 H new ATOM 0 HD23 LEU A 47 15.520 -7.689 -1.055 1.00 0.00 H new ATOM 780 N ASN A 48 13.919 -9.014 -6.277 1.00 0.00 N ATOM 781 CA ASN A 48 13.047 -9.907 -7.021 1.00 0.00 C ATOM 782 C ASN A 48 13.782 -11.221 -7.293 1.00 0.00 C ATOM 783 O ASN A 48 13.189 -12.296 -7.214 1.00 0.00 O ATOM 784 CB ASN A 48 12.656 -9.297 -8.369 1.00 0.00 C ATOM 785 CG ASN A 48 11.260 -9.758 -8.794 1.00 0.00 C ATOM 786 OD1 ASN A 48 10.779 -10.809 -8.404 1.00 0.00 O ATOM 787 ND2 ASN A 48 10.639 -8.915 -9.614 1.00 0.00 N ATOM 0 H ASN A 48 14.020 -8.082 -6.680 1.00 0.00 H new ATOM 0 HA ASN A 48 12.149 -10.075 -6.426 1.00 0.00 H new ATOM 0 HB2 ASN A 48 12.679 -8.209 -8.301 1.00 0.00 H new ATOM 0 HB3 ASN A 48 13.384 -9.584 -9.127 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.703 -9.132 -9.955 1.00 0.00 H new ATOM 0 HD22 ASN A 48 11.099 -8.051 -9.902 1.00 0.00 H new ATOM 794 N GLN A 49 15.063 -11.092 -7.607 1.00 0.00 N ATOM 795 CA GLN A 49 15.885 -12.256 -7.891 1.00 0.00 C ATOM 796 C GLN A 49 16.383 -12.884 -6.587 1.00 0.00 C ATOM 797 O GLN A 49 16.688 -14.075 -6.545 1.00 0.00 O ATOM 798 CB GLN A 49 17.056 -11.890 -8.805 1.00 0.00 C ATOM 799 CG GLN A 49 18.218 -12.869 -8.625 1.00 0.00 C ATOM 800 CD GLN A 49 19.209 -12.762 -9.786 1.00 0.00 C ATOM 801 OE1 GLN A 49 18.996 -12.052 -10.755 1.00 0.00 O ATOM 802 NE2 GLN A 49 20.302 -13.505 -9.635 1.00 0.00 N ATOM 0 H GLN A 49 15.552 -10.199 -7.671 1.00 0.00 H new ATOM 0 HA GLN A 49 15.273 -12.990 -8.415 1.00 0.00 H new ATOM 0 HB2 GLN A 49 16.727 -11.897 -9.844 1.00 0.00 H new ATOM 0 HB3 GLN A 49 17.392 -10.877 -8.584 1.00 0.00 H new ATOM 0 HG2 GLN A 49 18.730 -12.663 -7.685 1.00 0.00 H new ATOM 0 HG3 GLN A 49 17.834 -13.887 -8.562 1.00 0.00 H new ATOM 0 HE21 GLN A 49 20.418 -14.077 -8.799 1.00 0.00 H new ATOM 0 HE22 GLN A 49 21.024 -13.502 -10.355 1.00 0.00 H new ATOM 811 N GLN A 50 16.449 -12.056 -5.556 1.00 0.00 N ATOM 812 CA GLN A 50 16.904 -12.515 -4.255 1.00 0.00 C ATOM 813 C GLN A 50 15.997 -13.635 -3.740 1.00 0.00 C ATOM 814 O GLN A 50 16.404 -14.428 -2.892 1.00 0.00 O ATOM 815 CB GLN A 50 16.967 -11.358 -3.255 1.00 0.00 C ATOM 816 CG GLN A 50 18.072 -10.369 -3.631 1.00 0.00 C ATOM 817 CD GLN A 50 18.382 -9.425 -2.468 1.00 0.00 C ATOM 818 OE1 GLN A 50 18.380 -9.805 -1.309 1.00 0.00 O ATOM 819 NE2 GLN A 50 18.646 -8.176 -2.840 1.00 0.00 N ATOM 0 H GLN A 50 16.195 -11.069 -5.595 1.00 0.00 H new ATOM 0 HA GLN A 50 17.913 -12.912 -4.365 1.00 0.00 H new ATOM 0 HB2 GLN A 50 16.007 -10.843 -3.228 1.00 0.00 H new ATOM 0 HB3 GLN A 50 17.148 -11.748 -2.253 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.973 -10.914 -3.911 1.00 0.00 H new ATOM 0 HG3 GLN A 50 17.766 -9.790 -4.502 1.00 0.00 H new ATOM 0 HE21 GLN A 50 18.631 -7.924 -3.828 1.00 0.00 H new ATOM 0 HE22 GLN A 50 18.864 -7.470 -2.137 1.00 0.00 H new ATOM 828 N PHE A 51 14.786 -13.665 -4.275 1.00 0.00 N ATOM 829 CA PHE A 51 13.818 -14.674 -3.881 1.00 0.00 C ATOM 830 C PHE A 51 13.224 -15.373 -5.106 1.00 0.00 C ATOM 831 O PHE A 51 13.221 -16.600 -5.184 1.00 0.00 O ATOM 832 CB PHE A 51 12.699 -13.952 -3.128 1.00 0.00 C ATOM 833 CG PHE A 51 13.160 -13.259 -1.844 1.00 0.00 C ATOM 834 CD1 PHE A 51 13.990 -13.906 -0.982 1.00 0.00 C ATOM 835 CD2 PHE A 51 12.739 -11.997 -1.563 1.00 0.00 C ATOM 836 CE1 PHE A 51 14.417 -13.263 0.210 1.00 0.00 C ATOM 837 CE2 PHE A 51 13.166 -11.354 -0.371 1.00 0.00 C ATOM 838 CZ PHE A 51 13.996 -12.001 0.490 1.00 0.00 C ATOM 0 H PHE A 51 14.453 -13.006 -4.979 1.00 0.00 H new ATOM 0 HA PHE A 51 14.301 -15.431 -3.263 1.00 0.00 H new ATOM 0 HB2 PHE A 51 12.251 -13.210 -3.788 1.00 0.00 H new ATOM 0 HB3 PHE A 51 11.918 -14.671 -2.880 1.00 0.00 H new ATOM 0 HD1 PHE A 51 14.324 -14.909 -1.204 1.00 0.00 H new ATOM 0 HD2 PHE A 51 12.079 -11.483 -2.247 1.00 0.00 H new ATOM 0 HE1 PHE A 51 15.076 -13.777 0.894 1.00 0.00 H new ATOM 0 HE2 PHE A 51 12.832 -10.351 -0.148 1.00 0.00 H new ATOM 0 HZ PHE A 51 14.321 -11.512 1.397 1.00 0.00 H new ATOM 848 N ARG A 52 12.735 -14.560 -6.031 1.00 0.00 N ATOM 849 CA ARG A 52 12.140 -15.085 -7.248 1.00 0.00 C ATOM 850 C ARG A 52 13.220 -15.680 -8.154 1.00 0.00 C ATOM 851 O ARG A 52 12.939 -16.562 -8.964 1.00 0.00 O ATOM 852 CB ARG A 52 11.391 -13.990 -8.011 1.00 0.00 C ATOM 853 CG ARG A 52 10.106 -14.537 -8.635 1.00 0.00 C ATOM 854 CD ARG A 52 9.054 -14.825 -7.562 1.00 0.00 C ATOM 855 NE ARG A 52 7.883 -15.497 -8.168 1.00 0.00 N ATOM 856 CZ ARG A 52 6.919 -16.122 -7.459 1.00 0.00 C ATOM 857 NH1 ARG A 52 6.979 -16.166 -6.112 1.00 0.00 N ATOM 858 NH2 ARG A 52 5.917 -16.689 -8.105 1.00 0.00 N ATOM 0 H ARG A 52 12.739 -13.542 -5.962 1.00 0.00 H new ATOM 0 HA ARG A 52 11.432 -15.863 -6.962 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.150 -13.170 -7.334 1.00 0.00 H new ATOM 0 HB3 ARG A 52 12.033 -13.581 -8.791 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.711 -13.818 -9.352 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.326 -15.450 -9.188 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.481 -15.455 -6.782 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.744 -13.895 -7.086 1.00 0.00 H new ATOM 0 HE ARG A 52 7.799 -15.487 -9.184 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.757 -15.725 -5.621 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.246 -16.640 -5.584 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.880 -16.651 -9.124 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.180 -17.166 -7.586 1.00 0.00 H new ATOM 871 N GLY A 53 14.433 -15.175 -7.985 1.00 0.00 N ATOM 872 CA GLY A 53 15.557 -15.646 -8.777 1.00 0.00 C ATOM 873 C GLY A 53 15.587 -14.963 -10.146 1.00 0.00 C ATOM 874 O GLY A 53 16.540 -15.130 -10.905 1.00 0.00 O ATOM 0 H GLY A 53 14.662 -14.444 -7.311 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.489 -15.448 -8.247 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.488 -16.726 -8.907 1.00 0.00 H new ATOM 878 N GLN A 54 14.533 -14.208 -10.419 1.00 0.00 N ATOM 879 CA GLN A 54 14.427 -13.500 -11.683 1.00 0.00 C ATOM 880 C GLN A 54 14.921 -12.060 -11.527 1.00 0.00 C ATOM 881 O GLN A 54 14.659 -11.417 -10.511 1.00 0.00 O ATOM 882 CB GLN A 54 12.992 -13.533 -12.212 1.00 0.00 C ATOM 883 CG GLN A 54 12.736 -14.805 -13.022 1.00 0.00 C ATOM 884 CD GLN A 54 11.538 -14.627 -13.958 1.00 0.00 C ATOM 885 OE1 GLN A 54 10.486 -14.142 -13.576 1.00 0.00 O ATOM 886 NE2 GLN A 54 11.756 -15.047 -15.201 1.00 0.00 N ATOM 0 H GLN A 54 13.745 -14.071 -9.786 1.00 0.00 H new ATOM 0 HA GLN A 54 15.060 -14.004 -12.414 1.00 0.00 H new ATOM 0 HB2 GLN A 54 12.292 -13.481 -11.378 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.810 -12.658 -12.836 1.00 0.00 H new ATOM 0 HG2 GLN A 54 13.623 -15.054 -13.604 1.00 0.00 H new ATOM 0 HG3 GLN A 54 12.553 -15.640 -12.346 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.661 -15.443 -15.454 1.00 0.00 H new ATOM 0 HE22 GLN A 54 11.018 -14.973 -15.901 1.00 0.00 H new ATOM 895 N ASP A 55 15.626 -11.596 -12.548 1.00 0.00 N ATOM 896 CA ASP A 55 16.158 -10.244 -12.537 1.00 0.00 C ATOM 897 C ASP A 55 15.238 -9.331 -13.350 1.00 0.00 C ATOM 898 O ASP A 55 15.359 -9.251 -14.572 1.00 0.00 O ATOM 899 CB ASP A 55 17.551 -10.195 -13.169 1.00 0.00 C ATOM 900 CG ASP A 55 18.461 -9.084 -12.642 1.00 0.00 C ATOM 901 OD1 ASP A 55 18.266 -8.571 -11.531 1.00 0.00 O ATOM 902 OD2 ASP A 55 19.419 -8.742 -13.436 1.00 0.00 O ATOM 0 H ASP A 55 15.841 -12.132 -13.389 1.00 0.00 H new ATOM 0 HA ASP A 55 16.220 -9.915 -11.500 1.00 0.00 H new ATOM 0 HB2 ASP A 55 18.042 -11.154 -13.005 1.00 0.00 H new ATOM 0 HB3 ASP A 55 17.441 -10.073 -14.247 1.00 0.00 H new ATOM 908 N ARG A 56 14.339 -8.666 -12.640 1.00 0.00 N ATOM 909 CA ARG A 56 13.399 -7.763 -13.280 1.00 0.00 C ATOM 910 C ARG A 56 12.578 -7.016 -12.227 1.00 0.00 C ATOM 911 O ARG A 56 11.912 -7.636 -11.399 1.00 0.00 O ATOM 912 CB ARG A 56 12.451 -8.522 -14.210 1.00 0.00 C ATOM 913 CG ARG A 56 11.615 -9.539 -13.430 1.00 0.00 C ATOM 914 CD ARG A 56 10.160 -9.080 -13.316 1.00 0.00 C ATOM 915 NE ARG A 56 9.348 -10.129 -12.660 1.00 0.00 N ATOM 916 CZ ARG A 56 7.998 -10.162 -12.675 1.00 0.00 C ATOM 917 NH1 ARG A 56 7.297 -9.202 -13.314 1.00 0.00 N ATOM 918 NH2 ARG A 56 7.375 -11.147 -12.056 1.00 0.00 N ATOM 0 H ARG A 56 14.242 -8.735 -11.627 1.00 0.00 H new ATOM 0 HA ARG A 56 13.975 -7.050 -13.870 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.792 -7.817 -14.718 1.00 0.00 H new ATOM 0 HB3 ARG A 56 13.026 -9.034 -14.982 1.00 0.00 H new ATOM 0 HG2 ARG A 56 11.657 -10.508 -13.928 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.037 -9.674 -12.434 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.106 -8.155 -12.742 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.759 -8.865 -14.307 1.00 0.00 H new ATOM 0 HE ARG A 56 9.839 -10.874 -12.165 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.787 -8.444 -13.790 1.00 0.00 H new ATOM 0 HH12 ARG A 56 6.278 -9.234 -13.321 1.00 0.00 H new ATOM 0 HH21 ARG A 56 7.913 -11.869 -11.576 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.356 -11.187 -12.058 1.00 0.00 H new ATOM 931 N PRO A 57 12.656 -5.659 -12.293 1.00 0.00 N ATOM 932 CA PRO A 57 11.929 -4.822 -11.355 1.00 0.00 C ATOM 933 C PRO A 57 10.437 -4.788 -11.692 1.00 0.00 C ATOM 934 O PRO A 57 10.021 -5.288 -12.736 1.00 0.00 O ATOM 935 CB PRO A 57 12.591 -3.457 -11.452 1.00 0.00 C ATOM 936 CG PRO A 57 13.353 -3.455 -12.767 1.00 0.00 C ATOM 937 CD PRO A 57 13.435 -4.891 -13.260 1.00 0.00 C ATOM 0 HA PRO A 57 11.972 -5.200 -10.333 1.00 0.00 H new ATOM 0 HB2 PRO A 57 11.848 -2.660 -11.430 1.00 0.00 H new ATOM 0 HB3 PRO A 57 13.263 -3.289 -10.611 1.00 0.00 H new ATOM 0 HG2 PRO A 57 12.847 -2.828 -13.501 1.00 0.00 H new ATOM 0 HG3 PRO A 57 14.352 -3.041 -12.629 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.026 -4.989 -14.265 1.00 0.00 H new ATOM 0 HD3 PRO A 57 14.468 -5.237 -13.301 1.00 0.00 H new ATOM 945 N THR A 58 9.672 -4.192 -10.789 1.00 0.00 N ATOM 946 CA THR A 58 8.235 -4.087 -10.978 1.00 0.00 C ATOM 947 C THR A 58 7.653 -3.014 -10.055 1.00 0.00 C ATOM 948 O THR A 58 8.352 -2.489 -9.190 1.00 0.00 O ATOM 949 CB THR A 58 7.626 -5.473 -10.758 1.00 0.00 C ATOM 950 OG1 THR A 58 6.220 -5.239 -10.762 1.00 0.00 O ATOM 951 CG2 THR A 58 7.908 -6.020 -9.357 1.00 0.00 C ATOM 0 H THR A 58 10.020 -3.777 -9.925 1.00 0.00 H new ATOM 0 HA THR A 58 7.992 -3.767 -11.991 1.00 0.00 H new ATOM 0 HB THR A 58 8.018 -6.164 -11.504 1.00 0.00 H new ATOM 0 HG1 THR A 58 5.747 -6.087 -10.627 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.454 -7.006 -9.253 1.00 0.00 H new ATOM 0 HG22 THR A 58 8.985 -6.099 -9.207 1.00 0.00 H new ATOM 0 HG23 THR A 58 7.486 -5.346 -8.612 1.00 0.00 H new ATOM 959 N ASP A 59 6.380 -2.719 -10.272 1.00 0.00 N ATOM 960 CA ASP A 59 5.696 -1.718 -9.471 1.00 0.00 C ATOM 961 C ASP A 59 5.753 -2.125 -7.997 1.00 0.00 C ATOM 962 O ASP A 59 6.493 -1.532 -7.214 1.00 0.00 O ATOM 963 CB ASP A 59 4.225 -1.602 -9.872 1.00 0.00 C ATOM 964 CG ASP A 59 3.370 -0.729 -8.952 1.00 0.00 C ATOM 965 OD1 ASP A 59 3.451 -0.830 -7.719 1.00 0.00 O ATOM 966 OD2 ASP A 59 2.584 0.096 -9.558 1.00 0.00 O ATOM 0 H ASP A 59 5.804 -3.156 -10.991 1.00 0.00 H new ATOM 0 HA ASP A 59 6.191 -0.760 -9.634 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.171 -1.199 -10.883 1.00 0.00 H new ATOM 0 HB3 ASP A 59 3.793 -2.602 -9.903 1.00 0.00 H new ATOM 972 N VAL A 60 4.962 -3.134 -7.664 1.00 0.00 N ATOM 973 CA VAL A 60 4.914 -3.627 -6.298 1.00 0.00 C ATOM 974 C VAL A 60 5.019 -5.154 -6.307 1.00 0.00 C ATOM 975 O VAL A 60 4.431 -5.815 -7.161 1.00 0.00 O ATOM 976 CB VAL A 60 3.648 -3.120 -5.603 1.00 0.00 C ATOM 977 CG1 VAL A 60 2.405 -3.412 -6.446 1.00 0.00 C ATOM 978 CG2 VAL A 60 3.514 -3.720 -4.202 1.00 0.00 C ATOM 0 H VAL A 60 4.349 -3.624 -8.316 1.00 0.00 H new ATOM 0 HA VAL A 60 5.759 -3.246 -5.725 1.00 0.00 H new ATOM 0 HB VAL A 60 3.734 -2.039 -5.497 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.520 -3.042 -5.929 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.496 -2.915 -7.412 1.00 0.00 H new ATOM 0 HG13 VAL A 60 2.313 -4.487 -6.598 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.606 -3.343 -3.730 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.461 -4.806 -4.275 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.379 -3.438 -3.601 1.00 0.00 H new ATOM 988 N LEU A 61 5.773 -5.669 -5.347 1.00 0.00 N ATOM 989 CA LEU A 61 5.964 -7.105 -5.233 1.00 0.00 C ATOM 990 C LEU A 61 5.052 -7.650 -4.132 1.00 0.00 C ATOM 991 O LEU A 61 5.022 -7.116 -3.025 1.00 0.00 O ATOM 992 CB LEU A 61 7.443 -7.434 -5.027 1.00 0.00 C ATOM 993 CG LEU A 61 8.184 -7.989 -6.245 1.00 0.00 C ATOM 994 CD1 LEU A 61 9.252 -7.008 -6.731 1.00 0.00 C ATOM 995 CD2 LEU A 61 8.767 -9.372 -5.949 1.00 0.00 C ATOM 0 H LEU A 61 6.259 -5.117 -4.640 1.00 0.00 H new ATOM 0 HA LEU A 61 5.678 -7.603 -6.159 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.953 -6.529 -4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.524 -8.158 -4.217 1.00 0.00 H new ATOM 0 HG LEU A 61 7.466 -8.110 -7.056 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.764 -7.427 -7.597 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.781 -6.065 -7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.974 -6.832 -5.934 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.288 -9.743 -6.831 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.467 -9.301 -5.117 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.961 -10.058 -5.688 1.00 0.00 H new ATOM 1007 N THR A 62 4.331 -8.707 -4.475 1.00 0.00 N ATOM 1008 CA THR A 62 3.421 -9.331 -3.530 1.00 0.00 C ATOM 1009 C THR A 62 4.003 -10.652 -3.021 1.00 0.00 C ATOM 1010 O THR A 62 4.526 -11.445 -3.802 1.00 0.00 O ATOM 1011 CB THR A 62 2.062 -9.490 -4.215 1.00 0.00 C ATOM 1012 OG1 THR A 62 1.498 -8.182 -4.175 1.00 0.00 O ATOM 1013 CG2 THR A 62 1.089 -10.341 -3.397 1.00 0.00 C ATOM 0 H THR A 62 4.359 -9.147 -5.395 1.00 0.00 H new ATOM 0 HA THR A 62 3.284 -8.710 -2.645 1.00 0.00 H new ATOM 0 HB THR A 62 2.202 -9.942 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.615 -8.193 -4.600 1.00 0.00 H new ATOM 0 HG21 THR A 62 0.141 -10.422 -3.928 1.00 0.00 H new ATOM 0 HG22 THR A 62 1.509 -11.336 -3.252 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.922 -9.872 -2.427 1.00 0.00 H new ATOM 1021 N PHE A 63 3.892 -10.846 -1.715 1.00 0.00 N ATOM 1022 CA PHE A 63 4.401 -12.057 -1.093 1.00 0.00 C ATOM 1023 C PHE A 63 3.443 -13.229 -1.311 1.00 0.00 C ATOM 1024 O PHE A 63 2.235 -13.091 -1.126 1.00 0.00 O ATOM 1025 CB PHE A 63 4.512 -11.776 0.407 1.00 0.00 C ATOM 1026 CG PHE A 63 5.750 -12.390 1.064 1.00 0.00 C ATOM 1027 CD1 PHE A 63 6.966 -12.268 0.470 1.00 0.00 C ATOM 1028 CD2 PHE A 63 5.633 -13.056 2.244 1.00 0.00 C ATOM 1029 CE1 PHE A 63 8.115 -12.838 1.080 1.00 0.00 C ATOM 1030 CE2 PHE A 63 6.781 -13.625 2.855 1.00 0.00 C ATOM 1031 CZ PHE A 63 7.998 -13.504 2.260 1.00 0.00 C ATOM 0 H PHE A 63 3.457 -10.185 -1.071 1.00 0.00 H new ATOM 0 HA PHE A 63 5.364 -12.324 -1.529 1.00 0.00 H new ATOM 0 HB2 PHE A 63 4.527 -10.698 0.564 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.621 -12.159 0.905 1.00 0.00 H new ATOM 0 HD1 PHE A 63 7.059 -11.738 -0.466 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.666 -13.152 2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.081 -12.743 0.607 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.688 -14.154 3.792 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.872 -13.937 2.725 1.00 0.00 H new ATOM 1041 N PRO A 64 4.033 -14.387 -1.712 1.00 0.00 N ATOM 1042 CA PRO A 64 3.246 -15.583 -1.957 1.00 0.00 C ATOM 1043 C PRO A 64 2.800 -16.225 -0.642 1.00 0.00 C ATOM 1044 O PRO A 64 3.618 -16.775 0.093 1.00 0.00 O ATOM 1045 CB PRO A 64 4.148 -16.486 -2.783 1.00 0.00 C ATOM 1046 CG PRO A 64 5.561 -15.965 -2.577 1.00 0.00 C ATOM 1047 CD PRO A 64 5.461 -14.588 -1.941 1.00 0.00 C ATOM 0 HA PRO A 64 2.319 -15.374 -2.490 1.00 0.00 H new ATOM 0 HB2 PRO A 64 4.063 -17.524 -2.460 1.00 0.00 H new ATOM 0 HB3 PRO A 64 3.871 -16.457 -3.837 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.128 -16.641 -1.937 1.00 0.00 H new ATOM 0 HG3 PRO A 64 6.090 -15.909 -3.528 1.00 0.00 H new ATOM 0 HD2 PRO A 64 6.022 -14.542 -1.008 1.00 0.00 H new ATOM 0 HD3 PRO A 64 5.869 -13.819 -2.597 1.00 0.00 H new ATOM 1055 N LEU A 65 1.503 -16.135 -0.386 1.00 0.00 N ATOM 1056 CA LEU A 65 0.938 -16.700 0.828 1.00 0.00 C ATOM 1057 C LEU A 65 -0.588 -16.632 0.755 1.00 0.00 C ATOM 1058 O LEU A 65 -1.254 -16.445 1.772 1.00 0.00 O ATOM 1059 CB LEU A 65 1.526 -16.014 2.062 1.00 0.00 C ATOM 1060 CG LEU A 65 0.975 -14.623 2.383 1.00 0.00 C ATOM 1061 CD1 LEU A 65 1.002 -14.356 3.889 1.00 0.00 C ATOM 1062 CD2 LEU A 65 1.720 -13.543 1.596 1.00 0.00 C ATOM 0 H LEU A 65 0.827 -15.679 -0.999 1.00 0.00 H new ATOM 0 HA LEU A 65 1.206 -17.753 0.919 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.358 -16.658 2.926 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.605 -15.934 1.929 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.068 -14.589 2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.605 -13.361 4.089 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.392 -15.100 4.401 1.00 0.00 H new ATOM 0 HD13 LEU A 65 2.028 -14.417 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.309 -12.564 1.843 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.778 -13.568 1.856 1.00 0.00 H new ATOM 0 HD23 LEU A 65 1.605 -13.726 0.528 1.00 0.00 H new ATOM 1074 N MET A 66 -1.098 -16.786 -0.458 1.00 0.00 N ATOM 1075 CA MET A 66 -2.534 -16.744 -0.677 1.00 0.00 C ATOM 1076 C MET A 66 -3.279 -17.501 0.425 1.00 0.00 C ATOM 1077 O MET A 66 -3.417 -18.721 0.360 1.00 0.00 O ATOM 1078 CB MET A 66 -2.862 -17.367 -2.036 1.00 0.00 C ATOM 1079 CG MET A 66 -3.025 -16.289 -3.108 1.00 0.00 C ATOM 1080 SD MET A 66 -4.197 -16.826 -4.342 1.00 0.00 S ATOM 1081 CE MET A 66 -5.643 -15.925 -3.810 1.00 0.00 C ATOM 0 H MET A 66 -0.543 -16.940 -1.299 1.00 0.00 H new ATOM 0 HA MET A 66 -2.855 -15.703 -0.658 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.068 -18.056 -2.325 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.779 -17.951 -1.960 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.365 -15.360 -2.652 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.062 -16.081 -3.575 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.445 -16.062 -4.536 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.966 -16.297 -2.838 1.00 0.00 H new ATOM 0 HE3 MET A 66 -5.403 -14.865 -3.731 1.00 0.00 H new ATOM 1091 N GLU A 67 -3.740 -16.744 1.410 1.00 0.00 N ATOM 1092 CA GLU A 67 -4.467 -17.328 2.524 1.00 0.00 C ATOM 1093 C GLU A 67 -5.801 -16.606 2.724 1.00 0.00 C ATOM 1094 O GLU A 67 -6.163 -15.733 1.936 1.00 0.00 O ATOM 1095 CB GLU A 67 -3.629 -17.295 3.804 1.00 0.00 C ATOM 1096 CG GLU A 67 -2.642 -18.464 3.843 1.00 0.00 C ATOM 1097 CD GLU A 67 -1.527 -18.206 4.858 1.00 0.00 C ATOM 1098 OE1 GLU A 67 -1.034 -17.073 4.963 1.00 0.00 O ATOM 1099 OE2 GLU A 67 -1.174 -19.234 5.554 1.00 0.00 O ATOM 0 H GLU A 67 -3.624 -15.732 1.460 1.00 0.00 H new ATOM 0 HA GLU A 67 -4.672 -18.373 2.290 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.085 -16.353 3.862 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.285 -17.339 4.674 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.170 -19.382 4.103 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -2.210 -18.613 2.853 1.00 0.00 H new ATOM 1107 N GLU A 68 -6.496 -16.996 3.783 1.00 0.00 N ATOM 1108 CA GLU A 68 -7.782 -16.397 4.096 1.00 0.00 C ATOM 1109 C GLU A 68 -7.606 -14.920 4.454 1.00 0.00 C ATOM 1110 O GLU A 68 -8.436 -14.087 4.094 1.00 0.00 O ATOM 1111 CB GLU A 68 -8.480 -17.156 5.226 1.00 0.00 C ATOM 1112 CG GLU A 68 -9.818 -16.504 5.580 1.00 0.00 C ATOM 1113 CD GLU A 68 -10.988 -17.311 5.014 1.00 0.00 C ATOM 1114 OE1 GLU A 68 -11.444 -17.039 3.893 1.00 0.00 O ATOM 1115 OE2 GLU A 68 -11.425 -18.250 5.783 1.00 0.00 O ATOM 0 H GLU A 68 -6.192 -17.719 4.435 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.417 -16.463 3.212 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -8.644 -18.191 4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -7.837 -17.177 6.106 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -9.914 -16.428 6.663 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -9.847 -15.488 5.185 1.00 0.00 H new ATOM 1123 N ASP A 69 -6.520 -14.640 5.160 1.00 0.00 N ATOM 1124 CA ASP A 69 -6.225 -13.279 5.571 1.00 0.00 C ATOM 1125 C ASP A 69 -4.714 -13.044 5.497 1.00 0.00 C ATOM 1126 O ASP A 69 -4.003 -13.238 6.482 1.00 0.00 O ATOM 1127 CB ASP A 69 -6.671 -13.029 7.013 1.00 0.00 C ATOM 1128 CG ASP A 69 -8.067 -13.552 7.357 1.00 0.00 C ATOM 1129 OD1 ASP A 69 -8.224 -14.450 8.197 1.00 0.00 O ATOM 1130 OD2 ASP A 69 -9.034 -12.989 6.713 1.00 0.00 O ATOM 0 H ASP A 69 -5.834 -15.333 5.458 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.761 -12.603 4.905 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -5.950 -13.492 7.686 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.643 -11.956 7.205 1.00 0.00 H new ATOM 1136 N VAL A 70 -4.269 -12.631 4.319 1.00 0.00 N ATOM 1137 CA VAL A 70 -2.857 -12.368 4.104 1.00 0.00 C ATOM 1138 C VAL A 70 -2.298 -11.593 5.299 1.00 0.00 C ATOM 1139 O VAL A 70 -2.913 -10.635 5.765 1.00 0.00 O ATOM 1140 CB VAL A 70 -2.657 -11.639 2.773 1.00 0.00 C ATOM 1141 CG1 VAL A 70 -2.998 -10.153 2.905 1.00 0.00 C ATOM 1142 CG2 VAL A 70 -1.232 -11.831 2.251 1.00 0.00 C ATOM 0 H VAL A 70 -4.862 -12.472 3.504 1.00 0.00 H new ATOM 0 HA VAL A 70 -2.301 -13.303 4.035 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.341 -12.076 2.046 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -2.847 -9.658 1.945 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.039 -10.044 3.210 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.351 -9.696 3.654 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -1.117 -11.303 1.304 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -0.522 -11.434 2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -1.040 -12.893 2.099 1.00 0.00 H new ATOM 1152 N TYR A 71 -1.138 -12.037 5.761 1.00 0.00 N ATOM 1153 CA TYR A 71 -0.490 -11.397 6.893 1.00 0.00 C ATOM 1154 C TYR A 71 1.016 -11.665 6.886 1.00 0.00 C ATOM 1155 O TYR A 71 1.618 -11.876 7.938 1.00 0.00 O ATOM 1156 CB TYR A 71 -1.102 -12.031 8.144 1.00 0.00 C ATOM 1157 CG TYR A 71 -0.495 -13.385 8.516 1.00 0.00 C ATOM 1158 CD1 TYR A 71 -0.874 -14.523 7.833 1.00 0.00 C ATOM 1159 CD2 TYR A 71 0.432 -13.469 9.535 1.00 0.00 C ATOM 1160 CE1 TYR A 71 -0.302 -15.797 8.184 1.00 0.00 C ATOM 1161 CE2 TYR A 71 1.004 -14.743 9.886 1.00 0.00 C ATOM 1162 CZ TYR A 71 0.608 -15.844 9.193 1.00 0.00 C ATOM 1163 OH TYR A 71 1.149 -17.048 9.524 1.00 0.00 O ATOM 0 H TYR A 71 -0.631 -12.832 5.372 1.00 0.00 H new ATOM 0 HA TYR A 71 -0.635 -10.317 6.858 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.979 -11.346 8.983 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -2.174 -12.155 7.989 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -1.599 -14.458 7.036 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.729 -12.579 10.069 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -0.589 -16.695 7.658 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.731 -14.822 10.681 1.00 0.00 H new ATOM 0 HH TYR A 71 1.784 -16.930 10.261 1.00 0.00 H new ATOM 1173 N GLY A 72 1.582 -11.648 5.688 1.00 0.00 N ATOM 1174 CA GLY A 72 3.007 -11.887 5.530 1.00 0.00 C ATOM 1175 C GLY A 72 3.768 -10.571 5.358 1.00 0.00 C ATOM 1176 O GLY A 72 3.494 -9.596 6.057 1.00 0.00 O ATOM 0 H GLY A 72 1.080 -11.472 4.818 1.00 0.00 H new ATOM 0 HA2 GLY A 72 3.389 -12.421 6.400 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.178 -12.526 4.664 1.00 0.00 H new ATOM 1180 N GLU A 73 4.708 -10.585 4.425 1.00 0.00 N ATOM 1181 CA GLU A 73 5.510 -9.404 4.153 1.00 0.00 C ATOM 1182 C GLU A 73 5.548 -9.123 2.650 1.00 0.00 C ATOM 1183 O GLU A 73 6.100 -9.909 1.881 1.00 0.00 O ATOM 1184 CB GLU A 73 6.923 -9.560 4.717 1.00 0.00 C ATOM 1185 CG GLU A 73 7.556 -10.874 4.255 1.00 0.00 C ATOM 1186 CD GLU A 73 8.728 -11.266 5.159 1.00 0.00 C ATOM 1187 OE1 GLU A 73 8.514 -11.661 6.314 1.00 0.00 O ATOM 1188 OE2 GLU A 73 9.894 -11.148 4.621 1.00 0.00 O ATOM 0 H GLU A 73 4.933 -11.395 3.848 1.00 0.00 H new ATOM 0 HA GLU A 73 5.047 -8.552 4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 73 7.541 -8.722 4.396 1.00 0.00 H new ATOM 0 HB3 GLU A 73 6.889 -9.532 5.806 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.806 -11.665 4.262 1.00 0.00 H new ATOM 0 HG3 GLU A 73 7.903 -10.773 3.227 1.00 0.00 H new ATOM 1196 N ILE A 74 4.954 -7.999 2.275 1.00 0.00 N ATOM 1197 CA ILE A 74 4.913 -7.604 0.877 1.00 0.00 C ATOM 1198 C ILE A 74 5.945 -6.502 0.633 1.00 0.00 C ATOM 1199 O ILE A 74 6.285 -5.752 1.546 1.00 0.00 O ATOM 1200 CB ILE A 74 3.489 -7.215 0.472 1.00 0.00 C ATOM 1201 CG1 ILE A 74 3.026 -5.967 1.227 1.00 0.00 C ATOM 1202 CG2 ILE A 74 2.526 -8.389 0.659 1.00 0.00 C ATOM 1203 CD1 ILE A 74 2.853 -4.783 0.274 1.00 0.00 C ATOM 0 H ILE A 74 4.497 -7.349 2.915 1.00 0.00 H new ATOM 0 HA ILE A 74 5.184 -8.442 0.235 1.00 0.00 H new ATOM 0 HB ILE A 74 3.491 -6.967 -0.589 1.00 0.00 H new ATOM 0 HG12 ILE A 74 2.082 -6.173 1.733 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.753 -5.714 1.999 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.521 -8.086 0.364 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.849 -9.226 0.040 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.521 -8.692 1.706 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.523 -3.909 0.836 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.804 -4.565 -0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.108 -5.030 -0.482 1.00 0.00 H new ATOM 1215 N TYR A 75 6.414 -6.439 -0.605 1.00 0.00 N ATOM 1216 CA TYR A 75 7.400 -5.440 -0.981 1.00 0.00 C ATOM 1217 C TYR A 75 6.806 -4.422 -1.956 1.00 0.00 C ATOM 1218 O TYR A 75 6.115 -4.794 -2.903 1.00 0.00 O ATOM 1219 CB TYR A 75 8.526 -6.203 -1.682 1.00 0.00 C ATOM 1220 CG TYR A 75 9.168 -7.294 -0.823 1.00 0.00 C ATOM 1221 CD1 TYR A 75 8.434 -8.402 -0.453 1.00 0.00 C ATOM 1222 CD2 TYR A 75 10.482 -7.170 -0.418 1.00 0.00 C ATOM 1223 CE1 TYR A 75 9.038 -9.429 0.356 1.00 0.00 C ATOM 1224 CE2 TYR A 75 11.086 -8.197 0.391 1.00 0.00 C ATOM 1225 CZ TYR A 75 10.334 -9.275 0.738 1.00 0.00 C ATOM 1226 OH TYR A 75 10.905 -10.245 1.502 1.00 0.00 O ATOM 0 H TYR A 75 6.130 -7.063 -1.360 1.00 0.00 H new ATOM 0 HA TYR A 75 7.747 -4.894 -0.104 1.00 0.00 H new ATOM 0 HB2 TYR A 75 8.132 -6.656 -2.592 1.00 0.00 H new ATOM 0 HB3 TYR A 75 9.296 -5.494 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR A 75 7.406 -8.499 -0.770 1.00 0.00 H new ATOM 0 HD2 TYR A 75 11.057 -6.303 -0.708 1.00 0.00 H new ATOM 0 HE1 TYR A 75 8.475 -10.301 0.652 1.00 0.00 H new ATOM 0 HE2 TYR A 75 12.113 -8.113 0.715 1.00 0.00 H new ATOM 0 HH TYR A 75 11.605 -10.698 0.987 1.00 0.00 H new ATOM 1236 N VAL A 76 7.097 -3.157 -1.691 1.00 0.00 N ATOM 1237 CA VAL A 76 6.599 -2.083 -2.533 1.00 0.00 C ATOM 1238 C VAL A 76 7.770 -1.202 -2.973 1.00 0.00 C ATOM 1239 O VAL A 76 8.797 -1.144 -2.298 1.00 0.00 O ATOM 1240 CB VAL A 76 5.509 -1.302 -1.797 1.00 0.00 C ATOM 1241 CG1 VAL A 76 5.145 -0.023 -2.552 1.00 0.00 C ATOM 1242 CG2 VAL A 76 4.272 -2.174 -1.566 1.00 0.00 C ATOM 0 H VAL A 76 7.671 -2.852 -0.905 1.00 0.00 H new ATOM 0 HA VAL A 76 6.138 -2.488 -3.434 1.00 0.00 H new ATOM 0 HB VAL A 76 5.903 -1.014 -0.823 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.368 0.513 -2.007 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.028 0.610 -2.642 1.00 0.00 H new ATOM 0 HG13 VAL A 76 4.780 -0.279 -3.546 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.512 -1.595 -1.041 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.877 -2.506 -2.526 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.546 -3.042 -0.966 1.00 0.00 H new ATOM 1252 N CYS A 77 7.578 -0.538 -4.104 1.00 0.00 N ATOM 1253 CA CYS A 77 8.605 0.337 -4.642 1.00 0.00 C ATOM 1254 C CYS A 77 7.922 1.566 -5.245 1.00 0.00 C ATOM 1255 O CYS A 77 7.436 1.519 -6.374 1.00 0.00 O ATOM 1256 CB CYS A 77 9.486 -0.385 -5.663 1.00 0.00 C ATOM 1257 SG CYS A 77 10.503 0.827 -6.582 1.00 0.00 S ATOM 0 H CYS A 77 6.726 -0.589 -4.662 1.00 0.00 H new ATOM 0 HA CYS A 77 9.274 0.651 -3.841 1.00 0.00 H new ATOM 0 HB2 CYS A 77 10.131 -1.103 -5.156 1.00 0.00 H new ATOM 0 HB3 CYS A 77 8.864 -0.950 -6.357 1.00 0.00 H new ATOM 0 HG CYS A 77 11.473 0.209 -7.188 1.00 0.00 H new ATOM 1263 N PRO A 78 7.906 2.666 -4.445 1.00 0.00 N ATOM 1264 CA PRO A 78 7.291 3.905 -4.888 1.00 0.00 C ATOM 1265 C PRO A 78 8.174 4.620 -5.913 1.00 0.00 C ATOM 1266 O PRO A 78 7.821 5.693 -6.401 1.00 0.00 O ATOM 1267 CB PRO A 78 7.078 4.715 -3.620 1.00 0.00 C ATOM 1268 CG PRO A 78 7.999 4.104 -2.576 1.00 0.00 C ATOM 1269 CD PRO A 78 8.472 2.758 -3.103 1.00 0.00 C ATOM 0 HA PRO A 78 6.345 3.743 -5.404 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.316 5.766 -3.783 1.00 0.00 H new ATOM 0 HB3 PRO A 78 6.038 4.670 -3.298 1.00 0.00 H new ATOM 0 HG2 PRO A 78 8.849 4.760 -2.386 1.00 0.00 H new ATOM 0 HG3 PRO A 78 7.474 3.980 -1.629 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.560 2.703 -3.128 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.125 1.941 -2.470 1.00 0.00 H new ATOM 1277 N LEU A 79 9.306 3.998 -6.209 1.00 0.00 N ATOM 1278 CA LEU A 79 10.242 4.561 -7.166 1.00 0.00 C ATOM 1279 C LEU A 79 9.648 4.461 -8.573 1.00 0.00 C ATOM 1280 O LEU A 79 9.490 5.471 -9.257 1.00 0.00 O ATOM 1281 CB LEU A 79 11.613 3.897 -7.029 1.00 0.00 C ATOM 1282 CG LEU A 79 12.802 4.843 -6.852 1.00 0.00 C ATOM 1283 CD1 LEU A 79 13.294 4.841 -5.403 1.00 0.00 C ATOM 1284 CD2 LEU A 79 13.923 4.507 -7.838 1.00 0.00 C ATOM 0 H LEU A 79 9.596 3.109 -5.802 1.00 0.00 H new ATOM 0 HA LEU A 79 10.405 5.619 -6.962 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.583 3.220 -6.175 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.789 3.286 -7.914 1.00 0.00 H new ATOM 0 HG LEU A 79 12.468 5.856 -7.077 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.140 5.522 -5.305 1.00 0.00 H new ATOM 0 HD12 LEU A 79 12.488 5.166 -4.745 1.00 0.00 H new ATOM 0 HD13 LEU A 79 13.605 3.834 -5.126 1.00 0.00 H new ATOM 0 HD21 LEU A 79 14.756 5.195 -7.690 1.00 0.00 H new ATOM 0 HD22 LEU A 79 14.262 3.485 -7.669 1.00 0.00 H new ATOM 0 HD23 LEU A 79 13.551 4.602 -8.858 1.00 0.00 H new ATOM 1296 N ILE A 80 9.335 3.234 -8.963 1.00 0.00 N ATOM 1297 CA ILE A 80 8.762 2.990 -10.275 1.00 0.00 C ATOM 1298 C ILE A 80 7.341 3.554 -10.320 1.00 0.00 C ATOM 1299 O ILE A 80 6.937 4.150 -11.318 1.00 0.00 O ATOM 1300 CB ILE A 80 8.845 1.503 -10.627 1.00 0.00 C ATOM 1301 CG1 ILE A 80 10.293 1.012 -10.596 1.00 0.00 C ATOM 1302 CG2 ILE A 80 8.172 1.220 -11.972 1.00 0.00 C ATOM 1303 CD1 ILE A 80 10.490 -0.049 -9.512 1.00 0.00 C ATOM 0 H ILE A 80 9.468 2.398 -8.393 1.00 0.00 H new ATOM 0 HA ILE A 80 9.335 3.509 -11.043 1.00 0.00 H new ATOM 0 HB ILE A 80 8.299 0.941 -9.869 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.561 0.598 -11.568 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.962 1.853 -10.412 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.245 0.156 -12.199 1.00 0.00 H new ATOM 0 HG22 ILE A 80 7.122 1.509 -11.922 1.00 0.00 H new ATOM 0 HG23 ILE A 80 8.669 1.793 -12.755 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.528 -0.381 -9.512 1.00 0.00 H new ATOM 0 HD12 ILE A 80 10.245 0.376 -8.539 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.838 -0.899 -9.712 1.00 0.00 H new ATOM 1315 N VAL A 81 6.622 3.348 -9.227 1.00 0.00 N ATOM 1316 CA VAL A 81 5.254 3.829 -9.128 1.00 0.00 C ATOM 1317 C VAL A 81 5.218 5.322 -9.461 1.00 0.00 C ATOM 1318 O VAL A 81 4.425 5.757 -10.294 1.00 0.00 O ATOM 1319 CB VAL A 81 4.686 3.511 -7.744 1.00 0.00 C ATOM 1320 CG1 VAL A 81 3.288 4.109 -7.575 1.00 0.00 C ATOM 1321 CG2 VAL A 81 4.670 2.002 -7.491 1.00 0.00 C ATOM 0 H VAL A 81 6.961 2.854 -8.401 1.00 0.00 H new ATOM 0 HA VAL A 81 4.617 3.319 -9.850 1.00 0.00 H new ATOM 0 HB VAL A 81 5.339 3.969 -7.001 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.907 3.868 -6.583 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.339 5.192 -7.692 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.621 3.694 -8.330 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.262 1.804 -6.500 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.051 1.513 -8.243 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.686 1.613 -7.549 1.00 0.00 H new ATOM 1331 N GLU A 82 6.086 6.066 -8.791 1.00 0.00 N ATOM 1332 CA GLU A 82 6.164 7.501 -9.005 1.00 0.00 C ATOM 1333 C GLU A 82 6.578 7.801 -10.446 1.00 0.00 C ATOM 1334 O GLU A 82 6.032 8.704 -11.078 1.00 0.00 O ATOM 1335 CB GLU A 82 7.127 8.152 -8.010 1.00 0.00 C ATOM 1336 CG GLU A 82 6.858 9.653 -7.888 1.00 0.00 C ATOM 1337 CD GLU A 82 8.044 10.373 -7.243 1.00 0.00 C ATOM 1338 OE1 GLU A 82 9.169 10.300 -7.760 1.00 0.00 O ATOM 1339 OE2 GLU A 82 7.765 11.026 -6.167 1.00 0.00 O ATOM 0 H GLU A 82 6.741 5.702 -8.100 1.00 0.00 H new ATOM 0 HA GLU A 82 5.176 7.928 -8.836 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.021 7.679 -7.034 1.00 0.00 H new ATOM 0 HB3 GLU A 82 8.155 7.988 -8.333 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.667 10.073 -8.875 1.00 0.00 H new ATOM 0 HG3 GLU A 82 5.960 9.818 -7.292 1.00 0.00 H new ATOM 1347 N GLU A 83 7.541 7.027 -10.925 1.00 0.00 N ATOM 1348 CA GLU A 83 8.035 7.199 -12.281 1.00 0.00 C ATOM 1349 C GLU A 83 6.885 7.082 -13.284 1.00 0.00 C ATOM 1350 O GLU A 83 6.732 7.933 -14.159 1.00 0.00 O ATOM 1351 CB GLU A 83 9.140 6.188 -12.594 1.00 0.00 C ATOM 1352 CG GLU A 83 10.178 6.787 -13.546 1.00 0.00 C ATOM 1353 CD GLU A 83 11.323 7.439 -12.768 1.00 0.00 C ATOM 1354 OE1 GLU A 83 11.733 6.921 -11.719 1.00 0.00 O ATOM 1355 OE2 GLU A 83 11.790 8.522 -13.290 1.00 0.00 O ATOM 0 H GLU A 83 7.992 6.279 -10.398 1.00 0.00 H new ATOM 0 HA GLU A 83 8.465 8.197 -12.366 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.626 5.877 -11.669 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.704 5.294 -13.041 1.00 0.00 H new ATOM 0 HG2 GLU A 83 10.573 6.007 -14.196 1.00 0.00 H new ATOM 0 HG3 GLU A 83 9.702 7.527 -14.189 1.00 0.00 H new ATOM 1363 N ASN A 84 6.107 6.023 -13.122 1.00 0.00 N ATOM 1364 CA ASN A 84 4.975 5.784 -14.003 1.00 0.00 C ATOM 1365 C ASN A 84 3.902 6.844 -13.746 1.00 0.00 C ATOM 1366 O ASN A 84 3.135 7.186 -14.644 1.00 0.00 O ATOM 1367 CB ASN A 84 4.355 4.410 -13.742 1.00 0.00 C ATOM 1368 CG ASN A 84 5.434 3.330 -13.647 1.00 0.00 C ATOM 1369 OD1 ASN A 84 5.445 2.504 -12.749 1.00 0.00 O ATOM 1370 ND2 ASN A 84 6.339 3.382 -14.620 1.00 0.00 N ATOM 0 H ASN A 84 6.237 5.320 -12.394 1.00 0.00 H new ATOM 0 HA ASN A 84 5.332 5.829 -15.032 1.00 0.00 H new ATOM 0 HB2 ASN A 84 3.780 4.437 -12.816 1.00 0.00 H new ATOM 0 HB3 ASN A 84 3.658 4.163 -14.543 1.00 0.00 H new ATOM 0 HD21 ASN A 84 7.101 2.704 -14.645 1.00 0.00 H new ATOM 0 HD22 ASN A 84 6.271 4.100 -15.342 1.00 0.00 H new ATOM 1377 N ALA A 85 3.883 7.335 -12.515 1.00 0.00 N ATOM 1378 CA ALA A 85 2.917 8.349 -12.129 1.00 0.00 C ATOM 1379 C ALA A 85 3.358 9.705 -12.683 1.00 0.00 C ATOM 1380 O ALA A 85 2.527 10.573 -12.944 1.00 0.00 O ATOM 1381 CB ALA A 85 2.772 8.361 -10.606 1.00 0.00 C ATOM 0 H ALA A 85 4.521 7.049 -11.772 1.00 0.00 H new ATOM 0 HA ALA A 85 1.936 8.125 -12.549 1.00 0.00 H new ATOM 0 HB1 ALA A 85 2.047 9.122 -10.315 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.429 7.384 -10.265 1.00 0.00 H new ATOM 0 HB3 ALA A 85 3.736 8.586 -10.150 1.00 0.00 H new ATOM 1387 N ARG A 86 4.666 9.844 -12.847 1.00 0.00 N ATOM 1388 CA ARG A 86 5.227 11.080 -13.366 1.00 0.00 C ATOM 1389 C ARG A 86 4.733 11.329 -14.793 1.00 0.00 C ATOM 1390 O ARG A 86 4.224 12.407 -15.098 1.00 0.00 O ATOM 1391 CB ARG A 86 6.756 11.034 -13.364 1.00 0.00 C ATOM 1392 CG ARG A 86 7.308 11.189 -11.946 1.00 0.00 C ATOM 1393 CD ARG A 86 8.556 12.073 -11.936 1.00 0.00 C ATOM 1394 NE ARG A 86 8.182 13.475 -11.644 1.00 0.00 N ATOM 1395 CZ ARG A 86 8.942 14.544 -11.964 1.00 0.00 C ATOM 1396 NH1 ARG A 86 10.126 14.379 -12.591 1.00 0.00 N ATOM 1397 NH2 ARG A 86 8.510 15.752 -11.655 1.00 0.00 N ATOM 0 H ARG A 86 5.353 9.122 -12.630 1.00 0.00 H new ATOM 0 HA ARG A 86 4.898 11.892 -12.717 1.00 0.00 H new ATOM 0 HB2 ARG A 86 7.095 10.089 -13.789 1.00 0.00 H new ATOM 0 HB3 ARG A 86 7.148 11.828 -13.999 1.00 0.00 H new ATOM 0 HG2 ARG A 86 6.545 11.624 -11.301 1.00 0.00 H new ATOM 0 HG3 ARG A 86 7.550 10.208 -11.537 1.00 0.00 H new ATOM 0 HD2 ARG A 86 9.261 11.713 -11.187 1.00 0.00 H new ATOM 0 HD3 ARG A 86 9.060 12.016 -12.901 1.00 0.00 H new ATOM 0 HE ARG A 86 7.294 13.644 -11.171 1.00 0.00 H new ATOM 0 HH11 ARG A 86 10.452 13.442 -12.826 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.694 15.192 -12.829 1.00 0.00 H new ATOM 0 HH21 ARG A 86 7.614 15.868 -11.181 1.00 0.00 H new ATOM 0 HH22 ARG A 86 9.072 16.570 -11.890 1.00 0.00 H new ATOM 1410 N GLU A 87 4.901 10.315 -15.629 1.00 0.00 N ATOM 1411 CA GLU A 87 4.479 10.411 -17.016 1.00 0.00 C ATOM 1412 C GLU A 87 2.952 10.374 -17.110 1.00 0.00 C ATOM 1413 O GLU A 87 2.361 11.060 -17.943 1.00 0.00 O ATOM 1414 CB GLU A 87 5.106 9.299 -17.858 1.00 0.00 C ATOM 1415 CG GLU A 87 4.880 7.929 -17.215 1.00 0.00 C ATOM 1416 CD GLU A 87 6.206 7.197 -17.002 1.00 0.00 C ATOM 1417 OE1 GLU A 87 7.176 7.800 -16.517 1.00 0.00 O ATOM 1418 OE2 GLU A 87 6.208 5.958 -17.358 1.00 0.00 O ATOM 0 H GLU A 87 5.324 9.423 -15.372 1.00 0.00 H new ATOM 0 HA GLU A 87 4.826 11.364 -17.415 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.676 9.310 -18.859 1.00 0.00 H new ATOM 0 HB3 GLU A 87 6.175 9.481 -17.968 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.371 8.052 -16.259 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.227 7.329 -17.849 1.00 0.00 H new ATOM 1426 N PHE A 88 2.357 9.567 -16.243 1.00 0.00 N ATOM 1427 CA PHE A 88 0.910 9.433 -16.218 1.00 0.00 C ATOM 1428 C PHE A 88 0.284 10.425 -15.236 1.00 0.00 C ATOM 1429 O PHE A 88 -0.896 10.318 -14.908 1.00 0.00 O ATOM 1430 CB PHE A 88 0.602 8.009 -15.751 1.00 0.00 C ATOM 1431 CG PHE A 88 -0.757 7.482 -16.215 1.00 0.00 C ATOM 1432 CD1 PHE A 88 -1.866 7.702 -15.460 1.00 0.00 C ATOM 1433 CD2 PHE A 88 -0.856 6.793 -17.384 1.00 0.00 C ATOM 1434 CE1 PHE A 88 -3.128 7.213 -15.891 1.00 0.00 C ATOM 1435 CE2 PHE A 88 -2.117 6.304 -17.815 1.00 0.00 C ATOM 1436 CZ PHE A 88 -3.226 6.524 -17.060 1.00 0.00 C ATOM 0 H PHE A 88 2.850 9.000 -15.553 1.00 0.00 H new ATOM 0 HA PHE A 88 0.500 9.635 -17.208 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.383 7.341 -16.115 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.639 7.979 -14.662 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.787 8.249 -14.532 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.025 6.618 -17.984 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.009 7.388 -15.291 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -2.195 5.757 -18.743 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.185 6.152 -17.388 1.00 0.00 H new ATOM 1446 N ASN A 89 1.103 11.369 -14.796 1.00 0.00 N ATOM 1447 CA ASN A 89 0.644 12.380 -13.859 1.00 0.00 C ATOM 1448 C ASN A 89 -0.304 11.737 -12.845 1.00 0.00 C ATOM 1449 O ASN A 89 -1.281 12.355 -12.425 1.00 0.00 O ATOM 1450 CB ASN A 89 -0.119 13.493 -14.579 1.00 0.00 C ATOM 1451 CG ASN A 89 -0.664 14.519 -13.583 1.00 0.00 C ATOM 1452 OD1 ASN A 89 0.202 14.863 -12.634 1.00 0.00 O flip ATOM 1453 ND2 ASN A 89 -1.795 14.968 -13.671 1.00 0.00 N flip ATOM 0 H ASN A 89 2.081 11.455 -15.071 1.00 0.00 H new ATOM 0 HA ASN A 89 1.519 12.803 -13.365 1.00 0.00 H new ATOM 0 HB2 ASN A 89 0.540 13.988 -15.292 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -0.942 13.064 -15.151 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -2.409 14.660 -14.425 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -2.127 15.651 -12.990 1.00 0.00 H new ATOM 1460 N ASN A 90 0.018 10.504 -12.481 1.00 0.00 N ATOM 1461 CA ASN A 90 -0.792 9.771 -11.524 1.00 0.00 C ATOM 1462 C ASN A 90 -0.436 10.224 -10.107 1.00 0.00 C ATOM 1463 O ASN A 90 0.662 10.723 -9.869 1.00 0.00 O ATOM 1464 CB ASN A 90 -0.530 8.266 -11.619 1.00 0.00 C ATOM 1465 CG ASN A 90 -1.687 7.469 -11.014 1.00 0.00 C ATOM 1466 OD1 ASN A 90 -1.359 6.782 -9.923 1.00 0.00 O flip ATOM 1467 ND2 ASN A 90 -2.804 7.476 -11.506 1.00 0.00 N flip ATOM 0 H ASN A 90 0.829 9.995 -12.832 1.00 0.00 H new ATOM 0 HA ASN A 90 -1.840 9.970 -11.748 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -0.395 7.982 -12.663 1.00 0.00 H new ATOM 0 HB3 ASN A 90 0.396 8.021 -11.099 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.988 8.026 -12.345 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -3.553 6.932 -11.078 1.00 0.00 H new ATOM 1474 N THR A 91 -1.386 10.034 -9.203 1.00 0.00 N ATOM 1475 CA THR A 91 -1.186 10.417 -7.816 1.00 0.00 C ATOM 1476 C THR A 91 -0.254 9.425 -7.117 1.00 0.00 C ATOM 1477 O THR A 91 -0.692 8.367 -6.668 1.00 0.00 O ATOM 1478 CB THR A 91 -2.561 10.529 -7.153 1.00 0.00 C ATOM 1479 OG1 THR A 91 -3.300 11.378 -8.028 1.00 0.00 O ATOM 1480 CG2 THR A 91 -2.514 11.302 -5.834 1.00 0.00 C ATOM 0 H THR A 91 -2.296 9.620 -9.404 1.00 0.00 H new ATOM 0 HA THR A 91 -0.693 11.386 -7.741 1.00 0.00 H new ATOM 0 HB THR A 91 -2.960 9.531 -6.974 1.00 0.00 H new ATOM 0 HG1 THR A 91 -4.206 11.503 -7.675 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.515 11.352 -5.406 1.00 0.00 H new ATOM 0 HG22 THR A 91 -1.847 10.794 -5.138 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.147 12.312 -6.017 1.00 0.00 H new ATOM 1488 N PHE A 92 1.014 9.802 -7.048 1.00 0.00 N ATOM 1489 CA PHE A 92 2.012 8.958 -6.412 1.00 0.00 C ATOM 1490 C PHE A 92 1.571 8.555 -5.003 1.00 0.00 C ATOM 1491 O PHE A 92 1.957 7.498 -4.507 1.00 0.00 O ATOM 1492 CB PHE A 92 3.298 9.782 -6.315 1.00 0.00 C ATOM 1493 CG PHE A 92 4.251 9.320 -5.211 1.00 0.00 C ATOM 1494 CD1 PHE A 92 4.418 7.992 -4.968 1.00 0.00 C ATOM 1495 CD2 PHE A 92 4.931 10.237 -4.473 1.00 0.00 C ATOM 1496 CE1 PHE A 92 5.302 7.563 -3.944 1.00 0.00 C ATOM 1497 CE2 PHE A 92 5.816 9.808 -3.448 1.00 0.00 C ATOM 1498 CZ PHE A 92 5.983 8.481 -3.205 1.00 0.00 C ATOM 0 H PHE A 92 1.374 10.680 -7.422 1.00 0.00 H new ATOM 0 HA PHE A 92 2.155 8.047 -6.994 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.818 9.738 -7.272 1.00 0.00 H new ATOM 0 HB3 PHE A 92 3.036 10.826 -6.142 1.00 0.00 H new ATOM 0 HD1 PHE A 92 3.878 7.264 -5.555 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.798 11.291 -4.666 1.00 0.00 H new ATOM 0 HE1 PHE A 92 5.434 6.509 -3.751 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.356 10.536 -2.862 1.00 0.00 H new ATOM 0 HZ PHE A 92 6.656 8.155 -2.426 1.00 0.00 H new ATOM 1508 N GLU A 93 0.770 9.420 -4.398 1.00 0.00 N ATOM 1509 CA GLU A 93 0.273 9.167 -3.056 1.00 0.00 C ATOM 1510 C GLU A 93 -0.779 8.057 -3.080 1.00 0.00 C ATOM 1511 O GLU A 93 -0.632 7.042 -2.400 1.00 0.00 O ATOM 1512 CB GLU A 93 -0.292 10.444 -2.431 1.00 0.00 C ATOM 1513 CG GLU A 93 0.698 11.604 -2.563 1.00 0.00 C ATOM 1514 CD GLU A 93 0.437 12.404 -3.841 1.00 0.00 C ATOM 1515 OE1 GLU A 93 0.341 11.820 -4.930 1.00 0.00 O ATOM 1516 OE2 GLU A 93 0.332 13.679 -3.673 1.00 0.00 O ATOM 0 H GLU A 93 0.453 10.297 -4.812 1.00 0.00 H new ATOM 0 HA GLU A 93 1.107 8.837 -2.437 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.232 10.706 -2.917 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -0.515 10.270 -1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 93 0.614 12.259 -1.696 1.00 0.00 H new ATOM 0 HG3 GLU A 93 1.717 11.218 -2.573 1.00 0.00 H new ATOM 1524 N LYS A 94 -1.817 8.286 -3.871 1.00 0.00 N ATOM 1525 CA LYS A 94 -2.894 7.317 -3.992 1.00 0.00 C ATOM 1526 C LYS A 94 -2.321 5.983 -4.476 1.00 0.00 C ATOM 1527 O LYS A 94 -2.745 4.921 -4.023 1.00 0.00 O ATOM 1528 CB LYS A 94 -4.010 7.866 -4.882 1.00 0.00 C ATOM 1529 CG LYS A 94 -4.360 6.877 -5.996 1.00 0.00 C ATOM 1530 CD LYS A 94 -5.125 5.674 -5.441 1.00 0.00 C ATOM 1531 CE LYS A 94 -6.598 5.725 -5.851 1.00 0.00 C ATOM 1532 NZ LYS A 94 -7.063 4.387 -6.282 1.00 0.00 N ATOM 0 H LYS A 94 -1.935 9.128 -4.434 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.353 7.134 -3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.895 8.068 -4.279 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.698 8.815 -5.318 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.962 7.377 -6.755 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -3.447 6.538 -6.486 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.674 4.751 -5.806 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.047 5.659 -4.354 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.203 6.074 -5.014 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.731 6.441 -6.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -7.957 4.482 -6.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -6.347 3.952 -6.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -7.212 3.786 -5.447 1.00 0.00 H new ATOM 1545 N GLU A 95 -1.367 6.082 -5.390 1.00 0.00 N ATOM 1546 CA GLU A 95 -0.733 4.896 -5.940 1.00 0.00 C ATOM 1547 C GLU A 95 -0.099 4.066 -4.822 1.00 0.00 C ATOM 1548 O GLU A 95 -0.352 2.867 -4.714 1.00 0.00 O ATOM 1549 CB GLU A 95 0.305 5.271 -7.000 1.00 0.00 C ATOM 1550 CG GLU A 95 0.075 4.488 -8.294 1.00 0.00 C ATOM 1551 CD GLU A 95 -0.071 2.992 -8.011 1.00 0.00 C ATOM 1552 OE1 GLU A 95 0.433 2.502 -6.989 1.00 0.00 O ATOM 1553 OE2 GLU A 95 -0.735 2.331 -8.898 1.00 0.00 O ATOM 0 H GLU A 95 -1.018 6.965 -5.763 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.498 4.291 -6.426 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.252 6.340 -7.204 1.00 0.00 H new ATOM 0 HB3 GLU A 95 1.307 5.068 -6.621 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.822 4.857 -8.792 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.909 4.653 -8.976 1.00 0.00 H new ATOM 1561 N LEU A 96 0.713 4.737 -4.018 1.00 0.00 N ATOM 1562 CA LEU A 96 1.385 4.076 -2.912 1.00 0.00 C ATOM 1563 C LEU A 96 0.352 3.689 -1.851 1.00 0.00 C ATOM 1564 O LEU A 96 0.547 2.725 -1.113 1.00 0.00 O ATOM 1565 CB LEU A 96 2.520 4.951 -2.375 1.00 0.00 C ATOM 1566 CG LEU A 96 3.092 4.546 -1.015 1.00 0.00 C ATOM 1567 CD1 LEU A 96 2.203 5.047 0.125 1.00 0.00 C ATOM 1568 CD2 LEU A 96 3.319 3.035 -0.943 1.00 0.00 C ATOM 0 H LEU A 96 0.921 5.731 -4.110 1.00 0.00 H new ATOM 0 HA LEU A 96 1.857 3.153 -3.250 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.331 4.948 -3.104 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.159 5.977 -2.304 1.00 0.00 H new ATOM 0 HG LEU A 96 4.065 5.023 -0.898 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.632 4.746 1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.137 6.134 0.084 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.206 4.619 0.024 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.726 2.774 0.034 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.371 2.517 -1.091 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.022 2.735 -1.720 1.00 0.00 H new ATOM 1580 N LEU A 97 -0.723 4.462 -1.809 1.00 0.00 N ATOM 1581 CA LEU A 97 -1.787 4.212 -0.851 1.00 0.00 C ATOM 1582 C LEU A 97 -2.495 2.904 -1.211 1.00 0.00 C ATOM 1583 O LEU A 97 -3.035 2.226 -0.339 1.00 0.00 O ATOM 1584 CB LEU A 97 -2.726 5.417 -0.767 1.00 0.00 C ATOM 1585 CG LEU A 97 -2.609 6.271 0.497 1.00 0.00 C ATOM 1586 CD1 LEU A 97 -1.893 7.591 0.202 1.00 0.00 C ATOM 1587 CD2 LEU A 97 -3.981 6.495 1.136 1.00 0.00 C ATOM 0 H LEU A 97 -0.880 5.262 -2.423 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.376 4.087 0.151 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.544 6.056 -1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -3.752 5.059 -0.846 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.001 5.728 1.221 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.823 8.179 1.117 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.891 7.385 -0.175 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.454 8.150 -0.547 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.870 7.105 2.033 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -4.633 7.006 0.428 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -4.419 5.533 1.403 1.00 0.00 H new ATOM 1599 N GLU A 98 -2.470 2.590 -2.498 1.00 0.00 N ATOM 1600 CA GLU A 98 -3.102 1.375 -2.984 1.00 0.00 C ATOM 1601 C GLU A 98 -2.371 0.144 -2.446 1.00 0.00 C ATOM 1602 O GLU A 98 -2.982 -0.722 -1.822 1.00 0.00 O ATOM 1603 CB GLU A 98 -3.154 1.358 -4.513 1.00 0.00 C ATOM 1604 CG GLU A 98 -4.488 1.907 -5.023 1.00 0.00 C ATOM 1605 CD GLU A 98 -4.564 1.834 -6.549 1.00 0.00 C ATOM 1606 OE1 GLU A 98 -3.688 2.377 -7.240 1.00 0.00 O ATOM 1607 OE2 GLU A 98 -5.576 1.184 -7.015 1.00 0.00 O ATOM 0 H GLU A 98 -2.022 3.156 -3.219 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.129 1.352 -2.618 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.334 1.954 -4.915 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.014 0.339 -4.874 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.310 1.339 -4.587 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.608 2.941 -4.698 1.00 0.00 H new ATOM 1615 N VAL A 99 -1.073 0.105 -2.708 1.00 0.00 N ATOM 1616 CA VAL A 99 -0.251 -1.006 -2.258 1.00 0.00 C ATOM 1617 C VAL A 99 -0.339 -1.115 -0.734 1.00 0.00 C ATOM 1618 O VAL A 99 -0.165 -2.197 -0.175 1.00 0.00 O ATOM 1619 CB VAL A 99 1.183 -0.835 -2.763 1.00 0.00 C ATOM 1620 CG1 VAL A 99 1.201 -0.474 -4.250 1.00 0.00 C ATOM 1621 CG2 VAL A 99 1.935 0.209 -1.936 1.00 0.00 C ATOM 0 H VAL A 99 -0.570 0.825 -3.226 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.618 -1.945 -2.673 1.00 0.00 H new ATOM 0 HB VAL A 99 1.696 -1.789 -2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.232 -0.358 -4.584 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.721 -1.267 -4.823 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.663 0.461 -4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.952 0.311 -2.316 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.423 1.168 -2.008 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.967 -0.107 -0.893 1.00 0.00 H new ATOM 1631 N VAL A 100 -0.610 0.019 -0.106 1.00 0.00 N ATOM 1632 CA VAL A 100 -0.723 0.065 1.342 1.00 0.00 C ATOM 1633 C VAL A 100 -1.923 -0.776 1.781 1.00 0.00 C ATOM 1634 O VAL A 100 -1.776 -1.713 2.565 1.00 0.00 O ATOM 1635 CB VAL A 100 -0.805 1.517 1.815 1.00 0.00 C ATOM 1636 CG1 VAL A 100 -1.373 1.601 3.233 1.00 0.00 C ATOM 1637 CG2 VAL A 100 0.562 2.199 1.731 1.00 0.00 C ATOM 0 H VAL A 100 -0.755 0.914 -0.573 1.00 0.00 H new ATOM 0 HA VAL A 100 0.164 -0.364 1.809 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.486 2.048 1.150 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -1.420 2.644 3.545 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.375 1.171 3.250 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -0.729 1.047 3.916 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.476 3.230 2.073 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.274 1.666 2.361 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.912 2.187 0.699 1.00 0.00 H new ATOM 1647 N ILE A 101 -3.085 -0.410 1.259 1.00 0.00 N ATOM 1648 CA ILE A 101 -4.310 -1.119 1.588 1.00 0.00 C ATOM 1649 C ILE A 101 -4.365 -2.427 0.796 1.00 0.00 C ATOM 1650 O ILE A 101 -5.150 -3.319 1.118 1.00 0.00 O ATOM 1651 CB ILE A 101 -5.526 -0.216 1.370 1.00 0.00 C ATOM 1652 CG1 ILE A 101 -5.605 0.256 -0.083 1.00 0.00 C ATOM 1653 CG2 ILE A 101 -5.522 0.955 2.355 1.00 0.00 C ATOM 1654 CD1 ILE A 101 -6.959 0.905 -0.375 1.00 0.00 C ATOM 0 H ILE A 101 -3.204 0.368 0.611 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.325 -1.385 2.645 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.425 -0.799 1.567 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -4.805 0.970 -0.281 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -5.451 -0.590 -0.753 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.396 1.581 2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.549 0.572 3.375 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -4.617 1.547 2.213 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.989 1.232 -1.414 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -7.755 0.181 -0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.099 1.765 0.280 1.00 0.00 H new ATOM 1666 N HIS A 102 -3.523 -2.501 -0.224 1.00 0.00 N ATOM 1667 CA HIS A 102 -3.467 -3.685 -1.064 1.00 0.00 C ATOM 1668 C HIS A 102 -3.319 -4.930 -0.187 1.00 0.00 C ATOM 1669 O HIS A 102 -3.758 -6.015 -0.564 1.00 0.00 O ATOM 1670 CB HIS A 102 -2.354 -3.559 -2.107 1.00 0.00 C ATOM 1671 CG HIS A 102 -2.234 -4.752 -3.024 1.00 0.00 C ATOM 1672 ND1 HIS A 102 -1.910 -6.050 -2.760 1.00 0.00 N flip ATOM 1673 CD2 HIS A 102 -2.459 -4.675 -4.388 1.00 0.00 C flip ATOM 1674 CE1 HIS A 102 -1.937 -6.730 -3.900 1.00 0.00 C flip ATOM 1675 NE2 HIS A 102 -2.277 -5.879 -4.911 1.00 0.00 N flip ATOM 0 H HIS A 102 -2.874 -1.760 -0.488 1.00 0.00 H new ATOM 0 HA HIS A 102 -4.398 -3.784 -1.621 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.533 -2.668 -2.709 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -1.404 -3.411 -1.594 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -2.736 -3.785 -4.933 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -1.725 -7.783 -4.009 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -2.374 -6.126 -5.896 1.00 0.00 H new ATOM 1683 N GLY A 103 -2.699 -4.731 0.967 1.00 0.00 N ATOM 1684 CA GLY A 103 -2.488 -5.824 1.901 1.00 0.00 C ATOM 1685 C GLY A 103 -3.737 -6.070 2.749 1.00 0.00 C ATOM 1686 O GLY A 103 -4.221 -7.198 2.835 1.00 0.00 O ATOM 0 H GLY A 103 -2.336 -3.829 1.276 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.232 -6.731 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -1.643 -5.594 2.550 1.00 0.00 H new ATOM 1690 N ILE A 104 -4.224 -4.996 3.353 1.00 0.00 N ATOM 1691 CA ILE A 104 -5.409 -5.081 4.190 1.00 0.00 C ATOM 1692 C ILE A 104 -6.622 -5.410 3.319 1.00 0.00 C ATOM 1693 O ILE A 104 -7.335 -6.378 3.581 1.00 0.00 O ATOM 1694 CB ILE A 104 -5.573 -3.804 5.017 1.00 0.00 C ATOM 1695 CG1 ILE A 104 -4.374 -3.592 5.943 1.00 0.00 C ATOM 1696 CG2 ILE A 104 -6.896 -3.815 5.785 1.00 0.00 C ATOM 1697 CD1 ILE A 104 -4.249 -2.123 6.351 1.00 0.00 C ATOM 0 H ILE A 104 -3.820 -4.062 3.280 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.307 -5.891 4.913 1.00 0.00 H new ATOM 0 HB ILE A 104 -5.605 -2.956 4.333 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -4.483 -4.212 6.833 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.461 -3.913 5.441 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.988 -2.896 6.365 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -7.725 -3.884 5.081 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -6.919 -4.672 6.458 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -3.389 -2.000 7.009 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.116 -1.508 5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.153 -1.812 6.874 1.00 0.00 H new ATOM 1709 N LEU A 105 -6.820 -4.587 2.300 1.00 0.00 N ATOM 1710 CA LEU A 105 -7.935 -4.778 1.388 1.00 0.00 C ATOM 1711 C LEU A 105 -7.982 -6.243 0.947 1.00 0.00 C ATOM 1712 O LEU A 105 -9.046 -6.759 0.610 1.00 0.00 O ATOM 1713 CB LEU A 105 -7.851 -3.788 0.224 1.00 0.00 C ATOM 1714 CG LEU A 105 -6.978 -4.214 -0.957 1.00 0.00 C ATOM 1715 CD1 LEU A 105 -7.623 -5.366 -1.730 1.00 0.00 C ATOM 1716 CD2 LEU A 105 -6.662 -3.022 -1.863 1.00 0.00 C ATOM 0 H LEU A 105 -6.227 -3.786 2.086 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.879 -4.565 1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.860 -3.604 -0.144 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.473 -2.840 0.606 1.00 0.00 H new ATOM 0 HG LEU A 105 -6.030 -4.581 -0.565 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -6.981 -5.649 -2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.754 -6.221 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -8.594 -5.050 -2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.040 -3.352 -2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -7.591 -2.602 -2.249 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.130 -2.262 -1.291 1.00 0.00 H new ATOM 1728 N HIS A 106 -6.815 -6.870 0.964 1.00 0.00 N ATOM 1729 CA HIS A 106 -6.710 -8.265 0.571 1.00 0.00 C ATOM 1730 C HIS A 106 -7.397 -9.146 1.616 1.00 0.00 C ATOM 1731 O HIS A 106 -8.235 -9.981 1.276 1.00 0.00 O ATOM 1732 CB HIS A 106 -5.249 -8.654 0.335 1.00 0.00 C ATOM 1733 CG HIS A 106 -5.072 -9.997 -0.333 1.00 0.00 C ATOM 1734 ND1 HIS A 106 -3.890 -10.715 -0.271 1.00 0.00 N ATOM 1735 CD2 HIS A 106 -5.938 -10.746 -1.074 1.00 0.00 C ATOM 1736 CE1 HIS A 106 -4.049 -11.842 -0.949 1.00 0.00 C ATOM 1737 NE2 HIS A 106 -5.319 -11.859 -1.447 1.00 0.00 N ATOM 0 H HIS A 106 -5.934 -6.438 1.244 1.00 0.00 H new ATOM 0 HA HIS A 106 -7.224 -8.419 -0.378 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.774 -7.889 -0.279 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.727 -8.664 1.292 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -6.956 -10.478 -1.316 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.304 -12.612 -1.084 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -5.726 -12.604 -2.013 1.00 0.00 H new ATOM 1745 N LEU A 107 -7.017 -8.931 2.867 1.00 0.00 N ATOM 1746 CA LEU A 107 -7.586 -9.696 3.964 1.00 0.00 C ATOM 1747 C LEU A 107 -8.925 -9.077 4.370 1.00 0.00 C ATOM 1748 O LEU A 107 -9.551 -9.520 5.332 1.00 0.00 O ATOM 1749 CB LEU A 107 -6.585 -9.807 5.115 1.00 0.00 C ATOM 1750 CG LEU A 107 -6.195 -8.492 5.794 1.00 0.00 C ATOM 1751 CD1 LEU A 107 -6.964 -8.303 7.103 1.00 0.00 C ATOM 1752 CD2 LEU A 107 -4.681 -8.410 6.001 1.00 0.00 C ATOM 0 H LEU A 107 -6.322 -8.238 3.145 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.790 -10.720 3.650 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.002 -10.473 5.870 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.679 -10.281 4.738 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.474 -7.670 5.135 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.669 -7.361 7.566 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.034 -8.286 6.897 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.738 -9.127 7.780 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -4.431 -7.466 6.485 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -4.354 -9.238 6.630 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -4.178 -8.467 5.036 1.00 0.00 H new ATOM 1764 N ALA A 108 -9.324 -8.062 3.618 1.00 0.00 N ATOM 1765 CA ALA A 108 -10.578 -7.378 3.888 1.00 0.00 C ATOM 1766 C ALA A 108 -11.743 -8.258 3.430 1.00 0.00 C ATOM 1767 O ALA A 108 -12.848 -8.155 3.959 1.00 0.00 O ATOM 1768 CB ALA A 108 -10.572 -6.012 3.199 1.00 0.00 C ATOM 0 H ALA A 108 -8.801 -7.696 2.822 1.00 0.00 H new ATOM 0 HA ALA A 108 -10.698 -7.203 4.957 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -11.512 -5.498 3.401 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -9.743 -5.416 3.581 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -10.456 -6.147 2.124 1.00 0.00 H new ATOM 1774 N GLY A 109 -11.455 -9.103 2.451 1.00 0.00 N ATOM 1775 CA GLY A 109 -12.465 -10.000 1.915 1.00 0.00 C ATOM 1776 C GLY A 109 -11.871 -10.920 0.847 1.00 0.00 C ATOM 1777 O GLY A 109 -10.677 -11.216 0.872 1.00 0.00 O ATOM 0 H GLY A 109 -10.537 -9.186 2.015 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.889 -10.599 2.721 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.282 -9.419 1.486 1.00 0.00 H new ATOM 1781 N TYR A 110 -12.731 -11.348 -0.065 1.00 0.00 N ATOM 1782 CA TYR A 110 -12.306 -12.229 -1.140 1.00 0.00 C ATOM 1783 C TYR A 110 -11.923 -13.608 -0.599 1.00 0.00 C ATOM 1784 O TYR A 110 -11.647 -13.757 0.591 1.00 0.00 O ATOM 1785 CB TYR A 110 -11.069 -11.574 -1.757 1.00 0.00 C ATOM 1786 CG TYR A 110 -11.078 -10.045 -1.697 1.00 0.00 C ATOM 1787 CD1 TYR A 110 -12.276 -9.361 -1.733 1.00 0.00 C ATOM 1788 CD2 TYR A 110 -9.889 -9.351 -1.606 1.00 0.00 C ATOM 1789 CE1 TYR A 110 -12.285 -7.922 -1.676 1.00 0.00 C ATOM 1790 CE2 TYR A 110 -9.898 -7.912 -1.549 1.00 0.00 C ATOM 1791 CZ TYR A 110 -11.095 -7.268 -1.587 1.00 0.00 C ATOM 1792 OH TYR A 110 -11.103 -5.910 -1.533 1.00 0.00 O ATOM 0 H TYR A 110 -13.721 -11.101 -0.082 1.00 0.00 H new ATOM 0 HA TYR A 110 -13.110 -12.368 -1.863 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -10.181 -11.942 -1.243 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -10.987 -11.886 -2.798 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -13.207 -9.905 -1.804 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -8.952 -9.887 -1.578 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -13.215 -7.374 -1.703 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.974 -7.357 -1.478 1.00 0.00 H new ATOM 0 HH TYR A 110 -10.484 -5.607 -0.837 1.00 0.00 H new ATOM 1802 N ASP A 111 -11.917 -14.580 -1.499 1.00 0.00 N ATOM 1803 CA ASP A 111 -11.572 -15.942 -1.127 1.00 0.00 C ATOM 1804 C ASP A 111 -11.500 -16.807 -2.387 1.00 0.00 C ATOM 1805 O ASP A 111 -10.529 -17.534 -2.591 1.00 0.00 O ATOM 1806 CB ASP A 111 -12.628 -16.544 -0.199 1.00 0.00 C ATOM 1807 CG ASP A 111 -12.492 -18.048 0.046 1.00 0.00 C ATOM 1808 OD1 ASP A 111 -13.293 -18.851 -0.456 1.00 0.00 O ATOM 1809 OD2 ASP A 111 -11.501 -18.391 0.797 1.00 0.00 O ATOM 0 H ASP A 111 -12.145 -14.452 -2.485 1.00 0.00 H new ATOM 0 HA ASP A 111 -10.612 -15.918 -0.612 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -12.582 -16.029 0.761 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -13.614 -16.347 -0.620 1.00 0.00 H new ATOM 1815 N HIS A 112 -12.542 -16.701 -3.198 1.00 0.00 N ATOM 1816 CA HIS A 112 -12.610 -17.465 -4.432 1.00 0.00 C ATOM 1817 C HIS A 112 -12.339 -16.543 -5.623 1.00 0.00 C ATOM 1818 O HIS A 112 -13.265 -16.146 -6.329 1.00 0.00 O ATOM 1819 CB HIS A 112 -13.947 -18.199 -4.544 1.00 0.00 C ATOM 1820 CG HIS A 112 -15.129 -17.290 -4.784 1.00 0.00 C ATOM 1821 ND1 HIS A 112 -15.661 -16.476 -3.799 1.00 0.00 N ATOM 1822 CD2 HIS A 112 -15.875 -17.075 -5.906 1.00 0.00 C ATOM 1823 CE1 HIS A 112 -16.680 -15.806 -4.315 1.00 0.00 C ATOM 1824 NE2 HIS A 112 -16.812 -16.179 -5.621 1.00 0.00 N ATOM 0 H HIS A 112 -13.346 -16.098 -3.025 1.00 0.00 H new ATOM 0 HA HIS A 112 -11.838 -18.235 -4.429 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.886 -18.921 -5.358 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -14.117 -18.765 -3.628 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -15.728 -17.553 -6.863 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -17.298 -15.090 -3.794 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -17.515 -15.827 -6.271 1.00 0.00 H new ATOM 1832 N GLU A 113 -11.065 -16.228 -5.808 1.00 0.00 N ATOM 1833 CA GLU A 113 -10.661 -15.360 -6.901 1.00 0.00 C ATOM 1834 C GLU A 113 -11.261 -13.964 -6.720 1.00 0.00 C ATOM 1835 O GLU A 113 -12.445 -13.829 -6.416 1.00 0.00 O ATOM 1836 CB GLU A 113 -11.058 -15.957 -8.252 1.00 0.00 C ATOM 1837 CG GLU A 113 -9.841 -16.100 -9.168 1.00 0.00 C ATOM 1838 CD GLU A 113 -10.195 -16.888 -10.431 1.00 0.00 C ATOM 1839 OE1 GLU A 113 -11.228 -16.618 -11.061 1.00 0.00 O ATOM 1840 OE2 GLU A 113 -9.351 -17.809 -10.753 1.00 0.00 O ATOM 0 H GLU A 113 -10.300 -16.558 -5.220 1.00 0.00 H new ATOM 0 HA GLU A 113 -9.575 -15.272 -6.886 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.520 -16.933 -8.101 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.804 -15.321 -8.729 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.470 -15.113 -9.443 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -9.036 -16.605 -8.634 1.00 0.00 H new ATOM 1848 N PHE A 114 -10.417 -12.962 -6.915 1.00 0.00 N ATOM 1849 CA PHE A 114 -10.850 -11.582 -6.778 1.00 0.00 C ATOM 1850 C PHE A 114 -10.688 -10.822 -8.096 1.00 0.00 C ATOM 1851 O PHE A 114 -10.919 -9.616 -8.154 1.00 0.00 O ATOM 1852 CB PHE A 114 -9.955 -10.936 -5.718 1.00 0.00 C ATOM 1853 CG PHE A 114 -8.506 -11.427 -5.743 1.00 0.00 C ATOM 1854 CD1 PHE A 114 -7.794 -11.385 -6.901 1.00 0.00 C ATOM 1855 CD2 PHE A 114 -7.930 -11.906 -4.608 1.00 0.00 C ATOM 1856 CE1 PHE A 114 -6.449 -11.841 -6.925 1.00 0.00 C ATOM 1857 CE2 PHE A 114 -6.586 -12.362 -4.631 1.00 0.00 C ATOM 1858 CZ PHE A 114 -5.874 -12.320 -5.789 1.00 0.00 C ATOM 0 H PHE A 114 -9.435 -13.078 -7.167 1.00 0.00 H new ATOM 0 HA PHE A 114 -11.903 -11.549 -6.498 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -9.964 -9.855 -5.859 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -10.377 -11.132 -4.732 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -8.251 -11.005 -7.803 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -8.496 -11.939 -3.689 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -5.883 -11.807 -7.844 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -6.129 -12.742 -3.729 1.00 0.00 H new ATOM 0 HZ PHE A 114 -4.851 -12.667 -5.807 1.00 0.00 H new ATOM 1868 N GLU A 115 -10.291 -11.561 -9.122 1.00 0.00 N ATOM 1869 CA GLU A 115 -10.095 -10.972 -10.436 1.00 0.00 C ATOM 1870 C GLU A 115 -10.890 -11.747 -11.489 1.00 0.00 C ATOM 1871 O GLU A 115 -11.214 -12.917 -11.290 1.00 0.00 O ATOM 1872 CB GLU A 115 -8.610 -10.921 -10.799 1.00 0.00 C ATOM 1873 CG GLU A 115 -8.043 -12.329 -10.989 1.00 0.00 C ATOM 1874 CD GLU A 115 -6.545 -12.364 -10.681 1.00 0.00 C ATOM 1875 OE1 GLU A 115 -5.850 -11.355 -10.871 1.00 0.00 O ATOM 1876 OE2 GLU A 115 -6.107 -13.490 -10.229 1.00 0.00 O ATOM 0 H GLU A 115 -10.100 -12.562 -9.070 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.464 -9.947 -10.411 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.475 -10.344 -11.714 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.057 -10.406 -10.013 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -8.568 -13.027 -10.337 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -8.215 -12.659 -12.014 1.00 0.00 H new ATOM 1884 N ASP A 116 -11.182 -11.064 -12.586 1.00 0.00 N ATOM 1885 CA ASP A 116 -11.933 -11.674 -13.670 1.00 0.00 C ATOM 1886 C ASP A 116 -12.176 -10.633 -14.765 1.00 0.00 C ATOM 1887 O ASP A 116 -13.135 -9.866 -14.696 1.00 0.00 O ATOM 1888 CB ASP A 116 -13.294 -12.174 -13.184 1.00 0.00 C ATOM 1889 CG ASP A 116 -13.885 -13.331 -13.993 1.00 0.00 C ATOM 1890 OD1 ASP A 116 -14.922 -13.182 -14.656 1.00 0.00 O ATOM 1891 OD2 ASP A 116 -13.226 -14.438 -13.923 1.00 0.00 O ATOM 0 H ASP A 116 -10.912 -10.094 -12.748 1.00 0.00 H new ATOM 0 HA ASP A 116 -11.354 -12.516 -14.049 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -13.199 -12.489 -12.145 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -13.997 -11.342 -13.202 1.00 0.00 H new ATOM 1897 N LYS A 117 -11.290 -10.640 -15.750 1.00 0.00 N ATOM 1898 CA LYS A 117 -11.395 -9.706 -16.858 1.00 0.00 C ATOM 1899 C LYS A 117 -11.177 -8.282 -16.342 1.00 0.00 C ATOM 1900 O LYS A 117 -10.119 -7.695 -16.560 1.00 0.00 O ATOM 1901 CB LYS A 117 -12.723 -9.897 -17.595 1.00 0.00 C ATOM 1902 CG LYS A 117 -12.615 -11.008 -18.641 1.00 0.00 C ATOM 1903 CD LYS A 117 -13.512 -12.193 -18.277 1.00 0.00 C ATOM 1904 CE LYS A 117 -13.477 -13.263 -19.370 1.00 0.00 C ATOM 1905 NZ LYS A 117 -13.974 -14.555 -18.847 1.00 0.00 N ATOM 0 H LYS A 117 -10.496 -11.278 -15.804 1.00 0.00 H new ATOM 0 HA LYS A 117 -10.616 -9.900 -17.596 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -13.508 -10.141 -16.880 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -13.012 -8.964 -18.079 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -12.898 -10.620 -19.619 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -11.580 -11.341 -18.718 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -13.185 -12.624 -17.331 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -14.536 -11.848 -18.133 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -14.088 -12.947 -20.216 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -12.458 -13.381 -19.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -13.943 -15.270 -19.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.375 -14.862 -18.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -14.954 -14.442 -18.517 1.00 0.00 H new ATOM 1918 N ASN A 118 -12.196 -7.769 -15.668 1.00 0.00 N ATOM 1919 CA ASN A 118 -12.129 -6.425 -15.120 1.00 0.00 C ATOM 1920 C ASN A 118 -12.192 -6.499 -13.593 1.00 0.00 C ATOM 1921 O ASN A 118 -13.010 -7.228 -13.036 1.00 0.00 O ATOM 1922 CB ASN A 118 -13.306 -5.574 -15.601 1.00 0.00 C ATOM 1923 CG ASN A 118 -14.634 -6.303 -15.383 1.00 0.00 C ATOM 1924 OD1 ASN A 118 -15.249 -6.225 -14.332 1.00 0.00 O ATOM 1925 ND2 ASN A 118 -15.040 -7.012 -16.432 1.00 0.00 N ATOM 0 H ASN A 118 -13.072 -8.260 -15.489 1.00 0.00 H new ATOM 0 HA ASN A 118 -11.196 -5.971 -15.454 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -13.316 -4.625 -15.066 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -13.184 -5.342 -16.659 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -15.915 -7.534 -16.387 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -14.476 -7.034 -17.282 1.00 0.00 H new ATOM 1932 N SER A 119 -11.316 -5.733 -12.959 1.00 0.00 N ATOM 1933 CA SER A 119 -11.261 -5.702 -11.507 1.00 0.00 C ATOM 1934 C SER A 119 -11.993 -4.465 -10.983 1.00 0.00 C ATOM 1935 O SER A 119 -11.360 -3.494 -10.569 1.00 0.00 O ATOM 1936 CB SER A 119 -9.814 -5.714 -11.010 1.00 0.00 C ATOM 1937 OG SER A 119 -9.556 -6.816 -10.145 1.00 0.00 O ATOM 0 H SER A 119 -10.638 -5.129 -13.424 1.00 0.00 H new ATOM 0 HA SER A 119 -11.754 -6.597 -11.126 1.00 0.00 H new ATOM 0 HB2 SER A 119 -9.138 -5.757 -11.864 1.00 0.00 H new ATOM 0 HB3 SER A 119 -9.604 -4.783 -10.484 1.00 0.00 H new ATOM 0 HG SER A 119 -8.622 -6.789 -9.851 1.00 0.00 H new ATOM 1943 N LYS A 120 -13.315 -4.540 -11.016 1.00 0.00 N ATOM 1944 CA LYS A 120 -14.139 -3.438 -10.549 1.00 0.00 C ATOM 1945 C LYS A 120 -14.261 -3.508 -9.026 1.00 0.00 C ATOM 1946 O LYS A 120 -13.967 -2.537 -8.331 1.00 0.00 O ATOM 1947 CB LYS A 120 -15.487 -3.432 -11.274 1.00 0.00 C ATOM 1948 CG LYS A 120 -15.974 -2.002 -11.515 1.00 0.00 C ATOM 1949 CD LYS A 120 -15.420 -1.448 -12.829 1.00 0.00 C ATOM 1950 CE LYS A 120 -14.416 -0.324 -12.571 1.00 0.00 C ATOM 1951 NZ LYS A 120 -13.146 -0.590 -13.282 1.00 0.00 N ATOM 0 H LYS A 120 -13.836 -5.347 -11.359 1.00 0.00 H new ATOM 0 HA LYS A 120 -13.670 -2.484 -10.788 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -15.394 -3.954 -12.227 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.224 -3.976 -10.683 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.064 -1.984 -11.540 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.663 -1.364 -10.688 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -14.938 -2.248 -13.391 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -16.239 -1.075 -13.444 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -14.833 0.627 -12.902 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -14.229 -0.234 -11.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -12.476 0.183 -13.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -12.742 -1.487 -12.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -13.327 -0.653 -14.304 1.00 0.00 H new ATOM 1964 N GLU A 121 -14.694 -4.667 -8.551 1.00 0.00 N ATOM 1965 CA GLU A 121 -14.858 -4.876 -7.123 1.00 0.00 C ATOM 1966 C GLU A 121 -13.515 -4.720 -6.406 1.00 0.00 C ATOM 1967 O GLU A 121 -13.456 -4.176 -5.304 1.00 0.00 O ATOM 1968 CB GLU A 121 -15.475 -6.247 -6.837 1.00 0.00 C ATOM 1969 CG GLU A 121 -16.734 -6.112 -5.977 1.00 0.00 C ATOM 1970 CD GLU A 121 -16.423 -5.406 -4.656 1.00 0.00 C ATOM 1971 OE1 GLU A 121 -16.114 -4.205 -4.653 1.00 0.00 O ATOM 1972 OE2 GLU A 121 -16.512 -6.149 -3.606 1.00 0.00 O ATOM 0 H GLU A 121 -14.936 -5.471 -9.130 1.00 0.00 H new ATOM 0 HA GLU A 121 -15.542 -4.119 -6.741 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -15.723 -6.742 -7.776 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -14.747 -6.878 -6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -17.493 -5.552 -6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -17.149 -7.100 -5.777 1.00 0.00 H new ATOM 1980 N MET A 122 -12.471 -5.206 -7.060 1.00 0.00 N ATOM 1981 CA MET A 122 -11.133 -5.126 -6.499 1.00 0.00 C ATOM 1982 C MET A 122 -10.718 -3.671 -6.275 1.00 0.00 C ATOM 1983 O MET A 122 -10.277 -3.308 -5.185 1.00 0.00 O ATOM 1984 CB MET A 122 -10.140 -5.800 -7.448 1.00 0.00 C ATOM 1985 CG MET A 122 -9.765 -7.197 -6.948 1.00 0.00 C ATOM 1986 SD MET A 122 -8.595 -7.069 -5.605 1.00 0.00 S ATOM 1987 CE MET A 122 -9.682 -7.363 -4.219 1.00 0.00 C ATOM 0 H MET A 122 -12.524 -5.657 -7.973 1.00 0.00 H new ATOM 0 HA MET A 122 -11.132 -5.636 -5.536 1.00 0.00 H new ATOM 0 HB2 MET A 122 -10.575 -5.871 -8.445 1.00 0.00 H new ATOM 0 HB3 MET A 122 -9.242 -5.188 -7.535 1.00 0.00 H new ATOM 0 HG2 MET A 122 -10.658 -7.725 -6.614 1.00 0.00 H new ATOM 0 HG3 MET A 122 -9.335 -7.781 -7.762 1.00 0.00 H new ATOM 0 HE1 MET A 122 -9.642 -6.513 -3.538 1.00 0.00 H new ATOM 0 HE2 MET A 122 -10.703 -7.492 -4.578 1.00 0.00 H new ATOM 0 HE3 MET A 122 -9.366 -8.264 -3.693 1.00 0.00 H new ATOM 1997 N PHE A 123 -10.873 -2.877 -7.324 1.00 0.00 N ATOM 1998 CA PHE A 123 -10.519 -1.469 -7.256 1.00 0.00 C ATOM 1999 C PHE A 123 -11.541 -0.687 -6.427 1.00 0.00 C ATOM 2000 O PHE A 123 -11.202 0.319 -5.806 1.00 0.00 O ATOM 2001 CB PHE A 123 -10.528 -0.935 -8.690 1.00 0.00 C ATOM 2002 CG PHE A 123 -9.594 0.256 -8.916 1.00 0.00 C ATOM 2003 CD1 PHE A 123 -9.992 1.508 -8.564 1.00 0.00 C ATOM 2004 CD2 PHE A 123 -8.367 0.062 -9.469 1.00 0.00 C ATOM 2005 CE1 PHE A 123 -9.126 2.613 -8.775 1.00 0.00 C ATOM 2006 CE2 PHE A 123 -7.501 1.167 -9.679 1.00 0.00 C ATOM 2007 CZ PHE A 123 -7.899 2.420 -9.328 1.00 0.00 C ATOM 0 H PHE A 123 -11.239 -3.182 -8.226 1.00 0.00 H new ATOM 0 HA PHE A 123 -9.543 -1.353 -6.785 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -10.245 -1.740 -9.368 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -11.545 -0.641 -8.951 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -10.966 1.661 -8.124 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.051 -0.932 -9.748 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.442 3.607 -8.496 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -6.526 1.013 -10.117 1.00 0.00 H new ATOM 0 HZ PHE A 123 -7.241 3.261 -9.489 1.00 0.00 H new ATOM 2017 N GLU A 124 -12.771 -1.179 -6.445 1.00 0.00 N ATOM 2018 CA GLU A 124 -13.843 -0.539 -5.703 1.00 0.00 C ATOM 2019 C GLU A 124 -13.598 -0.666 -4.198 1.00 0.00 C ATOM 2020 O GLU A 124 -13.441 0.337 -3.504 1.00 0.00 O ATOM 2021 CB GLU A 124 -15.203 -1.127 -6.088 1.00 0.00 C ATOM 2022 CG GLU A 124 -15.712 -0.519 -7.396 1.00 0.00 C ATOM 2023 CD GLU A 124 -17.026 0.232 -7.177 1.00 0.00 C ATOM 2024 OE1 GLU A 124 -17.986 -0.341 -6.641 1.00 0.00 O ATOM 2025 OE2 GLU A 124 -17.030 1.456 -7.585 1.00 0.00 O ATOM 0 H GLU A 124 -13.049 -2.013 -6.962 1.00 0.00 H new ATOM 0 HA GLU A 124 -13.854 0.520 -5.961 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -15.119 -2.209 -6.194 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -15.923 -0.940 -5.291 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -14.963 0.162 -7.800 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -15.858 -1.307 -8.135 1.00 0.00 H new ATOM 2033 N LYS A 125 -13.571 -1.908 -3.738 1.00 0.00 N ATOM 2034 CA LYS A 125 -13.347 -2.180 -2.328 1.00 0.00 C ATOM 2035 C LYS A 125 -11.997 -1.594 -1.909 1.00 0.00 C ATOM 2036 O LYS A 125 -11.785 -1.290 -0.736 1.00 0.00 O ATOM 2037 CB LYS A 125 -13.484 -3.676 -2.042 1.00 0.00 C ATOM 2038 CG LYS A 125 -14.640 -3.947 -1.078 1.00 0.00 C ATOM 2039 CD LYS A 125 -14.242 -3.616 0.362 1.00 0.00 C ATOM 2040 CE LYS A 125 -15.451 -3.136 1.168 1.00 0.00 C ATOM 2041 NZ LYS A 125 -15.538 -3.863 2.454 1.00 0.00 N ATOM 0 H LYS A 125 -13.701 -2.738 -4.317 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.109 -1.693 -1.720 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -13.650 -4.214 -2.975 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -12.555 -4.055 -1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -15.506 -3.351 -1.366 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -14.937 -4.994 -1.146 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -13.811 -4.498 0.836 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -13.471 -2.845 0.362 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -15.370 -2.065 1.354 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -16.364 -3.292 0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -16.023 -3.269 3.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -16.072 -4.745 2.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -14.580 -4.086 2.792 1.00 0.00 H new ATOM 2054 N GLN A 126 -11.118 -1.454 -2.891 1.00 0.00 N ATOM 2055 CA GLN A 126 -9.794 -0.911 -2.638 1.00 0.00 C ATOM 2056 C GLN A 126 -9.865 0.610 -2.487 1.00 0.00 C ATOM 2057 O GLN A 126 -9.178 1.186 -1.645 1.00 0.00 O ATOM 2058 CB GLN A 126 -8.819 -1.306 -3.748 1.00 0.00 C ATOM 2059 CG GLN A 126 -7.520 -0.504 -3.648 1.00 0.00 C ATOM 2060 CD GLN A 126 -6.397 -1.176 -4.442 1.00 0.00 C ATOM 2061 OE1 GLN A 126 -5.425 -1.670 -3.896 1.00 0.00 O ATOM 2062 NE2 GLN A 126 -6.586 -1.167 -5.759 1.00 0.00 N ATOM 0 H GLN A 126 -11.297 -1.707 -3.863 1.00 0.00 H new ATOM 0 HA GLN A 126 -9.421 -1.333 -1.705 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -8.599 -2.371 -3.681 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -9.281 -1.136 -4.720 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -7.682 0.506 -4.025 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -7.226 -0.411 -2.603 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -7.423 -0.736 -6.151 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -5.894 -1.591 -6.376 1.00 0.00 H new ATOM 2071 N LYS A 127 -10.702 1.217 -3.315 1.00 0.00 N ATOM 2072 CA LYS A 127 -10.872 2.660 -3.283 1.00 0.00 C ATOM 2073 C LYS A 127 -11.588 3.057 -1.991 1.00 0.00 C ATOM 2074 O LYS A 127 -11.437 4.181 -1.514 1.00 0.00 O ATOM 2075 CB LYS A 127 -11.578 3.144 -4.551 1.00 0.00 C ATOM 2076 CG LYS A 127 -10.645 4.008 -5.403 1.00 0.00 C ATOM 2077 CD LYS A 127 -10.984 5.493 -5.252 1.00 0.00 C ATOM 2078 CE LYS A 127 -10.507 6.290 -6.468 1.00 0.00 C ATOM 2079 NZ LYS A 127 -11.609 6.457 -7.442 1.00 0.00 N ATOM 0 H LYS A 127 -11.270 0.736 -4.012 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.902 3.158 -3.276 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -11.917 2.287 -5.132 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -12.465 3.717 -4.281 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -9.611 3.835 -5.106 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.729 3.717 -6.450 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -12.061 5.614 -5.133 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.517 5.886 -4.349 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -10.143 7.267 -6.150 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.670 5.777 -6.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.269 7.000 -8.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.937 5.522 -7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -12.396 6.966 -6.992 1.00 0.00 H new ATOM 2092 N LYS A 128 -12.351 2.113 -1.461 1.00 0.00 N ATOM 2093 CA LYS A 128 -13.091 2.350 -0.233 1.00 0.00 C ATOM 2094 C LYS A 128 -12.122 2.800 0.862 1.00 0.00 C ATOM 2095 O LYS A 128 -12.289 3.872 1.442 1.00 0.00 O ATOM 2096 CB LYS A 128 -13.914 1.116 0.143 1.00 0.00 C ATOM 2097 CG LYS A 128 -14.355 1.177 1.607 1.00 0.00 C ATOM 2098 CD LYS A 128 -15.848 0.874 1.744 1.00 0.00 C ATOM 2099 CE LYS A 128 -16.608 2.092 2.274 1.00 0.00 C ATOM 2100 NZ LYS A 128 -18.027 1.750 2.519 1.00 0.00 N ATOM 0 H LYS A 128 -12.473 1.182 -1.859 1.00 0.00 H new ATOM 0 HA LYS A 128 -13.812 3.155 -0.372 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -14.790 1.048 -0.502 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -13.324 0.215 -0.026 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -13.780 0.461 2.194 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -14.142 2.166 2.013 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.254 0.581 0.776 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -15.991 0.030 2.418 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -16.147 2.442 3.198 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -16.543 2.909 1.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -18.529 2.587 2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -18.467 1.437 1.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.083 0.985 3.221 1.00 0.00 H new ATOM 2113 N TYR A 129 -11.129 1.959 1.112 1.00 0.00 N ATOM 2114 CA TYR A 129 -10.133 2.256 2.127 1.00 0.00 C ATOM 2115 C TYR A 129 -9.181 3.358 1.655 1.00 0.00 C ATOM 2116 O TYR A 129 -8.806 4.234 2.432 1.00 0.00 O ATOM 2117 CB TYR A 129 -9.339 0.965 2.330 1.00 0.00 C ATOM 2118 CG TYR A 129 -10.204 -0.296 2.385 1.00 0.00 C ATOM 2119 CD1 TYR A 129 -11.338 -0.321 3.172 1.00 0.00 C ATOM 2120 CD2 TYR A 129 -9.851 -1.408 1.648 1.00 0.00 C ATOM 2121 CE1 TYR A 129 -12.152 -1.507 3.225 1.00 0.00 C ATOM 2122 CE2 TYR A 129 -10.666 -2.594 1.701 1.00 0.00 C ATOM 2123 CZ TYR A 129 -11.776 -2.585 2.486 1.00 0.00 C ATOM 2124 OH TYR A 129 -12.545 -3.706 2.535 1.00 0.00 O ATOM 0 H TYR A 129 -10.993 1.071 0.629 1.00 0.00 H new ATOM 0 HA TYR A 129 -10.611 2.601 3.044 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -8.618 0.863 1.519 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -8.769 1.043 3.256 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.614 0.550 3.748 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -8.964 -1.389 1.032 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.041 -1.540 3.838 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.401 -3.471 1.130 1.00 0.00 H new ATOM 0 HH TYR A 129 -12.794 -3.891 3.464 1.00 0.00 H new ATOM 2134 N VAL A 130 -8.818 3.276 0.383 1.00 0.00 N ATOM 2135 CA VAL A 130 -7.917 4.255 -0.202 1.00 0.00 C ATOM 2136 C VAL A 130 -8.500 5.656 -0.011 1.00 0.00 C ATOM 2137 O VAL A 130 -7.777 6.592 0.329 1.00 0.00 O ATOM 2138 CB VAL A 130 -7.653 3.912 -1.669 1.00 0.00 C ATOM 2139 CG1 VAL A 130 -7.913 5.121 -2.570 1.00 0.00 C ATOM 2140 CG2 VAL A 130 -6.232 3.380 -1.861 1.00 0.00 C ATOM 0 H VAL A 130 -9.131 2.547 -0.258 1.00 0.00 H new ATOM 0 HA VAL A 130 -6.951 4.234 0.302 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.347 3.123 -1.959 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.718 4.850 -3.608 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.951 5.435 -2.466 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.255 5.940 -2.279 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.071 3.144 -2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.514 4.137 -1.545 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.097 2.479 -1.262 1.00 0.00 H new ATOM 2150 N GLU A 131 -9.801 5.757 -0.237 1.00 0.00 N ATOM 2151 CA GLU A 131 -10.489 7.029 -0.094 1.00 0.00 C ATOM 2152 C GLU A 131 -10.529 7.449 1.376 1.00 0.00 C ATOM 2153 O GLU A 131 -10.414 8.632 1.691 1.00 0.00 O ATOM 2154 CB GLU A 131 -11.900 6.958 -0.683 1.00 0.00 C ATOM 2155 CG GLU A 131 -11.857 6.959 -2.212 1.00 0.00 C ATOM 2156 CD GLU A 131 -12.430 8.260 -2.777 1.00 0.00 C ATOM 2157 OE1 GLU A 131 -12.040 9.352 -2.335 1.00 0.00 O ATOM 2158 OE2 GLU A 131 -13.309 8.110 -3.708 1.00 0.00 O ATOM 0 H GLU A 131 -10.397 4.979 -0.518 1.00 0.00 H new ATOM 0 HA GLU A 131 -9.935 7.784 -0.652 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -12.400 6.056 -0.330 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -12.488 7.806 -0.332 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -10.828 6.834 -2.550 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -12.424 6.111 -2.596 1.00 0.00 H new ATOM 2166 N GLU A 132 -10.693 6.455 2.238 1.00 0.00 N ATOM 2167 CA GLU A 132 -10.749 6.707 3.668 1.00 0.00 C ATOM 2168 C GLU A 132 -9.367 7.100 4.193 1.00 0.00 C ATOM 2169 O GLU A 132 -9.247 7.997 5.025 1.00 0.00 O ATOM 2170 CB GLU A 132 -11.294 5.489 4.417 1.00 0.00 C ATOM 2171 CG GLU A 132 -12.696 5.765 4.964 1.00 0.00 C ATOM 2172 CD GLU A 132 -13.497 4.467 5.099 1.00 0.00 C ATOM 2173 OE1 GLU A 132 -13.792 3.813 4.089 1.00 0.00 O ATOM 2174 OE2 GLU A 132 -13.812 4.145 6.308 1.00 0.00 O ATOM 0 H GLU A 132 -10.789 5.475 1.973 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.432 7.538 3.845 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.323 4.629 3.748 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -10.624 5.232 5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.622 6.253 5.936 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.220 6.453 4.301 1.00 0.00 H new ATOM 2182 N VAL A 133 -8.357 6.409 3.684 1.00 0.00 N ATOM 2183 CA VAL A 133 -6.988 6.675 4.091 1.00 0.00 C ATOM 2184 C VAL A 133 -6.477 7.921 3.365 1.00 0.00 C ATOM 2185 O VAL A 133 -5.769 8.738 3.950 1.00 0.00 O ATOM 2186 CB VAL A 133 -6.119 5.440 3.842 1.00 0.00 C ATOM 2187 CG1 VAL A 133 -4.681 5.679 4.306 1.00 0.00 C ATOM 2188 CG2 VAL A 133 -6.715 4.205 4.520 1.00 0.00 C ATOM 0 H VAL A 133 -8.460 5.665 2.993 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.941 6.880 5.161 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.098 5.256 2.768 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.085 4.786 4.118 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -4.257 6.521 3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -4.675 5.901 5.373 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -6.078 3.341 4.328 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -6.780 4.376 5.595 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -7.712 4.017 4.122 1.00 0.00 H new ATOM 2198 N TRP A 134 -6.857 8.027 2.100 1.00 0.00 N ATOM 2199 CA TRP A 134 -6.447 9.159 1.287 1.00 0.00 C ATOM 2200 C TRP A 134 -7.299 10.364 1.691 1.00 0.00 C ATOM 2201 O TRP A 134 -6.987 11.498 1.331 1.00 0.00 O ATOM 2202 CB TRP A 134 -6.545 8.830 -0.203 1.00 0.00 C ATOM 2203 CG TRP A 134 -6.038 9.943 -1.122 1.00 0.00 C ATOM 2204 CD1 TRP A 134 -5.367 11.052 -0.781 1.00 0.00 C ATOM 2205 CD2 TRP A 134 -6.188 10.010 -2.556 1.00 0.00 C ATOM 2206 NE1 TRP A 134 -5.076 11.826 -1.886 1.00 0.00 N ATOM 2207 CE2 TRP A 134 -5.590 11.172 -3.000 1.00 0.00 C ATOM 2208 CE3 TRP A 134 -6.808 9.117 -3.448 1.00 0.00 C ATOM 2209 CZ2 TRP A 134 -5.554 11.549 -4.347 1.00 0.00 C ATOM 2210 CZ3 TRP A 134 -6.763 9.509 -4.792 1.00 0.00 C ATOM 2211 CH2 TRP A 134 -6.166 10.675 -5.255 1.00 0.00 C ATOM 0 H TRP A 134 -7.445 7.347 1.618 1.00 0.00 H new ATOM 0 HA TRP A 134 -5.398 9.399 1.462 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -5.976 7.922 -0.402 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -7.585 8.615 -0.449 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -5.089 11.308 0.231 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -4.576 12.715 -1.885 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -7.281 8.202 -3.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -5.080 12.464 -4.669 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -7.225 8.859 -5.520 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -6.174 10.907 -6.310 1.00 0.00 H new ATOM 2222 N GLY A 135 -8.359 10.077 2.432 1.00 0.00 N ATOM 2223 CA GLY A 135 -9.259 11.123 2.888 1.00 0.00 C ATOM 2224 C GLY A 135 -8.485 12.255 3.567 1.00 0.00 C ATOM 2225 O GLY A 135 -8.903 13.411 3.522 1.00 0.00 O ATOM 0 H GLY A 135 -8.615 9.135 2.728 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -9.821 11.518 2.042 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -9.985 10.705 3.585 1.00 0.00 H new ATOM 2229 N GLU A 136 -7.371 11.882 4.179 1.00 0.00 N ATOM 2230 CA GLU A 136 -6.535 12.852 4.866 1.00 0.00 C ATOM 2231 C GLU A 136 -5.531 13.472 3.892 1.00 0.00 C ATOM 2232 O GLU A 136 -5.502 14.689 3.714 1.00 0.00 O ATOM 2233 CB GLU A 136 -5.819 12.213 6.058 1.00 0.00 C ATOM 2234 CG GLU A 136 -5.457 13.264 7.108 1.00 0.00 C ATOM 2235 CD GLU A 136 -5.299 12.627 8.490 1.00 0.00 C ATOM 2236 OE1 GLU A 136 -6.303 12.293 9.137 1.00 0.00 O ATOM 2237 OE2 GLU A 136 -4.080 12.480 8.887 1.00 0.00 O ATOM 0 H GLU A 136 -7.028 10.922 4.214 1.00 0.00 H new ATOM 0 HA GLU A 136 -7.175 13.645 5.252 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -6.458 11.452 6.505 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.915 11.709 5.716 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -4.529 13.762 6.825 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -6.232 14.030 7.143 1.00 0.00 H new ATOM 2245 N TRP A 137 -4.731 12.606 3.286 1.00 0.00 N ATOM 2246 CA TRP A 137 -3.728 13.054 2.334 1.00 0.00 C ATOM 2247 C TRP A 137 -4.437 13.857 1.243 1.00 0.00 C ATOM 2248 O TRP A 137 -3.809 14.650 0.543 1.00 0.00 O ATOM 2249 CB TRP A 137 -2.930 11.871 1.783 1.00 0.00 C ATOM 2250 CG TRP A 137 -1.655 11.559 2.570 1.00 0.00 C ATOM 2251 CD1 TRP A 137 -1.532 11.336 3.886 1.00 0.00 C ATOM 2252 CD2 TRP A 137 -0.320 11.443 2.034 1.00 0.00 C ATOM 2253 NE1 TRP A 137 -0.221 11.086 4.236 1.00 0.00 N ATOM 2254 CE2 TRP A 137 0.539 11.153 3.074 1.00 0.00 C ATOM 2255 CE3 TRP A 137 0.146 11.578 0.715 1.00 0.00 C ATOM 2256 CZ2 TRP A 137 1.917 10.974 2.903 1.00 0.00 C ATOM 2257 CZ3 TRP A 137 1.525 11.397 0.560 1.00 0.00 C ATOM 2258 CH2 TRP A 137 2.404 11.105 1.596 1.00 0.00 C ATOM 0 H TRP A 137 -4.757 11.597 3.436 1.00 0.00 H new ATOM 0 HA TRP A 137 -2.995 13.699 2.819 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -3.567 10.987 1.778 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.663 12.077 0.746 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -2.356 11.350 4.585 1.00 0.00 H new ATOM 0 HE1 TRP A 137 0.126 10.888 5.174 1.00 0.00 H new ATOM 0 HE3 TRP A 137 -0.509 11.804 -0.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 2.569 10.747 3.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.935 11.491 -0.435 1.00 0.00 H new ATOM 0 HH2 TRP A 137 3.458 10.980 1.394 1.00 0.00 H new ATOM 2269 N ARG A 138 -5.737 13.625 1.131 1.00 0.00 N ATOM 2270 CA ARG A 138 -6.538 14.317 0.136 1.00 0.00 C ATOM 2271 C ARG A 138 -6.260 15.821 0.184 1.00 0.00 C ATOM 2272 O ARG A 138 -6.262 16.489 -0.849 1.00 0.00 O ATOM 2273 CB ARG A 138 -8.031 14.074 0.365 1.00 0.00 C ATOM 2274 CG ARG A 138 -8.694 13.511 -0.894 1.00 0.00 C ATOM 2275 CD ARG A 138 -9.035 14.629 -1.881 1.00 0.00 C ATOM 2276 NE ARG A 138 -10.468 14.983 -1.770 1.00 0.00 N ATOM 2277 CZ ARG A 138 -11.123 15.771 -2.647 1.00 0.00 C ATOM 2278 NH1 ARG A 138 -10.478 16.296 -3.711 1.00 0.00 N ATOM 2279 NH2 ARG A 138 -12.404 16.022 -2.451 1.00 0.00 N ATOM 0 H ARG A 138 -6.255 12.967 1.713 1.00 0.00 H new ATOM 0 HA ARG A 138 -6.263 13.924 -0.843 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.167 13.379 1.194 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -8.516 15.008 0.649 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.027 12.792 -1.370 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -9.602 12.972 -0.621 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -8.419 15.505 -1.678 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -8.809 14.309 -2.898 1.00 0.00 H new ATOM 0 HE ARG A 138 -10.993 14.607 -0.980 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -9.488 16.098 -3.856 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -10.981 16.891 -4.370 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -12.885 15.622 -1.645 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -12.913 16.616 -3.105 1.00 0.00 H new ATOM 2292 N SER A 139 -6.028 16.309 1.393 1.00 0.00 N ATOM 2293 CA SER A 139 -5.749 17.722 1.589 1.00 0.00 C ATOM 2294 C SER A 139 -4.506 18.125 0.794 1.00 0.00 C ATOM 2295 O SER A 139 -4.252 19.311 0.591 1.00 0.00 O ATOM 2296 CB SER A 139 -5.558 18.045 3.072 1.00 0.00 C ATOM 2297 OG SER A 139 -6.741 17.802 3.829 1.00 0.00 O ATOM 0 H SER A 139 -6.027 15.752 2.247 1.00 0.00 H new ATOM 0 HA SER A 139 -6.604 18.293 1.228 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.742 17.443 3.472 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.266 19.090 3.181 1.00 0.00 H new ATOM 0 HG SER A 139 -6.577 18.019 4.771 1.00 0.00 H new ATOM 2303 N ASN A 140 -3.764 17.115 0.364 1.00 0.00 N ATOM 2304 CA ASN A 140 -2.554 17.349 -0.404 1.00 0.00 C ATOM 2305 C ASN A 140 -2.713 16.736 -1.797 1.00 0.00 C ATOM 2306 O ASN A 140 -2.282 15.609 -2.036 1.00 0.00 O ATOM 2307 CB ASN A 140 -1.342 16.697 0.264 1.00 0.00 C ATOM 2308 CG ASN A 140 -1.353 16.937 1.775 1.00 0.00 C ATOM 2309 OD1 ASN A 140 -2.142 16.104 2.449 1.00 0.00 O flip ATOM 2310 ND2 ASN A 140 -0.690 17.819 2.294 1.00 0.00 N flip ATOM 0 H ASN A 140 -3.978 16.132 0.533 1.00 0.00 H new ATOM 0 HA ASN A 140 -2.396 18.426 -0.464 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -1.344 15.626 0.062 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -0.425 17.101 -0.165 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -0.105 18.424 1.717 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -0.720 17.952 3.305 1.00 0.00 H new ATOM 2317 N PRO A 141 -3.349 17.526 -2.704 1.00 0.00 N ATOM 2318 CA PRO A 141 -3.570 17.072 -4.066 1.00 0.00 C ATOM 2319 C PRO A 141 -2.274 17.124 -4.878 1.00 0.00 C ATOM 2320 O PRO A 141 -1.184 17.189 -4.312 1.00 0.00 O ATOM 2321 CB PRO A 141 -4.652 17.988 -4.615 1.00 0.00 C ATOM 2322 CG PRO A 141 -4.666 19.207 -3.707 1.00 0.00 C ATOM 2323 CD PRO A 141 -3.872 18.866 -2.456 1.00 0.00 C ATOM 0 HA PRO A 141 -3.886 16.030 -4.116 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -4.438 18.271 -5.646 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -5.622 17.490 -4.616 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -4.228 20.066 -4.215 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -5.689 19.478 -3.448 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -3.066 19.581 -2.291 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -4.504 18.887 -1.568 1.00 0.00 H new ATOM 2331 N SER A 142 -2.436 17.093 -6.193 1.00 0.00 N ATOM 2332 CA SER A 142 -1.292 17.135 -7.089 1.00 0.00 C ATOM 2333 C SER A 142 -0.228 18.085 -6.535 1.00 0.00 C ATOM 2334 O SER A 142 0.935 17.708 -6.400 1.00 0.00 O ATOM 2335 CB SER A 142 -1.710 17.569 -8.495 1.00 0.00 C ATOM 2336 OG SER A 142 -0.618 17.541 -9.409 1.00 0.00 O ATOM 0 H SER A 142 -3.342 17.039 -6.659 1.00 0.00 H new ATOM 0 HA SER A 142 -0.874 16.131 -7.157 1.00 0.00 H new ATOM 0 HB2 SER A 142 -2.502 16.913 -8.856 1.00 0.00 H new ATOM 0 HB3 SER A 142 -2.124 18.577 -8.455 1.00 0.00 H new ATOM 0 HG SER A 142 -0.926 17.823 -10.296 1.00 0.00 H new ATOM 2342 N GLU A 143 -0.665 19.297 -6.227 1.00 0.00 N ATOM 2343 CA GLU A 143 0.236 20.303 -5.691 1.00 0.00 C ATOM 2344 C GLU A 143 -0.534 21.290 -4.811 1.00 0.00 C ATOM 2345 O GLU A 143 -1.751 21.421 -4.937 1.00 0.00 O ATOM 2346 CB GLU A 143 0.976 21.032 -6.814 1.00 0.00 C ATOM 2347 CG GLU A 143 2.239 20.272 -7.223 1.00 0.00 C ATOM 2348 CD GLU A 143 3.145 21.143 -8.094 1.00 0.00 C ATOM 2349 OE1 GLU A 143 3.440 22.291 -7.729 1.00 0.00 O ATOM 2350 OE2 GLU A 143 3.549 20.588 -9.187 1.00 0.00 O ATOM 0 H GLU A 143 -1.631 19.605 -6.338 1.00 0.00 H new ATOM 0 HA GLU A 143 0.983 19.802 -5.075 1.00 0.00 H new ATOM 0 HB2 GLU A 143 0.318 21.142 -7.676 1.00 0.00 H new ATOM 0 HB3 GLU A 143 1.242 22.037 -6.486 1.00 0.00 H new ATOM 0 HG2 GLU A 143 2.781 19.954 -6.332 1.00 0.00 H new ATOM 0 HG3 GLU A 143 1.964 19.369 -7.768 1.00 0.00 H new ATOM 2358 N ASP A 144 0.206 21.959 -3.939 1.00 0.00 N ATOM 2359 CA ASP A 144 -0.392 22.930 -3.039 1.00 0.00 C ATOM 2360 C ASP A 144 -1.432 23.753 -3.801 1.00 0.00 C ATOM 2361 O ASP A 144 -1.224 24.099 -4.963 1.00 0.00 O ATOM 2362 CB ASP A 144 0.662 23.892 -2.488 1.00 0.00 C ATOM 2363 CG ASP A 144 0.120 24.986 -1.566 1.00 0.00 C ATOM 2364 OD1 ASP A 144 -0.434 24.702 -0.494 1.00 0.00 O ATOM 2365 OD2 ASP A 144 0.286 26.192 -1.995 1.00 0.00 O ATOM 0 H ASP A 144 1.215 21.848 -3.837 1.00 0.00 H new ATOM 0 HA ASP A 144 -0.851 22.386 -2.213 1.00 0.00 H new ATOM 0 HB2 ASP A 144 1.409 23.315 -1.942 1.00 0.00 H new ATOM 0 HB3 ASP A 144 1.174 24.365 -3.326 1.00 0.00 H new ATOM 2371 N SER A 145 -2.528 24.044 -3.116 1.00 0.00 N ATOM 2372 CA SER A 145 -3.600 24.820 -3.715 1.00 0.00 C ATOM 2373 C SER A 145 -4.755 24.970 -2.722 1.00 0.00 C ATOM 2374 O SER A 145 -5.317 23.976 -2.264 1.00 0.00 O ATOM 2375 CB SER A 145 -4.094 24.171 -5.009 1.00 0.00 C ATOM 2376 OG SER A 145 -5.304 24.763 -5.475 1.00 0.00 O ATOM 0 H SER A 145 -2.697 23.756 -2.152 1.00 0.00 H new ATOM 0 HA SER A 145 -3.210 25.808 -3.962 1.00 0.00 H new ATOM 0 HB2 SER A 145 -3.326 24.263 -5.777 1.00 0.00 H new ATOM 0 HB3 SER A 145 -4.252 23.105 -4.843 1.00 0.00 H new ATOM 0 HG SER A 145 -5.586 24.322 -6.304 1.00 0.00 H new ATOM 2382 N ASP A 146 -5.074 26.219 -2.418 1.00 0.00 N ATOM 2383 CA ASP A 146 -6.151 26.512 -1.488 1.00 0.00 C ATOM 2384 C ASP A 146 -5.825 25.895 -0.126 1.00 0.00 C ATOM 2385 O ASP A 146 -5.139 24.877 -0.050 1.00 0.00 O ATOM 2386 CB ASP A 146 -7.474 25.915 -1.972 1.00 0.00 C ATOM 2387 CG ASP A 146 -8.697 26.816 -1.785 1.00 0.00 C ATOM 2388 OD1 ASP A 146 -9.703 26.410 -1.185 1.00 0.00 O ATOM 2389 OD2 ASP A 146 -8.587 27.997 -2.293 1.00 0.00 O ATOM 0 H ASP A 146 -4.605 27.041 -2.800 1.00 0.00 H new ATOM 0 HA ASP A 146 -6.249 27.595 -1.416 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -7.380 25.671 -3.030 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -7.648 24.978 -1.443 1.00 0.00 H new ATOM 2395 N PRO A 147 -6.346 26.555 0.943 1.00 0.00 N ATOM 2396 CA PRO A 147 -6.117 26.082 2.298 1.00 0.00 C ATOM 2397 C PRO A 147 -6.970 24.849 2.600 1.00 0.00 C ATOM 2398 O PRO A 147 -6.474 23.867 3.151 1.00 0.00 O ATOM 2399 CB PRO A 147 -6.450 27.268 3.189 1.00 0.00 C ATOM 2400 CG PRO A 147 -7.293 28.204 2.339 1.00 0.00 C ATOM 2401 CD PRO A 147 -7.163 27.763 0.891 1.00 0.00 C ATOM 0 HA PRO A 147 -5.091 25.753 2.461 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -6.996 26.948 4.077 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -5.543 27.764 3.534 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -8.336 28.172 2.656 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -6.956 29.234 2.456 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -8.139 27.562 0.449 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -6.691 28.535 0.283 1.00 0.00 H new ATOM 2409 N GLY A 148 -8.237 24.939 2.226 1.00 0.00 N ATOM 2410 CA GLY A 148 -9.164 23.842 2.450 1.00 0.00 C ATOM 2411 C GLY A 148 -10.524 24.361 2.921 1.00 0.00 C ATOM 2412 O GLY A 148 -11.105 23.823 3.863 1.00 0.00 O ATOM 0 H GLY A 148 -8.644 25.755 1.769 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -9.287 23.272 1.529 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.753 23.160 3.195 1.00 0.00 H new ATOM 2416 N LYS A 149 -10.992 25.400 2.246 1.00 0.00 N ATOM 2417 CA LYS A 149 -12.273 25.997 2.584 1.00 0.00 C ATOM 2418 C LYS A 149 -12.131 26.795 3.882 1.00 0.00 C ATOM 2419 O LYS A 149 -11.488 26.341 4.827 1.00 0.00 O ATOM 2420 CB LYS A 149 -13.366 24.928 2.635 1.00 0.00 C ATOM 2421 CG LYS A 149 -14.724 25.514 2.243 1.00 0.00 C ATOM 2422 CD LYS A 149 -15.696 24.410 1.822 1.00 0.00 C ATOM 2423 CE LYS A 149 -17.034 24.551 2.550 1.00 0.00 C ATOM 2424 NZ LYS A 149 -17.868 25.589 1.904 1.00 0.00 N ATOM 0 H LYS A 149 -10.507 25.844 1.466 1.00 0.00 H new ATOM 0 HA LYS A 149 -12.583 26.699 1.810 1.00 0.00 H new ATOM 0 HB2 LYS A 149 -13.111 24.110 1.962 1.00 0.00 H new ATOM 0 HB3 LYS A 149 -13.423 24.509 3.639 1.00 0.00 H new ATOM 0 HG2 LYS A 149 -15.141 26.070 3.083 1.00 0.00 H new ATOM 0 HG3 LYS A 149 -14.596 26.222 1.425 1.00 0.00 H new ATOM 0 HD2 LYS A 149 -15.858 24.454 0.745 1.00 0.00 H new ATOM 0 HD3 LYS A 149 -15.261 23.435 2.039 1.00 0.00 H new ATOM 0 HE2 LYS A 149 -17.561 23.597 2.544 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -16.861 24.813 3.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -18.773 25.672 2.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -17.370 26.502 1.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 -18.048 25.324 0.915 1.00 0.00 H new ATOM 2437 N ARG A 150 -12.744 27.970 3.887 1.00 0.00 N ATOM 2438 CA ARG A 150 -12.695 28.834 5.054 1.00 0.00 C ATOM 2439 C ARG A 150 -14.055 28.859 5.754 1.00 0.00 C ATOM 2440 O ARG A 150 -15.090 29.001 5.104 1.00 0.00 O ATOM 2441 CB ARG A 150 -12.303 30.261 4.665 1.00 0.00 C ATOM 2442 CG ARG A 150 -11.078 30.728 5.454 1.00 0.00 C ATOM 2443 CD ARG A 150 -11.474 31.730 6.540 1.00 0.00 C ATOM 2444 NE ARG A 150 -10.343 31.939 7.472 1.00 0.00 N ATOM 2445 CZ ARG A 150 -9.899 31.008 8.344 1.00 0.00 C ATOM 2446 NH1 ARG A 150 -10.487 29.795 8.410 1.00 0.00 N ATOM 2447 NH2 ARG A 150 -8.881 31.303 9.130 1.00 0.00 N ATOM 0 H ARG A 150 -13.277 28.344 3.102 1.00 0.00 H new ATOM 0 HA ARG A 150 -11.941 28.434 5.732 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -12.090 30.305 3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -13.139 30.935 4.852 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -10.585 29.869 5.909 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -10.358 31.187 4.776 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -11.761 32.678 6.085 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -12.343 31.363 7.086 1.00 0.00 H new ATOM 0 HE ARG A 150 -9.870 32.842 7.455 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -11.273 29.575 7.798 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -10.145 29.098 9.071 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -8.442 32.222 9.073 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -8.533 30.612 9.794 1.00 0.00 H new TER 2460 ARG A 150