USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 521 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 132 THR OG1 : rot 42:sc= -1.93! USER MOD Set 1.2: A 134 LYS NZ :NH3+ 170:sc= 0.517 (180deg=-0.982) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.0213 K(o=-0.021,f=-1) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc=-0.00219 USER MOD Single : A 96 SER OG : rot -38:sc= -0.35! USER MOD Single : A 101 TYR OH : rot 30:sc= -0.468 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 41:sc= 0.0936 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 113 THR OG1 : rot 12:sc= 1.19 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 8:sc= -2.82! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 160:sc= -0.0499 (180deg=-0.547) USER MOD Single : A 133 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0104) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot -51:sc= 0.44! USER MOD Single : A 142 LYS NZ :NH3+ -115:sc= -1.41 (180deg=-4.26!) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 168:sc= 0.0383 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.307 -0.157 -6.589 1.00 0.00 N ATOM 17 CA ALA A 82 35.141 -1.456 -5.966 1.00 0.00 C ATOM 18 C ALA A 82 33.678 -1.693 -5.618 1.00 0.00 C ATOM 19 O ALA A 82 33.203 -1.287 -4.561 1.00 0.00 O ATOM 20 CB ALA A 82 35.991 -1.535 -4.695 1.00 0.00 C ATOM 0 HA ALA A 82 35.466 -2.224 -6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.862 -2.513 -4.231 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.041 -1.390 -4.950 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.676 -0.759 -3.998 1.00 0.00 H new ATOM 26 N TYR A 83 32.977 -2.371 -6.505 1.00 0.00 N ATOM 27 CA TYR A 83 31.566 -2.683 -6.292 1.00 0.00 C ATOM 28 C TYR A 83 31.355 -3.218 -4.881 1.00 0.00 C ATOM 29 O TYR A 83 30.233 -3.273 -4.385 1.00 0.00 O ATOM 30 CB TYR A 83 31.090 -3.728 -7.313 1.00 0.00 C ATOM 31 CG TYR A 83 31.764 -3.476 -8.643 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.764 -2.189 -9.198 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.386 -4.530 -9.323 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.389 -1.958 -10.427 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.011 -4.298 -10.554 1.00 0.00 C ATOM 36 CZ TYR A 83 33.011 -3.013 -11.107 1.00 0.00 C ATOM 37 OH TYR A 83 33.625 -2.784 -12.321 1.00 0.00 O ATOM 0 H TYR A 83 33.357 -2.720 -7.385 1.00 0.00 H new ATOM 0 HA TYR A 83 30.987 -1.769 -6.421 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.325 -4.732 -6.959 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.007 -3.675 -7.426 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.281 -1.376 -8.676 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.384 -5.523 -8.898 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.392 -0.965 -10.853 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.493 -5.111 -11.077 1.00 0.00 H new ATOM 0 HH TYR A 83 34.008 -3.621 -12.657 1.00 0.00 H new ATOM 47 N LYS A 84 32.446 -3.600 -4.237 1.00 0.00 N ATOM 48 CA LYS A 84 32.373 -4.118 -2.870 1.00 0.00 C ATOM 49 C LYS A 84 31.891 -3.027 -1.921 1.00 0.00 C ATOM 50 O LYS A 84 31.097 -3.275 -1.013 1.00 0.00 O ATOM 51 CB LYS A 84 33.745 -4.625 -2.424 1.00 0.00 C ATOM 52 CG LYS A 84 34.137 -5.842 -3.266 1.00 0.00 C ATOM 53 CD LYS A 84 35.515 -6.340 -2.830 1.00 0.00 C ATOM 54 CE LYS A 84 35.912 -7.547 -3.679 1.00 0.00 C ATOM 55 NZ LYS A 84 37.267 -8.015 -3.271 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.387 -3.564 -4.630 1.00 0.00 H new ATOM 0 HA LYS A 84 31.665 -4.946 -2.848 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.490 -3.837 -2.535 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.720 -4.893 -1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.398 -6.634 -3.146 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.152 -5.577 -4.323 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.253 -5.545 -2.941 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.498 -6.614 -1.775 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.185 -8.349 -3.553 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.911 -7.279 -4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 37.539 -8.837 -3.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.956 -7.249 -3.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 37.253 -8.286 -2.267 1.00 0.00 H new ATOM 69 N ASN A 85 32.392 -1.815 -2.139 1.00 0.00 N ATOM 70 CA ASN A 85 32.016 -0.681 -1.293 1.00 0.00 C ATOM 71 C ASN A 85 30.541 -0.340 -1.469 1.00 0.00 C ATOM 72 O ASN A 85 29.813 -0.164 -0.491 1.00 0.00 O ATOM 73 CB ASN A 85 32.869 0.537 -1.650 1.00 0.00 C ATOM 74 CG ASN A 85 32.688 1.629 -0.601 1.00 0.00 C ATOM 75 OD1 ASN A 85 32.562 1.336 0.587 1.00 0.00 O ATOM 76 ND2 ASN A 85 32.668 2.879 -0.973 1.00 0.00 N ATOM 0 H ASN A 85 33.052 -1.591 -2.884 1.00 0.00 H new ATOM 0 HA ASN A 85 32.188 -0.957 -0.253 1.00 0.00 H new ATOM 0 HB2 ASN A 85 33.919 0.250 -1.710 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.585 0.915 -2.632 1.00 0.00 H new ATOM 0 HD21 ASN A 85 32.548 3.616 -0.278 1.00 0.00 H new ATOM 0 HD22 ASN A 85 32.773 3.119 -1.959 1.00 0.00 H new ATOM 83 N LEU A 86 30.108 -0.239 -2.717 1.00 0.00 N ATOM 84 CA LEU A 86 28.724 0.096 -3.003 1.00 0.00 C ATOM 85 C LEU A 86 27.782 -0.945 -2.412 1.00 0.00 C ATOM 86 O LEU A 86 26.743 -0.608 -1.847 1.00 0.00 O ATOM 87 CB LEU A 86 28.518 0.174 -4.513 1.00 0.00 C ATOM 88 CG LEU A 86 27.057 0.586 -4.825 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.038 1.591 -5.978 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.241 -0.653 -5.219 1.00 0.00 C ATOM 0 H LEU A 86 30.691 -0.383 -3.541 1.00 0.00 H new ATOM 0 HA LEU A 86 28.501 1.062 -2.550 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.209 0.897 -4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.738 -0.791 -4.969 1.00 0.00 H new ATOM 0 HG LEU A 86 26.619 1.042 -3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.009 1.878 -6.194 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.610 2.476 -5.699 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.481 1.137 -6.864 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.215 -0.358 -5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.682 -1.113 -6.103 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.246 -1.368 -4.397 1.00 0.00 H new ATOM 102 N LEU A 87 28.148 -2.210 -2.551 1.00 0.00 N ATOM 103 CA LEU A 87 27.323 -3.295 -2.035 1.00 0.00 C ATOM 104 C LEU A 87 27.065 -3.095 -0.547 1.00 0.00 C ATOM 105 O LEU A 87 25.984 -3.407 -0.049 1.00 0.00 O ATOM 106 CB LEU A 87 28.034 -4.635 -2.258 1.00 0.00 C ATOM 107 CG LEU A 87 27.893 -5.047 -3.729 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.892 -6.163 -4.045 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.462 -5.545 -4.002 1.00 0.00 C ATOM 0 H LEU A 87 29.006 -2.511 -3.014 1.00 0.00 H new ATOM 0 HA LEU A 87 26.370 -3.297 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.088 -4.549 -1.992 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.604 -5.400 -1.612 1.00 0.00 H new ATOM 0 HG LEU A 87 28.097 -4.184 -4.362 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.792 -6.456 -5.090 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.906 -5.806 -3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.691 -7.023 -3.406 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.371 -5.835 -5.049 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.249 -6.405 -3.367 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.751 -4.748 -3.784 1.00 0.00 H new ATOM 121 N GLN A 88 28.061 -2.576 0.153 1.00 0.00 N ATOM 122 CA GLN A 88 27.929 -2.324 1.582 1.00 0.00 C ATOM 123 C GLN A 88 26.993 -1.144 1.830 1.00 0.00 C ATOM 124 O GLN A 88 26.248 -1.129 2.813 1.00 0.00 O ATOM 125 CB GLN A 88 29.300 -2.026 2.187 1.00 0.00 C ATOM 126 CG GLN A 88 30.156 -3.290 2.138 1.00 0.00 C ATOM 127 CD GLN A 88 31.554 -2.995 2.670 1.00 0.00 C ATOM 128 OE1 GLN A 88 31.826 -1.879 3.112 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.460 -3.932 2.654 1.00 0.00 N ATOM 0 H GLN A 88 28.967 -2.321 -0.241 1.00 0.00 H new ATOM 0 HA GLN A 88 27.510 -3.213 2.054 1.00 0.00 H new ATOM 0 HB2 GLN A 88 29.787 -1.221 1.636 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.190 -1.686 3.217 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.691 -4.077 2.731 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.218 -3.658 1.114 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.232 -4.856 2.287 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.397 -3.741 3.008 1.00 0.00 H new ATOM 138 N GLU A 89 27.053 -0.146 0.946 1.00 0.00 N ATOM 139 CA GLU A 89 26.214 1.041 1.102 1.00 0.00 C ATOM 140 C GLU A 89 24.737 0.669 1.058 1.00 0.00 C ATOM 141 O GLU A 89 23.961 1.075 1.922 1.00 0.00 O ATOM 142 CB GLU A 89 26.527 2.039 -0.014 1.00 0.00 C ATOM 143 CG GLU A 89 27.956 2.563 0.146 1.00 0.00 C ATOM 144 CD GLU A 89 28.060 3.419 1.404 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.032 3.896 1.856 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.164 3.586 1.896 1.00 0.00 O1- ATOM 0 H GLU A 89 27.663 -0.136 0.129 1.00 0.00 H new ATOM 0 HA GLU A 89 26.428 1.493 2.071 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.412 1.559 -0.986 1.00 0.00 H new ATOM 0 HB3 GLU A 89 25.820 2.868 0.018 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.654 1.728 0.206 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.237 3.151 -0.728 1.00 0.00 H new ATOM 153 N ILE A 90 24.360 -0.109 0.054 1.00 0.00 N ATOM 154 CA ILE A 90 22.973 -0.535 -0.091 1.00 0.00 C ATOM 155 C ILE A 90 22.571 -1.454 1.059 1.00 0.00 C ATOM 156 O ILE A 90 21.432 -1.427 1.517 1.00 0.00 O ATOM 157 CB ILE A 90 22.790 -1.256 -1.427 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.795 -2.404 -1.526 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.020 -0.274 -2.577 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.581 -3.159 -2.837 1.00 0.00 C ATOM 0 H ILE A 90 24.990 -0.457 -0.669 1.00 0.00 H new ATOM 0 HA ILE A 90 22.332 0.347 -0.068 1.00 0.00 H new ATOM 0 HB ILE A 90 21.777 -1.652 -1.489 1.00 0.00 H new ATOM 0 HG12 ILE A 90 24.812 -2.015 -1.480 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.674 -3.081 -0.680 1.00 0.00 H new ATOM 0 HG21 ILE A 90 22.889 -0.790 -3.528 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.303 0.544 -2.506 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.032 0.125 -2.517 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.298 -3.977 -2.907 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.568 -3.561 -2.864 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.724 -2.478 -3.676 1.00 0.00 H new ATOM 172 N ALA A 91 23.510 -2.278 1.507 1.00 0.00 N ATOM 173 CA ALA A 91 23.236 -3.209 2.596 1.00 0.00 C ATOM 174 C ALA A 91 22.810 -2.454 3.850 1.00 0.00 C ATOM 175 O ALA A 91 21.790 -2.774 4.463 1.00 0.00 O ATOM 176 CB ALA A 91 24.484 -4.041 2.901 1.00 0.00 C ATOM 0 H ALA A 91 24.460 -2.322 1.138 1.00 0.00 H new ATOM 0 HA ALA A 91 22.426 -3.870 2.288 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.270 -4.733 3.715 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.772 -4.604 2.013 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.300 -3.380 3.192 1.00 0.00 H new ATOM 182 N GLN A 92 23.594 -1.451 4.228 1.00 0.00 N ATOM 183 CA GLN A 92 23.282 -0.657 5.411 1.00 0.00 C ATOM 184 C GLN A 92 22.062 0.223 5.166 1.00 0.00 C ATOM 185 O GLN A 92 21.183 0.333 6.022 1.00 0.00 O ATOM 186 CB GLN A 92 24.480 0.222 5.779 1.00 0.00 C ATOM 187 CG GLN A 92 25.649 -0.661 6.219 1.00 0.00 C ATOM 188 CD GLN A 92 26.858 0.204 6.555 1.00 0.00 C ATOM 189 OE1 GLN A 92 26.774 1.431 6.520 1.00 0.00 O ATOM 190 NE2 GLN A 92 27.985 -0.367 6.882 1.00 0.00 N ATOM 0 H GLN A 92 24.443 -1.170 3.738 1.00 0.00 H new ATOM 0 HA GLN A 92 23.062 -1.339 6.232 1.00 0.00 H new ATOM 0 HB2 GLN A 92 24.773 0.831 4.924 1.00 0.00 H new ATOM 0 HB3 GLN A 92 24.208 0.908 6.581 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.362 -1.252 7.088 1.00 0.00 H new ATOM 0 HG3 GLN A 92 25.903 -1.364 5.426 1.00 0.00 H new ATOM 0 HE21 GLN A 92 28.052 -1.384 6.910 1.00 0.00 H new ATOM 0 HE22 GLN A 92 28.799 0.204 7.109 1.00 0.00 H new ATOM 199 N LYS A 93 22.018 0.853 3.995 1.00 0.00 N ATOM 200 CA LYS A 93 20.902 1.730 3.653 1.00 0.00 C ATOM 201 C LYS A 93 19.588 0.956 3.658 1.00 0.00 C ATOM 202 O LYS A 93 18.617 1.370 4.290 1.00 0.00 O ATOM 203 CB LYS A 93 21.132 2.342 2.268 1.00 0.00 C ATOM 204 CG LYS A 93 20.019 3.346 1.964 1.00 0.00 C ATOM 205 CD LYS A 93 20.297 4.026 0.623 1.00 0.00 C ATOM 206 CE LYS A 93 19.194 5.044 0.328 1.00 0.00 C ATOM 207 NZ LYS A 93 19.469 5.711 -0.976 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.735 0.774 3.273 1.00 0.00 H new ATOM 0 HA LYS A 93 20.843 2.523 4.399 1.00 0.00 H new ATOM 0 HB2 LYS A 93 22.102 2.837 2.234 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.147 1.559 1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 93 19.055 2.838 1.933 1.00 0.00 H new ATOM 0 HG3 LYS A 93 19.961 4.092 2.757 1.00 0.00 H new ATOM 0 HD2 LYS A 93 21.267 4.522 0.649 1.00 0.00 H new ATOM 0 HD3 LYS A 93 20.341 3.282 -0.172 1.00 0.00 H new ATOM 0 HE2 LYS A 93 18.224 4.547 0.297 1.00 0.00 H new ATOM 0 HE3 LYS A 93 19.146 5.786 1.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 18.719 6.403 -1.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 20.387 6.198 -0.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 19.493 4.998 -1.732 1.00 0.00 H new ATOM 221 N GLU A 94 19.565 -0.168 2.956 1.00 0.00 N ATOM 222 CA GLU A 94 18.363 -0.991 2.892 1.00 0.00 C ATOM 223 C GLU A 94 18.096 -1.642 4.243 1.00 0.00 C ATOM 224 O GLU A 94 17.100 -2.346 4.417 1.00 0.00 O ATOM 225 CB GLU A 94 18.524 -2.078 1.824 1.00 0.00 C ATOM 226 CG GLU A 94 18.630 -1.429 0.441 1.00 0.00 C ATOM 227 CD GLU A 94 17.313 -0.748 0.080 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.307 -1.099 0.675 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.330 0.112 -0.783 1.00 0.00 O1- ATOM 0 H GLU A 94 20.358 -0.530 2.426 1.00 0.00 H new ATOM 0 HA GLU A 94 17.520 -0.351 2.631 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.415 -2.672 2.027 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.673 -2.759 1.853 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.440 -0.699 0.434 1.00 0.00 H new ATOM 0 HG3 GLU A 94 18.875 -2.184 -0.306 1.00 0.00 H new ATOM 236 N SER A 95 18.994 -1.406 5.194 1.00 0.00 N ATOM 237 CA SER A 95 18.846 -1.975 6.528 1.00 0.00 C ATOM 238 C SER A 95 18.880 -3.500 6.462 1.00 0.00 C ATOM 239 O SER A 95 18.472 -4.181 7.403 1.00 0.00 O ATOM 240 CB SER A 95 17.521 -1.518 7.145 1.00 0.00 C ATOM 241 OG SER A 95 17.281 -0.163 6.788 1.00 0.00 O ATOM 0 H SER A 95 19.826 -0.829 5.067 1.00 0.00 H new ATOM 0 HA SER A 95 19.673 -1.629 7.148 1.00 0.00 H new ATOM 0 HB2 SER A 95 16.705 -2.149 6.793 1.00 0.00 H new ATOM 0 HB3 SER A 95 17.557 -1.620 8.230 1.00 0.00 H new ATOM 0 HG SER A 95 16.433 0.133 7.180 1.00 0.00 H new ATOM 247 N SER A 96 19.366 -4.026 5.343 1.00 0.00 N ATOM 248 CA SER A 96 19.445 -5.468 5.157 1.00 0.00 C ATOM 249 C SER A 96 20.562 -6.049 6.012 1.00 0.00 C ATOM 250 O SER A 96 20.590 -5.856 7.227 1.00 0.00 O ATOM 251 CB SER A 96 19.698 -5.795 3.691 1.00 0.00 C ATOM 252 OG SER A 96 21.028 -5.430 3.349 1.00 0.00 O ATOM 0 H SER A 96 19.710 -3.477 4.555 1.00 0.00 H new ATOM 0 HA SER A 96 18.497 -5.910 5.463 1.00 0.00 H new ATOM 0 HB2 SER A 96 19.544 -6.859 3.512 1.00 0.00 H new ATOM 0 HB3 SER A 96 18.989 -5.260 3.060 1.00 0.00 H new ATOM 0 HG SER A 96 21.263 -4.591 3.798 1.00 0.00 H new ATOM 258 N LEU A 97 21.482 -6.768 5.372 1.00 0.00 N ATOM 259 CA LEU A 97 22.602 -7.381 6.084 1.00 0.00 C ATOM 260 C LEU A 97 23.894 -7.210 5.302 1.00 0.00 C ATOM 261 O LEU A 97 23.957 -7.535 4.118 1.00 0.00 O ATOM 262 CB LEU A 97 22.326 -8.872 6.293 1.00 0.00 C ATOM 263 CG LEU A 97 21.110 -9.046 7.213 1.00 0.00 C ATOM 264 CD1 LEU A 97 20.698 -10.515 7.239 1.00 0.00 C ATOM 265 CD2 LEU A 97 21.463 -8.582 8.638 1.00 0.00 C ATOM 0 H LEU A 97 21.475 -6.940 4.367 1.00 0.00 H new ATOM 0 HA LEU A 97 22.710 -6.887 7.050 1.00 0.00 H new ATOM 0 HB2 LEU A 97 22.141 -9.356 5.334 1.00 0.00 H new ATOM 0 HB3 LEU A 97 23.199 -9.356 6.731 1.00 0.00 H new ATOM 0 HG LEU A 97 20.284 -8.444 6.836 1.00 0.00 H new ATOM 0 HD11 LEU A 97 19.834 -10.639 7.892 1.00 0.00 H new ATOM 0 HD12 LEU A 97 20.440 -10.838 6.231 1.00 0.00 H new ATOM 0 HD13 LEU A 97 21.525 -11.118 7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 97 20.596 -8.708 9.287 1.00 0.00 H new ATOM 0 HD22 LEU A 97 22.292 -9.178 9.020 1.00 0.00 H new ATOM 0 HD23 LEU A 97 21.751 -7.531 8.617 1.00 0.00 H new ATOM 277 N LEU A 98 24.925 -6.699 5.969 1.00 0.00 N ATOM 278 CA LEU A 98 26.205 -6.488 5.316 1.00 0.00 C ATOM 279 C LEU A 98 26.588 -7.703 4.472 1.00 0.00 C ATOM 280 O LEU A 98 26.186 -8.830 4.767 1.00 0.00 O ATOM 281 CB LEU A 98 27.294 -6.232 6.371 1.00 0.00 C ATOM 282 CG LEU A 98 27.280 -4.758 6.779 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.919 -4.411 7.382 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.377 -4.504 7.811 1.00 0.00 C ATOM 0 H LEU A 98 24.897 -6.427 6.952 1.00 0.00 H new ATOM 0 HA LEU A 98 26.118 -5.620 4.662 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.124 -6.863 7.244 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.272 -6.499 5.971 1.00 0.00 H new ATOM 0 HG LEU A 98 27.458 -4.135 5.902 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.907 -3.361 7.673 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.137 -4.592 6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.740 -5.033 8.259 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.367 -3.454 8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.201 -5.125 8.689 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.347 -4.752 7.380 1.00 0.00 H new ATOM 296 N PRO A 99 27.357 -7.488 3.436 1.00 0.00 N ATOM 297 CA PRO A 99 27.808 -8.576 2.524 1.00 0.00 C ATOM 298 C PRO A 99 28.709 -9.581 3.229 1.00 0.00 C ATOM 299 O PRO A 99 29.157 -9.349 4.352 1.00 0.00 O ATOM 300 CB PRO A 99 28.562 -7.832 1.410 1.00 0.00 C ATOM 301 CG PRO A 99 28.981 -6.534 2.024 1.00 0.00 C ATOM 302 CD PRO A 99 27.891 -6.177 3.021 1.00 0.00 C ATOM 0 HA PRO A 99 26.974 -9.169 2.149 1.00 0.00 H new ATOM 0 HB2 PRO A 99 29.425 -8.403 1.068 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.923 -7.670 0.542 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.948 -6.629 2.519 1.00 0.00 H new ATOM 0 HG3 PRO A 99 29.086 -5.758 1.265 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.290 -5.620 3.869 1.00 0.00 H new ATOM 0 HD3 PRO A 99 27.120 -5.556 2.566 1.00 0.00 H new ATOM 310 N PHE A 100 28.984 -10.693 2.554 1.00 0.00 N ATOM 311 CA PHE A 100 29.851 -11.723 3.121 1.00 0.00 C ATOM 312 C PHE A 100 30.682 -12.379 2.027 1.00 0.00 C ATOM 313 O PHE A 100 30.147 -13.047 1.148 1.00 0.00 O ATOM 314 CB PHE A 100 29.002 -12.775 3.826 1.00 0.00 C ATOM 315 CG PHE A 100 29.895 -13.696 4.621 1.00 0.00 C ATOM 316 CD1 PHE A 100 30.450 -13.255 5.828 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.167 -14.987 4.154 1.00 0.00 C ATOM 318 CE1 PHE A 100 31.277 -14.107 6.569 1.00 0.00 C ATOM 319 CE2 PHE A 100 30.994 -15.837 4.895 1.00 0.00 C ATOM 320 CZ PHE A 100 31.550 -15.399 6.103 1.00 0.00 C ATOM 0 H PHE A 100 28.624 -10.904 1.623 1.00 0.00 H new ATOM 0 HA PHE A 100 30.526 -11.259 3.840 1.00 0.00 H new ATOM 0 HB2 PHE A 100 28.281 -12.293 4.486 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.432 -13.347 3.094 1.00 0.00 H new ATOM 0 HD1 PHE A 100 30.240 -12.258 6.187 1.00 0.00 H new ATOM 0 HD2 PHE A 100 29.739 -15.326 3.222 1.00 0.00 H new ATOM 0 HE1 PHE A 100 31.705 -13.768 7.501 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.204 -16.833 4.535 1.00 0.00 H new ATOM 0 HZ PHE A 100 32.188 -16.056 6.674 1.00 0.00 H new ATOM 330 N TYR A 101 31.997 -12.188 2.089 1.00 0.00 N ATOM 331 CA TYR A 101 32.895 -12.769 1.094 1.00 0.00 C ATOM 332 C TYR A 101 33.533 -14.044 1.637 1.00 0.00 C ATOM 333 O TYR A 101 34.008 -14.078 2.772 1.00 0.00 O ATOM 334 CB TYR A 101 33.984 -11.760 0.731 1.00 0.00 C ATOM 335 CG TYR A 101 33.350 -10.561 0.067 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.845 -9.513 0.847 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.276 -10.492 -1.329 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.252 -8.402 0.230 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.685 -9.383 -1.944 1.00 0.00 C ATOM 340 CZ TYR A 101 32.180 -8.335 -1.166 1.00 0.00 C ATOM 341 OH TYR A 101 31.597 -7.241 -1.773 1.00 0.00 O ATOM 0 H TYR A 101 32.462 -11.640 2.812 1.00 0.00 H new ATOM 0 HA TYR A 101 32.319 -13.017 0.202 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.524 -11.452 1.626 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.712 -12.218 0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.912 -9.561 1.924 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.675 -11.295 -1.931 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.851 -7.599 0.831 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.618 -9.336 -3.021 1.00 0.00 H new ATOM 0 HH TYR A 101 31.721 -6.449 -1.209 1.00 0.00 H new ATOM 351 N ALA A 102 33.537 -15.094 0.820 1.00 0.00 N ATOM 352 CA ALA A 102 34.114 -16.372 1.231 1.00 0.00 C ATOM 353 C ALA A 102 34.763 -17.067 0.044 1.00 0.00 C ATOM 354 O ALA A 102 34.297 -16.948 -1.089 1.00 0.00 O ATOM 355 CB ALA A 102 33.026 -17.269 1.818 1.00 0.00 C ATOM 0 H ALA A 102 33.150 -15.087 -0.124 1.00 0.00 H new ATOM 0 HA ALA A 102 34.875 -16.182 1.988 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.463 -18.220 2.122 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.580 -16.781 2.685 1.00 0.00 H new ATOM 0 HB3 ALA A 102 32.257 -17.447 1.067 1.00 0.00 H new ATOM 361 N THR A 103 35.845 -17.794 0.310 1.00 0.00 N ATOM 362 CA THR A 103 36.561 -18.511 -0.745 1.00 0.00 C ATOM 363 C THR A 103 36.709 -19.980 -0.376 1.00 0.00 C ATOM 364 O THR A 103 37.111 -20.312 0.739 1.00 0.00 O ATOM 365 CB THR A 103 37.941 -17.891 -0.948 1.00 0.00 C ATOM 366 OG1 THR A 103 37.793 -16.523 -1.300 1.00 0.00 O ATOM 367 CG2 THR A 103 38.671 -18.634 -2.069 1.00 0.00 C ATOM 0 H THR A 103 36.245 -17.903 1.242 1.00 0.00 H new ATOM 0 HA THR A 103 35.991 -18.434 -1.671 1.00 0.00 H new ATOM 0 HB THR A 103 38.518 -17.969 -0.027 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.677 -16.121 -1.429 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.657 -18.193 -2.216 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.780 -19.684 -1.799 1.00 0.00 H new ATOM 0 HG23 THR A 103 38.097 -18.555 -2.992 1.00 0.00 H new ATOM 375 N ALA A 104 36.387 -20.861 -1.323 1.00 0.00 N ATOM 376 CA ALA A 104 36.492 -22.299 -1.098 1.00 0.00 C ATOM 377 C ALA A 104 37.515 -22.899 -2.052 1.00 0.00 C ATOM 378 O ALA A 104 37.643 -22.456 -3.192 1.00 0.00 O ATOM 379 CB ALA A 104 35.132 -22.958 -1.320 1.00 0.00 C ATOM 0 H ALA A 104 36.052 -20.603 -2.251 1.00 0.00 H new ATOM 0 HA ALA A 104 36.814 -22.476 -0.072 1.00 0.00 H new ATOM 0 HB1 ALA A 104 35.216 -24.032 -1.151 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.406 -22.537 -0.625 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.802 -22.777 -2.343 1.00 0.00 H new ATOM 385 N THR A 105 38.244 -23.914 -1.585 1.00 0.00 N ATOM 386 CA THR A 105 39.249 -24.572 -2.404 1.00 0.00 C ATOM 387 C THR A 105 38.851 -26.017 -2.684 1.00 0.00 C ATOM 388 O THR A 105 38.587 -26.789 -1.761 1.00 0.00 O ATOM 389 CB THR A 105 40.593 -24.536 -1.682 1.00 0.00 C ATOM 390 OG1 THR A 105 40.424 -24.937 -0.331 1.00 0.00 O ATOM 391 CG2 THR A 105 41.170 -23.119 -1.732 1.00 0.00 C ATOM 0 H THR A 105 38.153 -24.294 -0.643 1.00 0.00 H new ATOM 0 HA THR A 105 39.329 -24.046 -3.355 1.00 0.00 H new ATOM 0 HB THR A 105 41.282 -25.221 -2.175 1.00 0.00 H new ATOM 0 HG1 THR A 105 39.801 -25.693 -0.290 1.00 0.00 H new ATOM 0 HG21 THR A 105 42.129 -23.098 -1.215 1.00 0.00 H new ATOM 0 HG22 THR A 105 41.311 -22.820 -2.771 1.00 0.00 H new ATOM 0 HG23 THR A 105 40.481 -22.428 -1.246 1.00 0.00 H new ATOM 399 N SER A 106 38.810 -26.375 -3.965 1.00 0.00 N ATOM 400 CA SER A 106 38.443 -27.731 -4.352 1.00 0.00 C ATOM 401 C SER A 106 38.842 -28.001 -5.794 1.00 0.00 C ATOM 402 O SER A 106 39.054 -27.074 -6.573 1.00 0.00 O ATOM 403 CB SER A 106 36.938 -27.927 -4.191 1.00 0.00 C ATOM 404 OG SER A 106 36.253 -26.896 -4.890 1.00 0.00 O ATOM 0 H SER A 106 39.024 -25.752 -4.744 1.00 0.00 H new ATOM 0 HA SER A 106 38.972 -28.431 -3.705 1.00 0.00 H new ATOM 0 HB2 SER A 106 36.643 -28.902 -4.578 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.668 -27.908 -3.135 1.00 0.00 H new ATOM 0 HG SER A 106 35.286 -27.020 -4.790 1.00 0.00 H new ATOM 410 N GLY A 107 38.934 -29.277 -6.153 1.00 0.00 N ATOM 411 CA GLY A 107 39.299 -29.659 -7.513 1.00 0.00 C ATOM 412 C GLY A 107 40.413 -30.693 -7.503 1.00 0.00 C ATOM 413 O GLY A 107 41.018 -30.964 -6.468 1.00 0.00 O ATOM 0 H GLY A 107 38.762 -30.062 -5.524 1.00 0.00 H new ATOM 0 HA2 GLY A 107 38.427 -30.062 -8.029 1.00 0.00 H new ATOM 0 HA3 GLY A 107 39.619 -28.778 -8.069 1.00 0.00 H new ATOM 417 N PRO A 108 40.703 -31.258 -8.640 1.00 0.00 N ATOM 418 CA PRO A 108 41.779 -32.280 -8.782 1.00 0.00 C ATOM 419 C PRO A 108 43.157 -31.706 -8.456 1.00 0.00 C ATOM 420 O PRO A 108 43.421 -30.528 -8.690 1.00 0.00 O ATOM 421 CB PRO A 108 41.697 -32.694 -10.266 1.00 0.00 C ATOM 422 CG PRO A 108 40.987 -31.577 -10.946 1.00 0.00 C ATOM 423 CD PRO A 108 40.025 -30.995 -9.918 1.00 0.00 C ATOM 0 HA PRO A 108 41.645 -33.115 -8.094 1.00 0.00 H new ATOM 0 HB2 PRO A 108 42.691 -32.843 -10.688 1.00 0.00 H new ATOM 0 HB3 PRO A 108 41.156 -33.633 -10.383 1.00 0.00 H new ATOM 0 HG2 PRO A 108 41.692 -30.821 -11.291 1.00 0.00 H new ATOM 0 HG3 PRO A 108 40.449 -31.935 -11.824 1.00 0.00 H new ATOM 0 HD2 PRO A 108 39.863 -29.929 -10.076 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.048 -31.476 -9.962 1.00 0.00 H new ATOM 431 N SER A 109 44.034 -32.555 -7.938 1.00 0.00 N ATOM 432 CA SER A 109 45.388 -32.125 -7.608 1.00 0.00 C ATOM 433 C SER A 109 46.139 -31.738 -8.879 1.00 0.00 C ATOM 434 O SER A 109 47.167 -31.063 -8.819 1.00 0.00 O ATOM 435 CB SER A 109 46.136 -33.255 -6.898 1.00 0.00 C ATOM 436 OG SER A 109 45.424 -33.621 -5.722 1.00 0.00 O ATOM 0 H SER A 109 43.837 -33.536 -7.738 1.00 0.00 H new ATOM 0 HA SER A 109 45.330 -31.260 -6.948 1.00 0.00 H new ATOM 0 HB2 SER A 109 46.234 -34.115 -7.561 1.00 0.00 H new ATOM 0 HB3 SER A 109 47.145 -32.934 -6.641 1.00 0.00 H new ATOM 0 HG SER A 109 45.899 -34.346 -5.265 1.00 0.00 H new ATOM 442 N HIS A 110 45.611 -32.158 -10.029 1.00 0.00 N ATOM 443 CA HIS A 110 46.234 -31.837 -11.311 1.00 0.00 C ATOM 444 C HIS A 110 45.702 -30.517 -11.841 1.00 0.00 C ATOM 445 O HIS A 110 46.463 -29.687 -12.338 1.00 0.00 O ATOM 446 CB HIS A 110 45.956 -32.942 -12.324 1.00 0.00 C ATOM 447 CG HIS A 110 46.790 -32.713 -13.553 1.00 0.00 C ATOM 448 ND1 HIS A 110 46.304 -32.041 -14.662 1.00 0.00 N ATOM 449 CD2 HIS A 110 48.081 -33.062 -13.863 1.00 0.00 C ATOM 450 CE1 HIS A 110 47.287 -32.005 -15.580 1.00 0.00 C ATOM 451 NE2 HIS A 110 48.393 -32.614 -15.143 1.00 0.00 N ATOM 0 H HIS A 110 44.760 -32.717 -10.098 1.00 0.00 H new ATOM 0 HA HIS A 110 47.310 -31.753 -11.158 1.00 0.00 H new ATOM 0 HB2 HIS A 110 46.187 -33.915 -11.890 1.00 0.00 H new ATOM 0 HB3 HIS A 110 44.898 -32.953 -12.586 1.00 0.00 H new ATOM 0 HD2 HIS A 110 48.753 -33.602 -13.212 1.00 0.00 H new ATOM 0 HE1 HIS A 110 47.194 -31.541 -16.551 1.00 0.00 H new ATOM 0 HE2 HIS A 110 49.276 -32.726 -15.641 1.00 0.00 H new ATOM 459 N ALA A 111 44.390 -30.315 -11.711 1.00 0.00 N ATOM 460 CA ALA A 111 43.760 -29.071 -12.157 1.00 0.00 C ATOM 461 C ALA A 111 42.936 -28.451 -11.027 1.00 0.00 C ATOM 462 O ALA A 111 41.713 -28.561 -11.007 1.00 0.00 O ATOM 463 CB ALA A 111 42.872 -29.335 -13.377 1.00 0.00 C ATOM 0 H ALA A 111 43.746 -30.992 -11.303 1.00 0.00 H new ATOM 0 HA ALA A 111 44.544 -28.368 -12.438 1.00 0.00 H new ATOM 0 HB1 ALA A 111 42.409 -28.402 -13.699 1.00 0.00 H new ATOM 0 HB2 ALA A 111 43.478 -29.738 -14.188 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.095 -30.053 -13.113 1.00 0.00 H new ATOM 469 N PRO A 112 43.578 -27.794 -10.106 1.00 0.00 N ATOM 470 CA PRO A 112 42.891 -27.143 -8.952 1.00 0.00 C ATOM 471 C PRO A 112 41.926 -26.047 -9.394 1.00 0.00 C ATOM 472 O PRO A 112 42.051 -25.503 -10.491 1.00 0.00 O ATOM 473 CB PRO A 112 44.046 -26.567 -8.117 1.00 0.00 C ATOM 474 CG PRO A 112 45.272 -27.275 -8.591 1.00 0.00 C ATOM 475 CD PRO A 112 45.031 -27.595 -10.052 1.00 0.00 C ATOM 0 HA PRO A 112 42.271 -27.846 -8.396 1.00 0.00 H new ATOM 0 HB2 PRO A 112 44.135 -25.490 -8.260 1.00 0.00 H new ATOM 0 HB3 PRO A 112 43.883 -26.735 -7.052 1.00 0.00 H new ATOM 0 HG2 PRO A 112 46.156 -26.649 -8.469 1.00 0.00 H new ATOM 0 HG3 PRO A 112 45.444 -28.185 -8.016 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.352 -26.782 -10.703 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.573 -28.487 -10.365 1.00 0.00 H new ATOM 483 N THR A 113 40.961 -25.725 -8.530 1.00 0.00 N ATOM 484 CA THR A 113 39.987 -24.687 -8.846 1.00 0.00 C ATOM 485 C THR A 113 39.401 -24.092 -7.579 1.00 0.00 C ATOM 486 O THR A 113 39.313 -24.759 -6.552 1.00 0.00 O ATOM 487 CB THR A 113 38.866 -25.283 -9.704 1.00 0.00 C ATOM 488 OG1 THR A 113 38.388 -26.474 -9.089 1.00 0.00 O ATOM 489 CG2 THR A 113 39.397 -25.609 -11.104 1.00 0.00 C ATOM 0 H THR A 113 40.836 -26.164 -7.618 1.00 0.00 H new ATOM 0 HA THR A 113 40.491 -23.893 -9.397 1.00 0.00 H new ATOM 0 HB THR A 113 38.054 -24.561 -9.790 1.00 0.00 H new ATOM 0 HG1 THR A 113 38.745 -26.538 -8.179 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.594 -26.032 -11.708 1.00 0.00 H new ATOM 0 HG22 THR A 113 39.764 -24.697 -11.575 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.211 -26.330 -11.026 1.00 0.00 H new ATOM 497 N PHE A 114 39.002 -22.823 -7.654 1.00 0.00 N ATOM 498 CA PHE A 114 38.422 -22.147 -6.491 1.00 0.00 C ATOM 499 C PHE A 114 37.134 -21.437 -6.881 1.00 0.00 C ATOM 500 O PHE A 114 37.010 -20.918 -7.990 1.00 0.00 O ATOM 501 CB PHE A 114 39.419 -21.122 -5.927 1.00 0.00 C ATOM 502 CG PHE A 114 40.826 -21.547 -6.275 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.408 -22.644 -5.634 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.548 -20.843 -7.242 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.711 -23.036 -5.955 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.845 -21.231 -7.561 1.00 0.00 C ATOM 507 CZ PHE A 114 43.434 -22.327 -6.919 1.00 0.00 C ATOM 0 H PHE A 114 39.067 -22.248 -8.494 1.00 0.00 H new ATOM 0 HA PHE A 114 38.201 -22.895 -5.730 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.214 -20.134 -6.339 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.307 -21.046 -4.845 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.850 -23.191 -4.888 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.099 -19.997 -7.742 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.158 -23.885 -5.459 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.401 -20.684 -8.308 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.442 -22.623 -7.167 1.00 0.00 H new ATOM 517 N THR A 115 36.179 -21.407 -5.957 1.00 0.00 N ATOM 518 CA THR A 115 34.899 -20.743 -6.202 1.00 0.00 C ATOM 519 C THR A 115 34.605 -19.727 -5.106 1.00 0.00 C ATOM 520 O THR A 115 34.505 -20.079 -3.930 1.00 0.00 O ATOM 521 CB THR A 115 33.780 -21.781 -6.253 1.00 0.00 C ATOM 522 OG1 THR A 115 34.026 -22.686 -7.321 1.00 0.00 O ATOM 523 CG2 THR A 115 32.442 -21.076 -6.471 1.00 0.00 C ATOM 0 H THR A 115 36.264 -21.833 -5.034 1.00 0.00 H new ATOM 0 HA THR A 115 34.956 -20.221 -7.157 1.00 0.00 H new ATOM 0 HB THR A 115 33.747 -22.332 -5.313 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.310 -23.354 -7.355 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.643 -21.816 -6.508 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.258 -20.383 -5.650 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.470 -20.525 -7.411 1.00 0.00 H new ATOM 531 N SER A 116 34.467 -18.465 -5.498 1.00 0.00 N ATOM 532 CA SER A 116 34.186 -17.399 -4.542 1.00 0.00 C ATOM 533 C SER A 116 32.686 -17.150 -4.452 1.00 0.00 C ATOM 534 O SER A 116 32.036 -16.839 -5.449 1.00 0.00 O ATOM 535 CB SER A 116 34.885 -16.114 -4.977 1.00 0.00 C ATOM 536 OG SER A 116 34.211 -15.576 -6.107 1.00 0.00 O ATOM 0 H SER A 116 34.545 -18.156 -6.467 1.00 0.00 H new ATOM 0 HA SER A 116 34.557 -17.704 -3.564 1.00 0.00 H new ATOM 0 HB2 SER A 116 34.886 -15.392 -4.161 1.00 0.00 H new ATOM 0 HB3 SER A 116 35.927 -16.318 -5.223 1.00 0.00 H new ATOM 0 HG SER A 116 33.384 -16.078 -6.264 1.00 0.00 H new ATOM 542 N THR A 117 32.141 -17.284 -3.246 1.00 0.00 N ATOM 543 CA THR A 117 30.711 -17.067 -3.031 1.00 0.00 C ATOM 544 C THR A 117 30.482 -15.742 -2.318 1.00 0.00 C ATOM 545 O THR A 117 31.369 -15.231 -1.635 1.00 0.00 O ATOM 546 CB THR A 117 30.129 -18.205 -2.191 1.00 0.00 C ATOM 547 OG1 THR A 117 30.330 -19.441 -2.866 1.00 0.00 O ATOM 548 CG2 THR A 117 28.632 -17.971 -1.987 1.00 0.00 C ATOM 0 H THR A 117 32.662 -17.540 -2.407 1.00 0.00 H new ATOM 0 HA THR A 117 30.213 -17.043 -4.000 1.00 0.00 H new ATOM 0 HB THR A 117 30.627 -18.236 -1.222 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.959 -20.172 -2.328 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.215 -18.781 -1.389 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.479 -17.023 -1.471 1.00 0.00 H new ATOM 0 HG23 THR A 117 28.133 -17.942 -2.956 1.00 0.00 H new ATOM 556 N VAL A 118 29.283 -15.195 -2.472 1.00 0.00 N ATOM 557 CA VAL A 118 28.942 -13.928 -1.828 1.00 0.00 C ATOM 558 C VAL A 118 27.517 -13.964 -1.308 1.00 0.00 C ATOM 559 O VAL A 118 26.621 -14.456 -1.986 1.00 0.00 O ATOM 560 CB VAL A 118 29.101 -12.779 -2.824 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.977 -12.837 -3.862 1.00 0.00 C ATOM 562 CG2 VAL A 118 29.034 -11.447 -2.075 1.00 0.00 C ATOM 0 H VAL A 118 28.534 -15.603 -3.032 1.00 0.00 H new ATOM 0 HA VAL A 118 29.618 -13.772 -0.987 1.00 0.00 H new ATOM 0 HB VAL A 118 30.063 -12.868 -3.329 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.093 -12.017 -4.570 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.023 -13.786 -4.395 1.00 0.00 H new ATOM 0 HG13 VAL A 118 27.013 -12.749 -3.360 1.00 0.00 H new ATOM 0 HG21 VAL A 118 29.147 -10.626 -2.783 1.00 0.00 H new ATOM 0 HG22 VAL A 118 28.072 -11.361 -1.570 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.835 -11.404 -1.338 1.00 0.00 H new ATOM 572 N GLU A 119 27.311 -13.432 -0.104 1.00 0.00 N ATOM 573 CA GLU A 119 25.981 -13.403 0.499 1.00 0.00 C ATOM 574 C GLU A 119 25.592 -11.981 0.878 1.00 0.00 C ATOM 575 O GLU A 119 26.357 -11.271 1.528 1.00 0.00 O ATOM 576 CB GLU A 119 25.955 -14.302 1.744 1.00 0.00 C ATOM 577 CG GLU A 119 24.539 -14.835 1.970 1.00 0.00 C ATOM 578 CD GLU A 119 23.586 -13.672 2.228 1.00 0.00 C ATOM 579 OE1 GLU A 119 23.999 -12.725 2.876 1.00 0.00 O ATOM 580 OE2 GLU A 119 22.458 -13.744 1.768 1.00 0.00 O1- ATOM 0 H GLU A 119 28.045 -13.017 0.470 1.00 0.00 H new ATOM 0 HA GLU A 119 25.261 -13.774 -0.231 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.650 -15.132 1.619 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.285 -13.739 2.617 1.00 0.00 H new ATOM 0 HG2 GLU A 119 24.210 -15.401 1.098 1.00 0.00 H new ATOM 0 HG3 GLU A 119 24.529 -15.520 2.817 1.00 0.00 H new ATOM 587 N PHE A 120 24.392 -11.577 0.479 1.00 0.00 N ATOM 588 CA PHE A 120 23.911 -10.239 0.802 1.00 0.00 C ATOM 589 C PHE A 120 22.402 -10.142 0.573 1.00 0.00 C ATOM 590 O PHE A 120 21.839 -10.900 -0.215 1.00 0.00 O ATOM 591 CB PHE A 120 24.629 -9.203 -0.058 1.00 0.00 C ATOM 592 CG PHE A 120 24.242 -9.391 -1.504 1.00 0.00 C ATOM 593 CD1 PHE A 120 23.105 -8.750 -2.010 1.00 0.00 C ATOM 594 CD2 PHE A 120 25.021 -10.198 -2.339 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.741 -8.924 -3.350 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.656 -10.373 -3.681 1.00 0.00 C ATOM 597 CZ PHE A 120 23.520 -9.732 -4.186 1.00 0.00 C ATOM 0 H PHE A 120 23.742 -12.147 -0.061 1.00 0.00 H new ATOM 0 HA PHE A 120 24.120 -10.042 1.853 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.367 -8.197 0.271 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.708 -9.305 0.057 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.508 -8.121 -1.366 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.903 -10.686 -1.950 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.860 -8.435 -3.739 1.00 0.00 H new ATOM 0 HE2 PHE A 120 25.252 -11.003 -4.325 1.00 0.00 H new ATOM 0 HZ PHE A 120 23.244 -9.861 -5.222 1.00 0.00 H new ATOM 607 N ALA A 121 21.759 -9.194 1.247 1.00 0.00 N ATOM 608 CA ALA A 121 20.322 -9.008 1.096 1.00 0.00 C ATOM 609 C ALA A 121 19.583 -10.317 1.343 1.00 0.00 C ATOM 610 O ALA A 121 18.449 -10.494 0.897 1.00 0.00 O ATOM 611 CB ALA A 121 20.005 -8.498 -0.311 1.00 0.00 C ATOM 0 H ALA A 121 22.206 -8.548 1.898 1.00 0.00 H new ATOM 0 HA ALA A 121 19.992 -8.274 1.831 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.929 -8.362 -0.415 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.509 -7.545 -0.475 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.352 -9.223 -1.047 1.00 0.00 H new ATOM 617 N GLY A 122 20.235 -11.234 2.048 1.00 0.00 N ATOM 618 CA GLY A 122 19.630 -12.526 2.348 1.00 0.00 C ATOM 619 C GLY A 122 19.662 -13.439 1.130 1.00 0.00 C ATOM 620 O GLY A 122 18.875 -14.378 1.025 1.00 0.00 O ATOM 0 H GLY A 122 21.176 -11.108 2.420 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.162 -12.997 3.174 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.599 -12.382 2.672 1.00 0.00 H new ATOM 624 N LYS A 123 20.576 -13.160 0.206 1.00 0.00 N ATOM 625 CA LYS A 123 20.708 -13.966 -1.007 1.00 0.00 C ATOM 626 C LYS A 123 22.163 -14.318 -1.255 1.00 0.00 C ATOM 627 O LYS A 123 23.061 -13.582 -0.858 1.00 0.00 O ATOM 628 CB LYS A 123 20.151 -13.199 -2.202 1.00 0.00 C ATOM 629 CG LYS A 123 18.623 -13.224 -2.159 1.00 0.00 C ATOM 630 CD LYS A 123 18.062 -12.356 -3.294 1.00 0.00 C ATOM 631 CE LYS A 123 18.098 -13.135 -4.611 1.00 0.00 C ATOM 632 NZ LYS A 123 17.374 -12.370 -5.659 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.235 -12.385 0.272 1.00 0.00 H new ATOM 0 HA LYS A 123 20.143 -14.889 -0.875 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.509 -12.170 -2.185 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.506 -13.645 -3.131 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.263 -14.248 -2.259 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.270 -12.854 -1.196 1.00 0.00 H new ATOM 0 HD2 LYS A 123 17.039 -12.059 -3.065 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.646 -11.441 -3.387 1.00 0.00 H new ATOM 0 HE2 LYS A 123 19.130 -13.305 -4.917 1.00 0.00 H new ATOM 0 HE3 LYS A 123 17.639 -14.115 -4.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 17.398 -12.899 -6.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.386 -12.230 -5.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 17.830 -11.445 -5.791 1.00 0.00 H new ATOM 646 N VAL A 124 22.390 -15.454 -1.914 1.00 0.00 N ATOM 647 CA VAL A 124 23.748 -15.906 -2.208 1.00 0.00 C ATOM 648 C VAL A 124 23.947 -16.086 -3.705 1.00 0.00 C ATOM 649 O VAL A 124 23.157 -16.755 -4.370 1.00 0.00 O ATOM 650 CB VAL A 124 24.013 -17.236 -1.500 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.105 -18.321 -2.089 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.478 -17.636 -1.696 1.00 0.00 C ATOM 0 H VAL A 124 21.655 -16.075 -2.253 1.00 0.00 H new ATOM 0 HA VAL A 124 24.446 -15.149 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 124 23.804 -17.127 -0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.295 -19.268 -1.584 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.062 -18.038 -1.949 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.312 -18.430 -3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.667 -18.584 -1.192 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.687 -17.744 -2.760 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.125 -16.866 -1.276 1.00 0.00 H new ATOM 662 N PHE A 125 25.010 -15.483 -4.236 1.00 0.00 N ATOM 663 CA PHE A 125 25.314 -15.586 -5.665 1.00 0.00 C ATOM 664 C PHE A 125 26.639 -16.311 -5.873 1.00 0.00 C ATOM 665 O PHE A 125 27.674 -15.899 -5.343 1.00 0.00 O ATOM 666 CB PHE A 125 25.396 -14.192 -6.283 1.00 0.00 C ATOM 667 CG PHE A 125 24.077 -13.480 -6.099 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.700 -13.028 -4.829 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.236 -13.255 -7.199 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.480 -12.368 -4.655 1.00 0.00 C ATOM 671 CE2 PHE A 125 22.018 -12.594 -7.021 1.00 0.00 C ATOM 672 CZ PHE A 125 21.639 -12.147 -5.750 1.00 0.00 C ATOM 0 H PHE A 125 25.673 -14.921 -3.702 1.00 0.00 H new ATOM 0 HA PHE A 125 24.518 -16.151 -6.149 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.198 -13.621 -5.814 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.636 -14.267 -7.344 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.352 -13.189 -3.983 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.530 -13.592 -8.182 1.00 0.00 H new ATOM 0 HE1 PHE A 125 22.186 -12.028 -3.673 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.367 -12.428 -7.867 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.699 -11.633 -5.615 1.00 0.00 H new ATOM 682 N SER A 126 26.597 -17.395 -6.641 1.00 0.00 N ATOM 683 CA SER A 126 27.802 -18.170 -6.914 1.00 0.00 C ATOM 684 C SER A 126 28.604 -17.530 -8.042 1.00 0.00 C ATOM 685 O SER A 126 28.044 -17.118 -9.057 1.00 0.00 O ATOM 686 CB SER A 126 27.422 -19.599 -7.306 1.00 0.00 C ATOM 687 OG SER A 126 26.775 -20.230 -6.209 1.00 0.00 O ATOM 0 H SER A 126 25.750 -17.754 -7.082 1.00 0.00 H new ATOM 0 HA SER A 126 28.414 -18.189 -6.012 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.763 -19.587 -8.174 1.00 0.00 H new ATOM 0 HB3 SER A 126 28.313 -20.160 -7.589 1.00 0.00 H new ATOM 0 HG SER A 126 26.528 -21.145 -6.457 1.00 0.00 H new ATOM 693 N GLY A 127 29.917 -17.453 -7.859 1.00 0.00 N ATOM 694 CA GLY A 127 30.787 -16.864 -8.871 1.00 0.00 C ATOM 695 C GLY A 127 31.077 -17.866 -9.979 1.00 0.00 C ATOM 696 O GLY A 127 30.482 -18.944 -10.027 1.00 0.00 O ATOM 0 H GLY A 127 30.400 -17.788 -7.026 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.315 -15.976 -9.291 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.721 -16.541 -8.412 1.00 0.00 H new ATOM 700 N GLU A 128 32.001 -17.511 -10.871 1.00 0.00 N ATOM 701 CA GLU A 128 32.368 -18.387 -11.968 1.00 0.00 C ATOM 702 C GLU A 128 33.592 -19.220 -11.605 1.00 0.00 C ATOM 703 O GLU A 128 34.605 -18.691 -11.158 1.00 0.00 O ATOM 704 CB GLU A 128 32.662 -17.564 -13.226 1.00 0.00 C ATOM 705 CG GLU A 128 33.602 -18.327 -14.152 1.00 0.00 C ATOM 706 CD GLU A 128 33.568 -17.733 -15.552 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.049 -16.641 -15.699 1.00 0.00 O ATOM 708 OE2 GLU A 128 34.058 -18.385 -16.461 1.00 0.00 O1- ATOM 0 H GLU A 128 32.504 -16.624 -10.851 1.00 0.00 H new ATOM 0 HA GLU A 128 31.531 -19.058 -12.163 1.00 0.00 H new ATOM 0 HB2 GLU A 128 31.731 -17.339 -13.747 1.00 0.00 H new ATOM 0 HB3 GLU A 128 33.110 -16.610 -12.948 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.618 -18.290 -13.759 1.00 0.00 H new ATOM 0 HG3 GLU A 128 33.313 -19.377 -14.189 1.00 0.00 H new ATOM 715 N GLU A 129 33.493 -20.518 -11.818 1.00 0.00 N ATOM 716 CA GLU A 129 34.610 -21.417 -11.527 1.00 0.00 C ATOM 717 C GLU A 129 35.853 -20.966 -12.286 1.00 0.00 C ATOM 718 O GLU A 129 35.763 -20.478 -13.411 1.00 0.00 O ATOM 719 CB GLU A 129 34.254 -22.853 -11.923 1.00 0.00 C ATOM 720 CG GLU A 129 33.062 -23.340 -11.086 1.00 0.00 C ATOM 721 CD GLU A 129 31.753 -22.852 -11.705 1.00 0.00 C ATOM 722 OE1 GLU A 129 31.814 -22.104 -12.667 1.00 0.00 O ATOM 723 OE2 GLU A 129 30.709 -23.229 -11.205 1.00 0.00 O1- ATOM 0 H GLU A 129 32.661 -20.978 -12.188 1.00 0.00 H new ATOM 0 HA GLU A 129 34.812 -21.386 -10.456 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.008 -22.898 -12.984 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.112 -23.507 -11.767 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.065 -24.429 -11.033 1.00 0.00 H new ATOM 0 HG3 GLU A 129 33.150 -22.971 -10.064 1.00 0.00 H new ATOM 730 N ALA A 130 37.010 -21.127 -11.657 1.00 0.00 N ATOM 731 CA ALA A 130 38.267 -20.727 -12.277 1.00 0.00 C ATOM 732 C ALA A 130 39.454 -21.173 -11.430 1.00 0.00 C ATOM 733 O ALA A 130 39.290 -21.547 -10.270 1.00 0.00 O ATOM 734 CB ALA A 130 38.295 -19.208 -12.446 1.00 0.00 C ATOM 0 H ALA A 130 37.105 -21.529 -10.724 1.00 0.00 H new ATOM 0 HA ALA A 130 38.341 -21.206 -13.253 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.236 -18.911 -12.910 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.464 -18.897 -13.079 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.205 -18.732 -11.470 1.00 0.00 H new ATOM 740 N LYS A 131 40.647 -21.113 -12.008 1.00 0.00 N ATOM 741 CA LYS A 131 41.864 -21.492 -11.296 1.00 0.00 C ATOM 742 C LYS A 131 42.507 -20.272 -10.648 1.00 0.00 C ATOM 743 O LYS A 131 43.730 -20.183 -10.552 1.00 0.00 O ATOM 744 CB LYS A 131 42.855 -22.152 -12.253 1.00 0.00 C ATOM 745 CG LYS A 131 43.180 -21.186 -13.392 1.00 0.00 C ATOM 746 CD LYS A 131 44.134 -21.861 -14.378 1.00 0.00 C ATOM 747 CE LYS A 131 44.424 -20.911 -15.540 1.00 0.00 C ATOM 748 NZ LYS A 131 45.100 -19.687 -15.024 1.00 0.00 N1+ ATOM 0 H LYS A 131 40.799 -20.805 -12.969 1.00 0.00 H new ATOM 0 HA LYS A 131 41.595 -22.204 -10.515 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.766 -22.423 -11.720 1.00 0.00 H new ATOM 0 HB3 LYS A 131 42.433 -23.074 -12.653 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.264 -20.888 -13.902 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.634 -20.278 -12.995 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.062 -22.131 -13.875 1.00 0.00 H new ATOM 0 HD3 LYS A 131 43.693 -22.785 -14.752 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.056 -21.405 -16.278 1.00 0.00 H new ATOM 0 HE3 LYS A 131 43.496 -20.642 -16.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 45.594 -19.208 -15.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 44.391 -19.044 -14.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 45.788 -19.953 -14.291 1.00 0.00 H new ATOM 762 N THR A 132 41.680 -19.332 -10.214 1.00 0.00 N ATOM 763 CA THR A 132 42.176 -18.111 -9.577 1.00 0.00 C ATOM 764 C THR A 132 41.127 -17.539 -8.628 1.00 0.00 C ATOM 765 O THR A 132 39.931 -17.578 -8.911 1.00 0.00 O ATOM 766 CB THR A 132 42.530 -17.068 -10.651 1.00 0.00 C ATOM 767 OG1 THR A 132 42.153 -15.775 -10.199 1.00 0.00 O ATOM 768 CG2 THR A 132 41.790 -17.395 -11.950 1.00 0.00 C ATOM 0 H THR A 132 40.664 -19.387 -10.289 1.00 0.00 H new ATOM 0 HA THR A 132 43.070 -18.356 -9.003 1.00 0.00 H new ATOM 0 HB THR A 132 43.604 -17.088 -10.835 1.00 0.00 H new ATOM 0 HG1 THR A 132 42.391 -15.677 -9.253 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.043 -16.655 -12.709 1.00 0.00 H new ATOM 0 HG22 THR A 132 42.084 -18.385 -12.297 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.715 -17.378 -11.770 1.00 0.00 H new ATOM 776 N LYS A 133 41.585 -16.998 -7.503 1.00 0.00 N ATOM 777 CA LYS A 133 40.677 -16.416 -6.523 1.00 0.00 C ATOM 778 C LYS A 133 40.240 -15.023 -6.954 1.00 0.00 C ATOM 779 O LYS A 133 39.066 -14.671 -6.873 1.00 0.00 O ATOM 780 CB LYS A 133 41.353 -16.344 -5.154 1.00 0.00 C ATOM 781 CG LYS A 133 41.499 -17.754 -4.584 1.00 0.00 C ATOM 782 CD LYS A 133 42.207 -17.689 -3.227 1.00 0.00 C ATOM 783 CE LYS A 133 42.277 -19.091 -2.613 1.00 0.00 C ATOM 784 NZ LYS A 133 43.348 -19.875 -3.288 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.572 -16.951 -7.249 1.00 0.00 H new ATOM 0 HA LYS A 133 39.795 -17.053 -6.455 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.332 -15.873 -5.244 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.763 -15.726 -4.477 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.518 -18.215 -4.472 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.068 -18.379 -5.273 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.212 -17.285 -3.349 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.671 -17.015 -2.558 1.00 0.00 H new ATOM 0 HE2 LYS A 133 42.480 -19.022 -1.544 1.00 0.00 H new ATOM 0 HE3 LYS A 133 41.317 -19.596 -2.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.454 -20.796 -2.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 43.093 -20.024 -4.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 44.246 -19.354 -3.234 1.00 0.00 H new ATOM 798 N LYS A 134 41.202 -14.232 -7.402 1.00 0.00 N ATOM 799 CA LYS A 134 40.916 -12.873 -7.832 1.00 0.00 C ATOM 800 C LYS A 134 39.807 -12.881 -8.872 1.00 0.00 C ATOM 801 O LYS A 134 38.866 -12.098 -8.792 1.00 0.00 O ATOM 802 CB LYS A 134 42.174 -12.226 -8.424 1.00 0.00 C ATOM 803 CG LYS A 134 42.854 -13.203 -9.388 1.00 0.00 C ATOM 804 CD LYS A 134 44.136 -12.583 -9.932 1.00 0.00 C ATOM 805 CE LYS A 134 44.832 -13.586 -10.853 1.00 0.00 C ATOM 806 NZ LYS A 134 43.848 -14.134 -11.829 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.182 -14.505 -7.477 1.00 0.00 H new ATOM 0 HA LYS A 134 40.594 -12.294 -6.966 1.00 0.00 H new ATOM 0 HB2 LYS A 134 41.910 -11.308 -8.948 1.00 0.00 H new ATOM 0 HB3 LYS A 134 42.863 -11.950 -7.625 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.081 -14.137 -8.874 1.00 0.00 H new ATOM 0 HG3 LYS A 134 42.180 -13.446 -10.209 1.00 0.00 H new ATOM 0 HD2 LYS A 134 43.907 -11.668 -10.479 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.797 -12.307 -9.110 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.653 -13.101 -11.382 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.266 -14.395 -10.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 44.349 -14.682 -12.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 43.175 -14.752 -11.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 43.332 -13.351 -12.279 1.00 0.00 H new ATOM 820 N LEU A 135 39.924 -13.776 -9.846 1.00 0.00 N ATOM 821 CA LEU A 135 38.932 -13.883 -10.892 1.00 0.00 C ATOM 822 C LEU A 135 37.602 -14.364 -10.325 1.00 0.00 C ATOM 823 O LEU A 135 36.540 -13.876 -10.707 1.00 0.00 O ATOM 824 CB LEU A 135 39.422 -14.870 -11.964 1.00 0.00 C ATOM 825 CG LEU A 135 38.784 -14.522 -13.317 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.602 -13.411 -13.999 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.761 -15.765 -14.212 1.00 0.00 C ATOM 0 H LEU A 135 40.698 -14.435 -9.927 1.00 0.00 H new ATOM 0 HA LEU A 135 38.785 -12.898 -11.336 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.508 -14.828 -12.042 1.00 0.00 H new ATOM 0 HB3 LEU A 135 39.162 -15.890 -11.680 1.00 0.00 H new ATOM 0 HG LEU A 135 37.763 -14.176 -13.157 1.00 0.00 H new ATOM 0 HD11 LEU A 135 39.150 -13.164 -14.959 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.613 -12.525 -13.364 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.624 -13.756 -14.157 1.00 0.00 H new ATOM 0 HD21 LEU A 135 38.308 -15.514 -15.171 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.780 -16.116 -14.373 1.00 0.00 H new ATOM 0 HD23 LEU A 135 38.179 -16.550 -13.730 1.00 0.00 H new ATOM 839 N ALA A 136 37.666 -15.339 -9.424 1.00 0.00 N ATOM 840 CA ALA A 136 36.452 -15.879 -8.829 1.00 0.00 C ATOM 841 C ALA A 136 35.702 -14.771 -8.097 1.00 0.00 C ATOM 842 O ALA A 136 34.520 -14.549 -8.330 1.00 0.00 O ATOM 843 CB ALA A 136 36.803 -16.992 -7.837 1.00 0.00 C ATOM 0 H ALA A 136 38.532 -15.765 -9.095 1.00 0.00 H new ATOM 0 HA ALA A 136 35.823 -16.287 -9.620 1.00 0.00 H new ATOM 0 HB1 ALA A 136 35.888 -17.389 -7.397 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.332 -17.790 -8.358 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.439 -16.590 -7.049 1.00 0.00 H new ATOM 849 N GLU A 137 36.396 -14.076 -7.206 1.00 0.00 N ATOM 850 CA GLU A 137 35.775 -13.000 -6.447 1.00 0.00 C ATOM 851 C GLU A 137 35.133 -12.004 -7.403 1.00 0.00 C ATOM 852 O GLU A 137 34.039 -11.502 -7.152 1.00 0.00 O ATOM 853 CB GLU A 137 36.827 -12.291 -5.591 1.00 0.00 C ATOM 854 CG GLU A 137 37.361 -13.255 -4.526 1.00 0.00 C ATOM 855 CD GLU A 137 38.458 -12.577 -3.710 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.727 -11.414 -3.964 1.00 0.00 O ATOM 857 OE2 GLU A 137 39.016 -13.231 -2.844 1.00 0.00 O1- ATOM 0 H GLU A 137 37.380 -14.236 -6.992 1.00 0.00 H new ATOM 0 HA GLU A 137 35.009 -13.419 -5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.645 -11.939 -6.220 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.391 -11.413 -5.115 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.550 -13.570 -3.869 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.753 -14.154 -5.001 1.00 0.00 H new ATOM 864 N MET A 138 35.830 -11.724 -8.496 1.00 0.00 N ATOM 865 CA MET A 138 35.330 -10.786 -9.490 1.00 0.00 C ATOM 866 C MET A 138 34.017 -11.290 -10.076 1.00 0.00 C ATOM 867 O MET A 138 33.077 -10.522 -10.269 1.00 0.00 O ATOM 868 CB MET A 138 36.362 -10.619 -10.615 1.00 0.00 C ATOM 869 CG MET A 138 37.482 -9.688 -10.154 1.00 0.00 C ATOM 870 SD MET A 138 38.782 -9.637 -11.412 1.00 0.00 S ATOM 871 CE MET A 138 40.048 -8.835 -10.396 1.00 0.00 C ATOM 0 H MET A 138 36.739 -12.131 -8.716 1.00 0.00 H new ATOM 0 HA MET A 138 35.159 -9.823 -9.008 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.774 -11.590 -10.891 1.00 0.00 H new ATOM 0 HB3 MET A 138 35.881 -10.212 -11.505 1.00 0.00 H new ATOM 0 HG2 MET A 138 37.089 -8.686 -9.982 1.00 0.00 H new ATOM 0 HG3 MET A 138 37.892 -10.037 -9.206 1.00 0.00 H new ATOM 0 HE1 MET A 138 40.956 -8.702 -10.984 1.00 0.00 H new ATOM 0 HE2 MET A 138 39.685 -7.862 -10.063 1.00 0.00 H new ATOM 0 HE3 MET A 138 40.266 -9.457 -9.528 1.00 0.00 H new ATOM 881 N SER A 139 33.966 -12.586 -10.358 1.00 0.00 N ATOM 882 CA SER A 139 32.772 -13.187 -10.936 1.00 0.00 C ATOM 883 C SER A 139 31.578 -13.005 -10.011 1.00 0.00 C ATOM 884 O SER A 139 30.467 -12.759 -10.473 1.00 0.00 O ATOM 885 CB SER A 139 32.997 -14.681 -11.168 1.00 0.00 C ATOM 886 OG SER A 139 33.121 -15.343 -9.919 1.00 0.00 O ATOM 0 H SER A 139 34.734 -13.238 -10.197 1.00 0.00 H new ATOM 0 HA SER A 139 32.569 -12.692 -11.886 1.00 0.00 H new ATOM 0 HB2 SER A 139 32.165 -15.101 -11.733 1.00 0.00 H new ATOM 0 HB3 SER A 139 33.897 -14.835 -11.764 1.00 0.00 H new ATOM 0 HG SER A 139 33.790 -14.883 -9.370 1.00 0.00 H new ATOM 892 N ALA A 140 31.815 -13.128 -8.708 1.00 0.00 N ATOM 893 CA ALA A 140 30.744 -12.982 -7.728 1.00 0.00 C ATOM 894 C ALA A 140 30.203 -11.554 -7.724 1.00 0.00 C ATOM 895 O ALA A 140 28.995 -11.335 -7.670 1.00 0.00 O ATOM 896 CB ALA A 140 31.265 -13.339 -6.336 1.00 0.00 C ATOM 0 H ALA A 140 32.732 -13.327 -8.309 1.00 0.00 H new ATOM 0 HA ALA A 140 29.934 -13.658 -8.000 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.462 -13.228 -5.607 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.618 -14.370 -6.333 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.087 -12.673 -6.073 1.00 0.00 H new ATOM 902 N ALA A 141 31.109 -10.584 -7.756 1.00 0.00 N ATOM 903 CA ALA A 141 30.712 -9.183 -7.744 1.00 0.00 C ATOM 904 C ALA A 141 30.035 -8.803 -9.056 1.00 0.00 C ATOM 905 O ALA A 141 29.175 -7.924 -9.089 1.00 0.00 O ATOM 906 CB ALA A 141 31.936 -8.292 -7.535 1.00 0.00 C ATOM 0 H ALA A 141 32.116 -10.741 -7.790 1.00 0.00 H new ATOM 0 HA ALA A 141 30.008 -9.038 -6.925 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.628 -7.246 -7.528 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.407 -8.538 -6.583 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.647 -8.455 -8.345 1.00 0.00 H new ATOM 912 N LYS A 142 30.431 -9.466 -10.140 1.00 0.00 N ATOM 913 CA LYS A 142 29.849 -9.180 -11.445 1.00 0.00 C ATOM 914 C LYS A 142 28.418 -9.692 -11.544 1.00 0.00 C ATOM 915 O LYS A 142 27.511 -8.960 -11.936 1.00 0.00 O ATOM 916 CB LYS A 142 30.703 -9.824 -12.544 1.00 0.00 C ATOM 917 CG LYS A 142 31.973 -9.000 -12.760 1.00 0.00 C ATOM 918 CD LYS A 142 32.870 -9.701 -13.782 1.00 0.00 C ATOM 919 CE LYS A 142 34.062 -8.802 -14.115 1.00 0.00 C ATOM 920 NZ LYS A 142 34.852 -8.544 -12.878 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.144 -10.196 -10.140 1.00 0.00 H new ATOM 0 HA LYS A 142 29.830 -8.098 -11.574 1.00 0.00 H new ATOM 0 HB2 LYS A 142 30.964 -10.845 -12.264 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.134 -9.883 -13.472 1.00 0.00 H new ATOM 0 HG2 LYS A 142 31.715 -8.001 -13.112 1.00 0.00 H new ATOM 0 HG3 LYS A 142 32.505 -8.879 -11.816 1.00 0.00 H new ATOM 0 HD2 LYS A 142 33.219 -10.653 -13.383 1.00 0.00 H new ATOM 0 HD3 LYS A 142 32.304 -9.923 -14.687 1.00 0.00 H new ATOM 0 HE2 LYS A 142 34.691 -9.278 -14.868 1.00 0.00 H new ATOM 0 HE3 LYS A 142 33.713 -7.860 -14.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 34.805 -7.532 -12.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 34.460 -9.102 -12.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 35.843 -8.817 -13.036 1.00 0.00 H new ATOM 934 N VAL A 143 28.231 -10.961 -11.198 1.00 0.00 N ATOM 935 CA VAL A 143 26.914 -11.574 -11.265 1.00 0.00 C ATOM 936 C VAL A 143 25.975 -10.934 -10.254 1.00 0.00 C ATOM 937 O VAL A 143 24.817 -10.652 -10.562 1.00 0.00 O ATOM 938 CB VAL A 143 27.021 -13.074 -10.986 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.570 -13.291 -9.578 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.637 -13.714 -11.094 1.00 0.00 C ATOM 0 H VAL A 143 28.972 -11.581 -10.870 1.00 0.00 H new ATOM 0 HA VAL A 143 26.512 -11.419 -12.266 1.00 0.00 H new ATOM 0 HB VAL A 143 27.691 -13.531 -11.714 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.647 -14.360 -9.378 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.557 -12.835 -9.498 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.899 -12.833 -8.851 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.714 -14.783 -10.895 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.967 -13.257 -10.366 1.00 0.00 H new ATOM 0 HG23 VAL A 143 25.242 -13.559 -12.098 1.00 0.00 H new ATOM 950 N ALA A 144 26.479 -10.710 -9.043 1.00 0.00 N ATOM 951 CA ALA A 144 25.675 -10.111 -7.989 1.00 0.00 C ATOM 952 C ALA A 144 25.223 -8.714 -8.388 1.00 0.00 C ATOM 953 O ALA A 144 24.059 -8.360 -8.226 1.00 0.00 O ATOM 954 CB ALA A 144 26.491 -10.036 -6.697 1.00 0.00 C ATOM 0 H ALA A 144 27.436 -10.934 -8.771 1.00 0.00 H new ATOM 0 HA ALA A 144 24.793 -10.732 -7.830 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.886 -9.587 -5.910 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.790 -11.040 -6.397 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.380 -9.427 -6.863 1.00 0.00 H new ATOM 960 N PHE A 145 26.153 -7.924 -8.908 1.00 0.00 N ATOM 961 CA PHE A 145 25.842 -6.561 -9.320 1.00 0.00 C ATOM 962 C PHE A 145 24.777 -6.562 -10.408 1.00 0.00 C ATOM 963 O PHE A 145 23.861 -5.745 -10.392 1.00 0.00 O ATOM 964 CB PHE A 145 27.101 -5.866 -9.833 1.00 0.00 C ATOM 965 CG PHE A 145 26.810 -4.404 -10.067 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.773 -3.516 -8.982 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.572 -3.933 -11.362 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.502 -2.161 -9.196 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.303 -2.575 -11.576 1.00 0.00 C ATOM 970 CZ PHE A 145 26.265 -1.690 -10.493 1.00 0.00 C ATOM 0 H PHE A 145 27.124 -8.201 -9.054 1.00 0.00 H new ATOM 0 HA PHE A 145 25.461 -6.019 -8.454 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.910 -5.975 -9.110 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.436 -6.334 -10.759 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.954 -3.879 -7.981 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.596 -4.617 -12.198 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.475 -1.477 -8.360 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.125 -2.211 -12.577 1.00 0.00 H new ATOM 0 HZ PHE A 145 26.053 -0.644 -10.657 1.00 0.00 H new ATOM 980 N MET A 146 24.908 -7.482 -11.358 1.00 0.00 N ATOM 981 CA MET A 146 23.955 -7.577 -12.457 1.00 0.00 C ATOM 982 C MET A 146 22.561 -7.914 -11.938 1.00 0.00 C ATOM 983 O MET A 146 21.563 -7.397 -12.439 1.00 0.00 O ATOM 984 CB MET A 146 24.407 -8.655 -13.448 1.00 0.00 C ATOM 985 CG MET A 146 25.571 -8.125 -14.287 1.00 0.00 C ATOM 986 SD MET A 146 26.156 -9.429 -15.400 1.00 0.00 S ATOM 987 CE MET A 146 27.659 -8.589 -15.960 1.00 0.00 C ATOM 0 H MET A 146 25.661 -8.169 -11.389 1.00 0.00 H new ATOM 0 HA MET A 146 23.916 -6.611 -12.960 1.00 0.00 H new ATOM 0 HB2 MET A 146 24.712 -9.553 -12.910 1.00 0.00 H new ATOM 0 HB3 MET A 146 23.578 -8.938 -14.096 1.00 0.00 H new ATOM 0 HG2 MET A 146 25.252 -7.256 -14.863 1.00 0.00 H new ATOM 0 HG3 MET A 146 26.382 -7.796 -13.637 1.00 0.00 H new ATOM 0 HE1 MET A 146 28.189 -9.225 -16.669 1.00 0.00 H new ATOM 0 HE2 MET A 146 27.392 -7.650 -16.444 1.00 0.00 H new ATOM 0 HE3 MET A 146 28.302 -8.386 -15.104 1.00 0.00 H new ATOM 997 N SER A 147 22.495 -8.790 -10.942 1.00 0.00 N ATOM 998 CA SER A 147 21.211 -9.185 -10.378 1.00 0.00 C ATOM 999 C SER A 147 20.575 -8.030 -9.611 1.00 0.00 C ATOM 1000 O SER A 147 19.370 -7.796 -9.707 1.00 0.00 O ATOM 1001 CB SER A 147 21.398 -10.373 -9.443 1.00 0.00 C ATOM 1002 OG SER A 147 22.300 -10.019 -8.402 1.00 0.00 O ATOM 0 H SER A 147 23.306 -9.236 -10.513 1.00 0.00 H new ATOM 0 HA SER A 147 20.550 -9.465 -11.199 1.00 0.00 H new ATOM 0 HB2 SER A 147 20.438 -10.672 -9.021 1.00 0.00 H new ATOM 0 HB3 SER A 147 21.783 -11.229 -9.997 1.00 0.00 H new ATOM 0 HG SER A 147 22.271 -10.701 -7.699 1.00 0.00 H new ATOM 1008 N ILE A 148 21.390 -7.315 -8.846 1.00 0.00 N ATOM 1009 CA ILE A 148 20.895 -6.190 -8.059 1.00 0.00 C ATOM 1010 C ILE A 148 20.254 -5.139 -8.961 1.00 0.00 C ATOM 1011 O ILE A 148 19.342 -4.425 -8.543 1.00 0.00 O ATOM 1012 CB ILE A 148 22.043 -5.557 -7.267 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.498 -6.522 -6.171 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.573 -4.247 -6.629 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.806 -6.020 -5.558 1.00 0.00 C ATOM 0 H ILE A 148 22.390 -7.491 -8.753 1.00 0.00 H new ATOM 0 HA ILE A 148 20.140 -6.564 -7.367 1.00 0.00 H new ATOM 0 HB ILE A 148 22.874 -5.351 -7.942 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.731 -6.602 -5.401 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.638 -7.520 -6.586 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.394 -3.801 -6.067 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.251 -3.557 -7.409 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.740 -4.449 -5.956 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.130 -6.708 -4.777 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.572 -5.963 -6.331 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.650 -5.031 -5.128 1.00 0.00 H new ATOM 1027 N LYS A 149 20.730 -5.052 -10.195 1.00 0.00 N ATOM 1028 CA LYS A 149 20.186 -4.087 -11.143 1.00 0.00 C ATOM 1029 C LYS A 149 18.723 -4.395 -11.445 1.00 0.00 C ATOM 1030 O LYS A 149 17.893 -3.491 -11.521 1.00 0.00 O ATOM 1031 CB LYS A 149 20.993 -4.111 -12.437 1.00 0.00 C ATOM 1032 CG LYS A 149 22.353 -3.446 -12.207 1.00 0.00 C ATOM 1033 CD LYS A 149 23.221 -3.600 -13.461 1.00 0.00 C ATOM 1034 CE LYS A 149 22.781 -2.590 -14.523 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.749 -2.602 -15.651 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.485 -5.632 -10.562 1.00 0.00 H new ATOM 0 HA LYS A 149 20.250 -3.095 -10.696 1.00 0.00 H new ATOM 0 HB2 LYS A 149 21.132 -5.139 -12.772 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.451 -3.589 -13.225 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.218 -2.390 -11.974 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.851 -3.900 -11.350 1.00 0.00 H new ATOM 0 HD2 LYS A 149 24.270 -3.444 -13.210 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.135 -4.614 -13.852 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.783 -2.838 -14.884 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.724 -1.592 -14.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.450 -1.915 -16.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.694 -2.346 -15.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.782 -3.553 -16.070 1.00 0.00 H new