USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=18 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 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= -1.88! C(o=-1.9!,f=-4!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -67:sc= 1.16 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.499 USER MOD Single : A 103 THR OG1 : rot -48:sc= 0.00216 USER MOD Single : A 105 THR OG1 : rot 180:sc=-0.00168 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=-0.034) USER MOD Single : A 113 THR OG1 : rot 7:sc= 0.754 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -92:sc= 0.886 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot -170:sc= -1.35 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 135:sc= -0.131 (180deg=-0.935) USER MOD Single : A 139 SER OG : rot -71:sc= -0.814 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 157:sc= -0.17 (180deg=-1.07) USER MOD Single : A 147 SER OG : rot 76:sc= 0.542 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.545 -0.215 -6.728 1.00 0.00 N ATOM 17 CA ALA A 82 35.349 -1.522 -6.132 1.00 0.00 C ATOM 18 C ALA A 82 33.881 -1.718 -5.780 1.00 0.00 C ATOM 19 O ALA A 82 33.418 -1.302 -4.718 1.00 0.00 O ATOM 20 CB ALA A 82 36.198 -1.646 -4.871 1.00 0.00 C ATOM 0 HA ALA A 82 35.650 -2.287 -6.848 1.00 0.00 H new ATOM 0 HB1 ALA A 82 36.048 -2.630 -4.426 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.250 -1.520 -5.127 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.904 -0.876 -4.157 1.00 0.00 H new ATOM 26 N TYR A 83 33.162 -2.371 -6.674 1.00 0.00 N ATOM 27 CA TYR A 83 31.742 -2.639 -6.466 1.00 0.00 C ATOM 28 C TYR A 83 31.522 -3.194 -5.064 1.00 0.00 C ATOM 29 O TYR A 83 30.401 -3.221 -4.561 1.00 0.00 O ATOM 30 CB TYR A 83 31.235 -3.651 -7.510 1.00 0.00 C ATOM 31 CG TYR A 83 31.907 -3.388 -8.839 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.939 -2.089 -9.366 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.500 -4.443 -9.547 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.562 -1.849 -10.594 1.00 0.00 C ATOM 35 CE2 TYR A 83 33.122 -4.201 -10.776 1.00 0.00 C ATOM 36 CZ TYR A 83 33.153 -2.902 -11.300 1.00 0.00 C ATOM 37 OH TYR A 83 33.767 -2.664 -12.511 1.00 0.00 O ATOM 0 H TYR A 83 33.534 -2.728 -7.554 1.00 0.00 H new ATOM 0 HA TYR A 83 31.187 -1.707 -6.577 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.447 -4.668 -7.179 1.00 0.00 H new ATOM 0 HB3 TYR A 83 30.153 -3.569 -7.615 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.483 -1.274 -8.823 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.476 -5.444 -9.143 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.587 -0.848 -10.999 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.578 -5.015 -11.321 1.00 0.00 H new ATOM 0 HH TYR A 83 34.126 -3.504 -12.866 1.00 0.00 H new ATOM 47 N LYS A 84 32.607 -3.635 -4.445 1.00 0.00 N ATOM 48 CA LYS A 84 32.528 -4.190 -3.096 1.00 0.00 C ATOM 49 C LYS A 84 32.089 -3.111 -2.112 1.00 0.00 C ATOM 50 O LYS A 84 31.277 -3.354 -1.222 1.00 0.00 O ATOM 51 CB LYS A 84 33.881 -4.762 -2.671 1.00 0.00 C ATOM 52 CG LYS A 84 34.216 -5.969 -3.550 1.00 0.00 C ATOM 53 CD LYS A 84 35.554 -6.562 -3.111 1.00 0.00 C ATOM 54 CE LYS A 84 35.893 -7.767 -3.991 1.00 0.00 C ATOM 55 NZ LYS A 84 37.186 -8.360 -3.545 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.544 -3.621 -4.847 1.00 0.00 H new ATOM 0 HA LYS A 84 31.793 -4.995 -3.096 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.656 -4.002 -2.766 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.851 -5.058 -1.622 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.430 -6.720 -3.471 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.265 -5.668 -4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.339 -5.810 -3.188 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.504 -6.865 -2.065 1.00 0.00 H new ATOM 0 HE2 LYS A 84 35.099 -8.511 -3.929 1.00 0.00 H new ATOM 0 HE3 LYS A 84 35.962 -7.461 -5.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 37.417 -9.179 -4.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 37.940 -7.649 -3.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 37.104 -8.667 -2.555 1.00 0.00 H new ATOM 69 N ASN A 85 32.644 -1.919 -2.282 1.00 0.00 N ATOM 70 CA ASN A 85 32.308 -0.804 -1.394 1.00 0.00 C ATOM 71 C ASN A 85 30.844 -0.416 -1.551 1.00 0.00 C ATOM 72 O ASN A 85 30.130 -0.227 -0.566 1.00 0.00 O ATOM 73 CB ASN A 85 33.192 0.404 -1.703 1.00 0.00 C ATOM 74 CG ASN A 85 32.830 1.569 -0.788 1.00 0.00 C ATOM 75 OD1 ASN A 85 31.832 1.513 -0.069 1.00 0.00 O ATOM 76 ND2 ASN A 85 33.585 2.634 -0.776 1.00 0.00 N ATOM 0 H ASN A 85 33.319 -1.696 -3.013 1.00 0.00 H new ATOM 0 HA ASN A 85 32.481 -1.124 -0.366 1.00 0.00 H new ATOM 0 HB2 ASN A 85 34.241 0.140 -1.570 1.00 0.00 H new ATOM 0 HB3 ASN A 85 33.067 0.698 -2.745 1.00 0.00 H new ATOM 0 HD21 ASN A 85 33.348 3.420 -0.171 1.00 0.00 H new ATOM 0 HD22 ASN A 85 34.412 2.680 -1.372 1.00 0.00 H new ATOM 83 N LEU A 86 30.401 -0.296 -2.793 1.00 0.00 N ATOM 84 CA LEU A 86 29.023 0.077 -3.065 1.00 0.00 C ATOM 85 C LEU A 86 28.059 -0.953 -2.494 1.00 0.00 C ATOM 86 O LEU A 86 27.025 -0.603 -1.927 1.00 0.00 O ATOM 87 CB LEU A 86 28.814 0.194 -4.567 1.00 0.00 C ATOM 88 CG LEU A 86 27.344 0.609 -4.875 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.318 1.665 -5.987 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.537 -0.617 -5.329 1.00 0.00 C ATOM 0 H LEU A 86 30.972 -0.451 -3.624 1.00 0.00 H new ATOM 0 HA LEU A 86 28.824 1.037 -2.588 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.502 0.931 -4.981 1.00 0.00 H new ATOM 0 HB3 LEU A 86 29.039 -0.758 -5.048 1.00 0.00 H new ATOM 0 HG LEU A 86 26.902 1.023 -3.969 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.286 1.949 -6.195 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.879 2.544 -5.668 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.771 1.254 -6.890 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.511 -0.318 -5.542 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.987 -1.036 -6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.540 -1.367 -4.538 1.00 0.00 H new ATOM 102 N LEU A 87 28.399 -2.224 -2.652 1.00 0.00 N ATOM 103 CA LEU A 87 27.549 -3.298 -2.155 1.00 0.00 C ATOM 104 C LEU A 87 27.320 -3.129 -0.658 1.00 0.00 C ATOM 105 O LEU A 87 26.233 -3.398 -0.149 1.00 0.00 O ATOM 106 CB LEU A 87 28.220 -4.648 -2.427 1.00 0.00 C ATOM 107 CG LEU A 87 28.049 -5.021 -3.907 1.00 0.00 C ATOM 108 CD1 LEU A 87 29.036 -6.138 -4.269 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.605 -5.497 -4.184 1.00 0.00 C ATOM 0 H LEU A 87 29.251 -2.536 -3.117 1.00 0.00 H new ATOM 0 HA LEU A 87 26.587 -3.261 -2.667 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.279 -4.596 -2.175 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.779 -5.418 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 87 28.249 -4.140 -4.516 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.916 -6.404 -5.319 1.00 0.00 H new ATOM 0 HD12 LEU A 87 30.055 -5.793 -4.097 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.839 -7.012 -3.649 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.503 -5.757 -5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.387 -6.372 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.905 -4.698 -3.938 1.00 0.00 H new ATOM 121 N GLN A 88 28.350 -2.683 0.040 1.00 0.00 N ATOM 122 CA GLN A 88 28.245 -2.470 1.475 1.00 0.00 C ATOM 123 C GLN A 88 27.367 -1.259 1.770 1.00 0.00 C ATOM 124 O GLN A 88 26.652 -1.233 2.771 1.00 0.00 O ATOM 125 CB GLN A 88 29.628 -2.246 2.080 1.00 0.00 C ATOM 126 CG GLN A 88 30.443 -3.534 1.972 1.00 0.00 C ATOM 127 CD GLN A 88 31.851 -3.309 2.508 1.00 0.00 C ATOM 128 OE1 GLN A 88 32.144 -2.251 3.064 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.749 -4.247 2.367 1.00 0.00 N ATOM 0 H GLN A 88 29.263 -2.462 -0.359 1.00 0.00 H new ATOM 0 HA GLN A 88 27.795 -3.358 1.918 1.00 0.00 H new ATOM 0 HB2 GLN A 88 30.138 -1.435 1.560 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.536 -1.947 3.124 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.955 -4.331 2.533 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.489 -3.859 0.932 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.503 -5.123 1.906 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.696 -4.104 2.718 1.00 0.00 H new ATOM 138 N GLU A 89 27.438 -0.245 0.903 1.00 0.00 N ATOM 139 CA GLU A 89 26.649 0.969 1.107 1.00 0.00 C ATOM 140 C GLU A 89 25.154 0.676 1.057 1.00 0.00 C ATOM 141 O GLU A 89 24.393 1.132 1.910 1.00 0.00 O ATOM 142 CB GLU A 89 26.998 1.996 0.030 1.00 0.00 C ATOM 143 CG GLU A 89 28.418 2.518 0.259 1.00 0.00 C ATOM 144 CD GLU A 89 28.813 3.465 -0.869 1.00 0.00 C ATOM 145 OE1 GLU A 89 27.999 3.673 -1.755 1.00 0.00 O ATOM 146 OE2 GLU A 89 29.924 3.968 -0.833 1.00 0.00 O1- ATOM 0 H GLU A 89 28.023 -0.240 0.068 1.00 0.00 H new ATOM 0 HA GLU A 89 26.889 1.364 2.094 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.922 1.542 -0.958 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.287 2.822 0.057 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.474 3.036 1.216 1.00 0.00 H new ATOM 0 HG3 GLU A 89 29.118 1.684 0.307 1.00 0.00 H new ATOM 153 N ILE A 90 24.739 -0.082 0.055 1.00 0.00 N ATOM 154 CA ILE A 90 23.328 -0.427 -0.097 1.00 0.00 C ATOM 155 C ILE A 90 22.851 -1.292 1.066 1.00 0.00 C ATOM 156 O ILE A 90 21.768 -1.075 1.609 1.00 0.00 O ATOM 157 CB ILE A 90 23.114 -1.166 -1.426 1.00 0.00 C ATOM 158 CG1 ILE A 90 24.119 -2.316 -1.543 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.318 -0.196 -2.591 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.888 -3.077 -2.844 1.00 0.00 C ATOM 0 H ILE A 90 25.351 -0.470 -0.663 1.00 0.00 H new ATOM 0 HA ILE A 90 22.745 0.494 -0.098 1.00 0.00 H new ATOM 0 HB ILE A 90 22.100 -1.564 -1.456 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.136 -1.926 -1.516 1.00 0.00 H new ATOM 0 HG13 ILE A 90 24.013 -2.991 -0.693 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.166 -0.722 -3.533 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.602 0.622 -2.513 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.331 0.204 -2.558 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.606 -3.893 -2.920 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.876 -3.482 -2.854 1.00 0.00 H new ATOM 0 HD13 ILE A 90 24.016 -2.400 -3.689 1.00 0.00 H new ATOM 172 N ALA A 91 23.659 -2.274 1.436 1.00 0.00 N ATOM 173 CA ALA A 91 23.308 -3.168 2.526 1.00 0.00 C ATOM 174 C ALA A 91 23.292 -2.426 3.855 1.00 0.00 C ATOM 175 O ALA A 91 22.348 -2.552 4.634 1.00 0.00 O ATOM 176 CB ALA A 91 24.306 -4.325 2.604 1.00 0.00 C ATOM 0 H ALA A 91 24.559 -2.471 0.998 1.00 0.00 H new ATOM 0 HA ALA A 91 22.310 -3.560 2.330 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.032 -4.987 3.425 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.291 -4.882 1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.308 -3.931 2.775 1.00 0.00 H new ATOM 182 N GLN A 92 24.342 -1.655 4.105 1.00 0.00 N ATOM 183 CA GLN A 92 24.442 -0.896 5.345 1.00 0.00 C ATOM 184 C GLN A 92 23.377 0.194 5.401 1.00 0.00 C ATOM 185 O GLN A 92 22.720 0.381 6.424 1.00 0.00 O ATOM 186 CB GLN A 92 25.830 -0.263 5.459 1.00 0.00 C ATOM 187 CG GLN A 92 25.971 0.422 6.820 1.00 0.00 C ATOM 188 CD GLN A 92 27.372 1.008 6.968 1.00 0.00 C ATOM 189 OE1 GLN A 92 27.779 1.856 6.174 1.00 0.00 O ATOM 190 NE2 GLN A 92 28.136 0.605 7.946 1.00 0.00 N ATOM 0 H GLN A 92 25.132 -1.539 3.470 1.00 0.00 H new ATOM 0 HA GLN A 92 24.284 -1.581 6.178 1.00 0.00 H new ATOM 0 HB2 GLN A 92 26.600 -1.026 5.343 1.00 0.00 H new ATOM 0 HB3 GLN A 92 25.977 0.462 4.659 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.226 1.211 6.918 1.00 0.00 H new ATOM 0 HG3 GLN A 92 25.782 -0.295 7.619 1.00 0.00 H new ATOM 0 HE21 GLN A 92 27.796 -0.098 8.602 1.00 0.00 H new ATOM 0 HE22 GLN A 92 29.073 0.993 8.054 1.00 0.00 H new ATOM 199 N LYS A 93 23.214 0.912 4.295 1.00 0.00 N ATOM 200 CA LYS A 93 22.227 1.984 4.231 1.00 0.00 C ATOM 201 C LYS A 93 20.822 1.429 4.414 1.00 0.00 C ATOM 202 O LYS A 93 20.026 1.967 5.183 1.00 0.00 O ATOM 203 CB LYS A 93 22.324 2.705 2.885 1.00 0.00 C ATOM 204 CG LYS A 93 21.369 3.901 2.874 1.00 0.00 C ATOM 205 CD LYS A 93 21.517 4.662 1.556 1.00 0.00 C ATOM 206 CE LYS A 93 20.572 5.863 1.553 1.00 0.00 C ATOM 207 NZ LYS A 93 20.741 6.624 0.281 1.00 0.00 N1+ ATOM 0 H LYS A 93 23.748 0.773 3.437 1.00 0.00 H new ATOM 0 HA LYS A 93 22.433 2.690 5.035 1.00 0.00 H new ATOM 0 HB2 LYS A 93 23.347 3.042 2.714 1.00 0.00 H new ATOM 0 HB3 LYS A 93 22.074 2.020 2.075 1.00 0.00 H new ATOM 0 HG2 LYS A 93 20.341 3.560 2.995 1.00 0.00 H new ATOM 0 HG3 LYS A 93 21.587 4.561 3.713 1.00 0.00 H new ATOM 0 HD2 LYS A 93 22.547 4.996 1.430 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.290 4.005 0.717 1.00 0.00 H new ATOM 0 HE2 LYS A 93 19.540 5.528 1.655 1.00 0.00 H new ATOM 0 HE3 LYS A 93 20.783 6.508 2.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 20.098 7.442 0.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 21.724 6.956 0.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 20.519 6.006 -0.525 1.00 0.00 H new ATOM 221 N GLU A 94 20.519 0.352 3.698 1.00 0.00 N ATOM 222 CA GLU A 94 19.197 -0.270 3.781 1.00 0.00 C ATOM 223 C GLU A 94 19.185 -1.346 4.860 1.00 0.00 C ATOM 224 O GLU A 94 18.172 -2.017 5.064 1.00 0.00 O ATOM 225 CB GLU A 94 18.829 -0.892 2.432 1.00 0.00 C ATOM 226 CG GLU A 94 18.785 0.203 1.363 1.00 0.00 C ATOM 227 CD GLU A 94 17.596 1.128 1.602 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.783 0.810 2.453 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.520 2.145 0.931 1.00 0.00 O1- ATOM 0 H GLU A 94 21.165 -0.108 3.056 1.00 0.00 H new ATOM 0 HA GLU A 94 18.466 0.497 4.038 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.559 -1.653 2.159 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.861 -1.389 2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.711 0.777 1.383 1.00 0.00 H new ATOM 0 HG3 GLU A 94 18.711 -0.248 0.373 1.00 0.00 H new ATOM 236 N SER A 95 20.312 -1.506 5.549 1.00 0.00 N ATOM 237 CA SER A 95 20.419 -2.505 6.609 1.00 0.00 C ATOM 238 C SER A 95 19.731 -3.798 6.194 1.00 0.00 C ATOM 239 O SER A 95 18.611 -4.082 6.620 1.00 0.00 O ATOM 240 CB SER A 95 19.777 -1.975 7.891 1.00 0.00 C ATOM 241 OG SER A 95 19.423 -3.071 8.725 1.00 0.00 O ATOM 0 H SER A 95 21.160 -0.960 5.394 1.00 0.00 H new ATOM 0 HA SER A 95 21.475 -2.708 6.787 1.00 0.00 H new ATOM 0 HB2 SER A 95 20.470 -1.315 8.413 1.00 0.00 H new ATOM 0 HB3 SER A 95 18.893 -1.384 7.652 1.00 0.00 H new ATOM 0 HG SER A 95 18.702 -3.584 8.303 1.00 0.00 H new ATOM 247 N SER A 96 20.401 -4.580 5.355 1.00 0.00 N ATOM 248 CA SER A 96 19.844 -5.843 4.879 1.00 0.00 C ATOM 249 C SER A 96 20.896 -6.930 4.908 1.00 0.00 C ATOM 250 O SER A 96 20.946 -7.765 4.010 1.00 0.00 O ATOM 251 CB SER A 96 19.325 -5.681 3.451 1.00 0.00 C ATOM 252 OG SER A 96 20.380 -5.229 2.614 1.00 0.00 O ATOM 0 H SER A 96 21.329 -4.363 4.990 1.00 0.00 H new ATOM 0 HA SER A 96 19.022 -6.125 5.537 1.00 0.00 H new ATOM 0 HB2 SER A 96 18.936 -6.631 3.084 1.00 0.00 H new ATOM 0 HB3 SER A 96 18.500 -4.969 3.431 1.00 0.00 H new ATOM 0 HG SER A 96 20.049 -5.126 1.697 1.00 0.00 H new ATOM 258 N LEU A 97 21.732 -6.923 5.943 1.00 0.00 N ATOM 259 CA LEU A 97 22.777 -7.924 6.084 1.00 0.00 C ATOM 260 C LEU A 97 23.959 -7.612 5.175 1.00 0.00 C ATOM 261 O LEU A 97 23.970 -7.985 4.002 1.00 0.00 O ATOM 262 CB LEU A 97 22.223 -9.320 5.756 1.00 0.00 C ATOM 263 CG LEU A 97 23.029 -10.399 6.508 1.00 0.00 C ATOM 264 CD1 LEU A 97 22.445 -10.596 7.913 1.00 0.00 C ATOM 265 CD2 LEU A 97 22.955 -11.720 5.737 1.00 0.00 C ATOM 0 H LEU A 97 21.703 -6.234 6.694 1.00 0.00 H new ATOM 0 HA LEU A 97 23.123 -7.907 7.118 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.172 -9.378 6.037 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.276 -9.498 4.682 1.00 0.00 H new ATOM 0 HG LEU A 97 24.068 -10.081 6.590 1.00 0.00 H new ATOM 0 HD11 LEU A 97 23.017 -11.359 8.441 1.00 0.00 H new ATOM 0 HD12 LEU A 97 22.498 -9.657 8.464 1.00 0.00 H new ATOM 0 HD13 LEU A 97 21.405 -10.912 7.834 1.00 0.00 H new ATOM 0 HD21 LEU A 97 23.524 -12.483 6.267 1.00 0.00 H new ATOM 0 HD22 LEU A 97 21.915 -12.035 5.654 1.00 0.00 H new ATOM 0 HD23 LEU A 97 23.373 -11.583 4.740 1.00 0.00 H new ATOM 277 N LEU A 98 24.953 -6.927 5.724 1.00 0.00 N ATOM 278 CA LEU A 98 26.130 -6.568 4.952 1.00 0.00 C ATOM 279 C LEU A 98 26.617 -7.765 4.129 1.00 0.00 C ATOM 280 O LEU A 98 26.461 -8.914 4.540 1.00 0.00 O ATOM 281 CB LEU A 98 27.252 -6.094 5.883 1.00 0.00 C ATOM 282 CG LEU A 98 27.011 -4.638 6.280 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.704 -4.536 7.069 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.174 -4.149 7.143 1.00 0.00 C ATOM 0 H LEU A 98 24.967 -6.612 6.694 1.00 0.00 H new ATOM 0 HA LEU A 98 25.860 -5.758 4.274 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.289 -6.722 6.773 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.216 -6.190 5.384 1.00 0.00 H new ATOM 0 HG LEU A 98 26.941 -4.020 5.385 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.531 -3.498 7.353 1.00 0.00 H new ATOM 0 HD12 LEU A 98 24.877 -4.886 6.451 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.772 -5.151 7.966 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.004 -3.111 7.427 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.245 -4.764 8.040 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.103 -4.223 6.578 1.00 0.00 H new ATOM 296 N PRO A 99 27.199 -7.514 2.982 1.00 0.00 N ATOM 297 CA PRO A 99 27.714 -8.596 2.088 1.00 0.00 C ATOM 298 C PRO A 99 28.926 -9.305 2.682 1.00 0.00 C ATOM 299 O PRO A 99 29.812 -8.656 3.240 1.00 0.00 O ATOM 300 CB PRO A 99 28.089 -7.843 0.797 1.00 0.00 C ATOM 301 CG PRO A 99 28.360 -6.438 1.232 1.00 0.00 C ATOM 302 CD PRO A 99 27.434 -6.176 2.411 1.00 0.00 C ATOM 0 HA PRO A 99 26.980 -9.386 1.930 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.965 -8.285 0.323 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.279 -7.881 0.069 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.404 -6.314 1.521 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.168 -5.735 0.422 1.00 0.00 H new ATOM 0 HD2 PRO A 99 27.893 -5.506 3.138 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.502 -5.709 2.091 1.00 0.00 H new ATOM 310 N PHE A 100 28.972 -10.637 2.558 1.00 0.00 N ATOM 311 CA PHE A 100 30.083 -11.414 3.088 1.00 0.00 C ATOM 312 C PHE A 100 30.659 -12.259 1.973 1.00 0.00 C ATOM 313 O PHE A 100 29.932 -12.984 1.291 1.00 0.00 O ATOM 314 CB PHE A 100 29.600 -12.308 4.230 1.00 0.00 C ATOM 315 CG PHE A 100 30.744 -13.165 4.702 1.00 0.00 C ATOM 316 CD1 PHE A 100 31.719 -12.626 5.550 1.00 0.00 C ATOM 317 CD2 PHE A 100 30.836 -14.498 4.287 1.00 0.00 C ATOM 318 CE1 PHE A 100 32.784 -13.422 5.985 1.00 0.00 C ATOM 319 CE2 PHE A 100 31.900 -15.294 4.722 1.00 0.00 C ATOM 320 CZ PHE A 100 32.876 -14.756 5.571 1.00 0.00 C ATOM 0 H PHE A 100 28.252 -11.192 2.096 1.00 0.00 H new ATOM 0 HA PHE A 100 30.850 -10.744 3.477 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.223 -11.698 5.051 1.00 0.00 H new ATOM 0 HB3 PHE A 100 28.774 -12.935 3.893 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.649 -11.596 5.868 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.085 -14.912 3.631 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.535 -13.007 6.640 1.00 0.00 H new ATOM 0 HE2 PHE A 100 31.969 -16.324 4.404 1.00 0.00 H new ATOM 0 HZ PHE A 100 33.699 -15.370 5.906 1.00 0.00 H new ATOM 330 N TYR A 101 31.965 -12.155 1.777 1.00 0.00 N ATOM 331 CA TYR A 101 32.623 -12.907 0.722 1.00 0.00 C ATOM 332 C TYR A 101 33.170 -14.225 1.266 1.00 0.00 C ATOM 333 O TYR A 101 33.689 -14.280 2.382 1.00 0.00 O ATOM 334 CB TYR A 101 33.779 -12.087 0.142 1.00 0.00 C ATOM 335 CG TYR A 101 33.246 -10.786 -0.404 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.698 -10.736 -1.690 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.295 -9.628 0.383 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.198 -9.528 -2.190 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.795 -8.421 -0.116 1.00 0.00 C ATOM 340 CZ TYR A 101 32.247 -8.370 -1.403 1.00 0.00 C ATOM 341 OH TYR A 101 31.751 -7.181 -1.894 1.00 0.00 O ATOM 0 H TYR A 101 32.584 -11.562 2.330 1.00 0.00 H new ATOM 0 HA TYR A 101 31.891 -13.118 -0.058 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.524 -11.892 0.913 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.277 -12.649 -0.648 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.661 -11.629 -2.297 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.719 -9.667 1.375 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.774 -9.489 -3.183 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.832 -7.529 0.491 1.00 0.00 H new ATOM 0 HH TYR A 101 31.862 -6.478 -1.221 1.00 0.00 H new ATOM 351 N ALA A 102 33.064 -15.289 0.473 1.00 0.00 N ATOM 352 CA ALA A 102 33.560 -16.602 0.884 1.00 0.00 C ATOM 353 C ALA A 102 34.293 -17.263 -0.264 1.00 0.00 C ATOM 354 O ALA A 102 33.843 -17.206 -1.406 1.00 0.00 O ATOM 355 CB ALA A 102 32.394 -17.484 1.325 1.00 0.00 C ATOM 0 H ALA A 102 32.641 -15.269 -0.455 1.00 0.00 H new ATOM 0 HA ALA A 102 34.248 -16.472 1.719 1.00 0.00 H new ATOM 0 HB1 ALA A 102 32.771 -18.460 1.630 1.00 0.00 H new ATOM 0 HB2 ALA A 102 31.880 -17.015 2.164 1.00 0.00 H new ATOM 0 HB3 ALA A 102 31.697 -17.607 0.496 1.00 0.00 H new ATOM 361 N THR A 103 35.425 -17.893 0.041 1.00 0.00 N ATOM 362 CA THR A 103 36.223 -18.569 -0.982 1.00 0.00 C ATOM 363 C THR A 103 36.360 -20.052 -0.657 1.00 0.00 C ATOM 364 O THR A 103 36.780 -20.415 0.442 1.00 0.00 O ATOM 365 CB THR A 103 37.619 -17.946 -1.048 1.00 0.00 C ATOM 366 OG1 THR A 103 37.493 -16.536 -1.173 1.00 0.00 O ATOM 367 CG2 THR A 103 38.377 -18.491 -2.266 1.00 0.00 C ATOM 0 H THR A 103 35.810 -17.950 0.984 1.00 0.00 H new ATOM 0 HA THR A 103 35.719 -18.455 -1.942 1.00 0.00 H new ATOM 0 HB THR A 103 38.168 -18.195 -0.140 1.00 0.00 H new ATOM 0 HG1 THR A 103 36.848 -16.327 -1.881 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.370 -18.043 -2.307 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.470 -19.574 -2.182 1.00 0.00 H new ATOM 0 HG23 THR A 103 37.830 -18.244 -3.176 1.00 0.00 H new ATOM 375 N ALA A 104 36.007 -20.906 -1.619 1.00 0.00 N ATOM 376 CA ALA A 104 36.101 -22.357 -1.429 1.00 0.00 C ATOM 377 C ALA A 104 36.895 -22.984 -2.569 1.00 0.00 C ATOM 378 O ALA A 104 36.936 -22.445 -3.674 1.00 0.00 O ATOM 379 CB ALA A 104 34.697 -22.961 -1.387 1.00 0.00 C ATOM 0 H ALA A 104 35.655 -20.622 -2.533 1.00 0.00 H new ATOM 0 HA ALA A 104 36.612 -22.560 -0.488 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.769 -24.039 -1.246 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.137 -22.523 -0.560 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.183 -22.751 -2.325 1.00 0.00 H new ATOM 385 N THR A 105 37.524 -24.130 -2.298 1.00 0.00 N ATOM 386 CA THR A 105 38.310 -24.827 -3.301 1.00 0.00 C ATOM 387 C THR A 105 37.531 -26.017 -3.846 1.00 0.00 C ATOM 388 O THR A 105 36.943 -26.789 -3.087 1.00 0.00 O ATOM 389 CB THR A 105 39.608 -25.312 -2.669 1.00 0.00 C ATOM 390 OG1 THR A 105 39.334 -26.346 -1.735 1.00 0.00 O ATOM 391 CG2 THR A 105 40.309 -24.148 -1.965 1.00 0.00 C ATOM 0 H THR A 105 37.500 -24.590 -1.388 1.00 0.00 H new ATOM 0 HA THR A 105 38.530 -24.146 -4.123 1.00 0.00 H new ATOM 0 HB THR A 105 40.261 -25.702 -3.450 1.00 0.00 H new ATOM 0 HG1 THR A 105 40.173 -26.655 -1.333 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.237 -24.501 -1.515 1.00 0.00 H new ATOM 0 HG22 THR A 105 40.532 -23.365 -2.690 1.00 0.00 H new ATOM 0 HG23 THR A 105 39.658 -23.748 -1.188 1.00 0.00 H new ATOM 399 N SER A 106 37.518 -26.154 -5.166 1.00 0.00 N ATOM 400 CA SER A 106 36.802 -27.250 -5.802 1.00 0.00 C ATOM 401 C SER A 106 37.279 -27.431 -7.228 1.00 0.00 C ATOM 402 O SER A 106 37.958 -26.563 -7.776 1.00 0.00 O ATOM 403 CB SER A 106 35.302 -26.969 -5.800 1.00 0.00 C ATOM 404 OG SER A 106 35.061 -25.705 -6.404 1.00 0.00 O ATOM 0 H SER A 106 37.992 -25.524 -5.813 1.00 0.00 H new ATOM 0 HA SER A 106 36.999 -28.163 -5.240 1.00 0.00 H new ATOM 0 HB2 SER A 106 34.773 -27.752 -6.344 1.00 0.00 H new ATOM 0 HB3 SER A 106 34.920 -26.976 -4.779 1.00 0.00 H new ATOM 0 HG SER A 106 34.098 -25.522 -6.406 1.00 0.00 H new ATOM 410 N GLY A 107 36.917 -28.565 -7.832 1.00 0.00 N ATOM 411 CA GLY A 107 37.308 -28.850 -9.210 1.00 0.00 C ATOM 412 C GLY A 107 38.131 -30.133 -9.295 1.00 0.00 C ATOM 413 O GLY A 107 38.124 -30.946 -8.370 1.00 0.00 O ATOM 0 H GLY A 107 36.358 -29.295 -7.391 1.00 0.00 H new ATOM 0 HA2 GLY A 107 36.418 -28.944 -9.832 1.00 0.00 H new ATOM 0 HA3 GLY A 107 37.887 -28.016 -9.607 1.00 0.00 H new ATOM 417 N PRO A 108 38.825 -30.331 -10.389 1.00 0.00 N ATOM 418 CA PRO A 108 39.659 -31.552 -10.603 1.00 0.00 C ATOM 419 C PRO A 108 40.886 -31.583 -9.695 1.00 0.00 C ATOM 420 O PRO A 108 41.463 -30.543 -9.380 1.00 0.00 O ATOM 421 CB PRO A 108 40.071 -31.462 -12.084 1.00 0.00 C ATOM 422 CG PRO A 108 39.984 -30.019 -12.426 1.00 0.00 C ATOM 423 CD PRO A 108 38.895 -29.415 -11.543 1.00 0.00 C ATOM 0 HA PRO A 108 39.112 -32.464 -10.364 1.00 0.00 H new ATOM 0 HB2 PRO A 108 41.081 -31.842 -12.235 1.00 0.00 H new ATOM 0 HB3 PRO A 108 39.409 -32.056 -12.714 1.00 0.00 H new ATOM 0 HG2 PRO A 108 40.939 -29.524 -12.253 1.00 0.00 H new ATOM 0 HG3 PRO A 108 39.743 -29.887 -13.481 1.00 0.00 H new ATOM 0 HD2 PRO A 108 39.148 -28.401 -11.233 1.00 0.00 H new ATOM 0 HD3 PRO A 108 37.941 -29.359 -12.067 1.00 0.00 H new ATOM 431 N SER A 109 41.289 -32.783 -9.302 1.00 0.00 N ATOM 432 CA SER A 109 42.459 -32.936 -8.451 1.00 0.00 C ATOM 433 C SER A 109 43.718 -32.563 -9.229 1.00 0.00 C ATOM 434 O SER A 109 44.771 -32.323 -8.640 1.00 0.00 O ATOM 435 CB SER A 109 42.569 -34.386 -7.966 1.00 0.00 C ATOM 436 OG SER A 109 42.676 -35.253 -9.090 1.00 0.00 O ATOM 0 H SER A 109 40.828 -33.657 -9.556 1.00 0.00 H new ATOM 0 HA SER A 109 42.357 -32.276 -7.590 1.00 0.00 H new ATOM 0 HB2 SER A 109 43.440 -34.500 -7.320 1.00 0.00 H new ATOM 0 HB3 SER A 109 41.694 -34.650 -7.371 1.00 0.00 H new ATOM 0 HG SER A 109 42.748 -36.181 -8.782 1.00 0.00 H new ATOM 442 N HIS A 110 43.600 -32.515 -10.561 1.00 0.00 N ATOM 443 CA HIS A 110 44.739 -32.169 -11.409 1.00 0.00 C ATOM 444 C HIS A 110 44.847 -30.664 -11.551 1.00 0.00 C ATOM 445 O HIS A 110 45.941 -30.104 -11.487 1.00 0.00 O ATOM 446 CB HIS A 110 44.587 -32.809 -12.786 1.00 0.00 C ATOM 447 CG HIS A 110 44.695 -34.302 -12.655 1.00 0.00 C ATOM 448 ND1 HIS A 110 45.885 -34.933 -12.321 1.00 0.00 N ATOM 449 CD2 HIS A 110 43.771 -35.305 -12.810 1.00 0.00 C ATOM 450 CE1 HIS A 110 45.647 -36.257 -12.288 1.00 0.00 C ATOM 451 NE2 HIS A 110 44.374 -36.538 -12.578 1.00 0.00 N ATOM 0 H HIS A 110 42.736 -32.710 -11.067 1.00 0.00 H new ATOM 0 HA HIS A 110 45.648 -32.548 -10.941 1.00 0.00 H new ATOM 0 HB2 HIS A 110 43.624 -32.539 -13.221 1.00 0.00 H new ATOM 0 HB3 HIS A 110 45.357 -32.435 -13.460 1.00 0.00 H new ATOM 0 HD2 HIS A 110 42.733 -35.160 -13.072 1.00 0.00 H new ATOM 0 HE1 HIS A 110 46.394 -37.001 -12.055 1.00 0.00 H new ATOM 0 HE2 HIS A 110 43.937 -37.459 -12.620 1.00 0.00 H new ATOM 459 N ALA A 111 43.695 -30.008 -11.719 1.00 0.00 N ATOM 460 CA ALA A 111 43.656 -28.546 -11.838 1.00 0.00 C ATOM 461 C ALA A 111 42.670 -27.959 -10.829 1.00 0.00 C ATOM 462 O ALA A 111 41.550 -27.591 -11.185 1.00 0.00 O ATOM 463 CB ALA A 111 43.272 -28.142 -13.271 1.00 0.00 C ATOM 0 H ALA A 111 42.783 -30.461 -11.775 1.00 0.00 H new ATOM 0 HA ALA A 111 44.647 -28.147 -11.621 1.00 0.00 H new ATOM 0 HB1 ALA A 111 43.246 -27.055 -13.348 1.00 0.00 H new ATOM 0 HB2 ALA A 111 44.008 -28.538 -13.970 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.289 -28.546 -13.512 1.00 0.00 H new ATOM 469 N PRO A 112 43.061 -27.857 -9.589 1.00 0.00 N ATOM 470 CA PRO A 112 42.185 -27.307 -8.517 1.00 0.00 C ATOM 471 C PRO A 112 41.753 -25.868 -8.799 1.00 0.00 C ATOM 472 O PRO A 112 42.588 -24.995 -9.020 1.00 0.00 O ATOM 473 CB PRO A 112 43.061 -27.383 -7.248 1.00 0.00 C ATOM 474 CG PRO A 112 44.136 -28.372 -7.570 1.00 0.00 C ATOM 475 CD PRO A 112 44.373 -28.256 -9.067 1.00 0.00 C ATOM 0 HA PRO A 112 41.253 -27.865 -8.429 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.483 -26.409 -7.003 1.00 0.00 H new ATOM 0 HB3 PRO A 112 42.477 -27.704 -6.385 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.047 -28.154 -7.012 1.00 0.00 H new ATOM 0 HG3 PRO A 112 43.831 -29.383 -7.300 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.139 -27.515 -9.296 1.00 0.00 H new ATOM 0 HD3 PRO A 112 44.705 -29.201 -9.496 1.00 0.00 H new ATOM 483 N THR A 113 40.445 -25.633 -8.784 1.00 0.00 N ATOM 484 CA THR A 113 39.896 -24.300 -9.034 1.00 0.00 C ATOM 485 C THR A 113 39.280 -23.745 -7.767 1.00 0.00 C ATOM 486 O THR A 113 39.194 -24.436 -6.752 1.00 0.00 O ATOM 487 CB THR A 113 38.839 -24.368 -10.141 1.00 0.00 C ATOM 488 OG1 THR A 113 37.754 -25.178 -9.713 1.00 0.00 O ATOM 489 CG2 THR A 113 39.458 -24.966 -11.408 1.00 0.00 C ATOM 0 H THR A 113 39.742 -26.349 -8.601 1.00 0.00 H new ATOM 0 HA THR A 113 40.703 -23.641 -9.353 1.00 0.00 H new ATOM 0 HB THR A 113 38.477 -23.363 -10.357 1.00 0.00 H new ATOM 0 HG1 THR A 113 37.878 -25.420 -8.771 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.704 -25.013 -12.194 1.00 0.00 H new ATOM 0 HG22 THR A 113 40.287 -24.340 -11.738 1.00 0.00 H new ATOM 0 HG23 THR A 113 39.824 -25.971 -11.195 1.00 0.00 H new ATOM 497 N PHE A 114 38.860 -22.489 -7.830 1.00 0.00 N ATOM 498 CA PHE A 114 38.251 -21.831 -6.672 1.00 0.00 C ATOM 499 C PHE A 114 36.960 -21.125 -7.072 1.00 0.00 C ATOM 500 O PHE A 114 36.844 -20.618 -8.185 1.00 0.00 O ATOM 501 CB PHE A 114 39.241 -20.809 -6.088 1.00 0.00 C ATOM 502 CG PHE A 114 40.650 -21.284 -6.344 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.183 -22.337 -5.598 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.424 -20.669 -7.329 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.488 -22.774 -5.832 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.727 -21.098 -7.564 1.00 0.00 C ATOM 507 CZ PHE A 114 43.266 -22.150 -6.815 1.00 0.00 C ATOM 0 H PHE A 114 38.927 -21.904 -8.663 1.00 0.00 H new ATOM 0 HA PHE A 114 38.014 -22.586 -5.922 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.085 -19.831 -6.544 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.072 -20.692 -5.018 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.584 -22.815 -4.837 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.011 -19.858 -7.910 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.897 -23.591 -5.256 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.323 -20.618 -8.326 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.279 -22.480 -6.994 1.00 0.00 H new ATOM 517 N THR A 115 35.998 -21.094 -6.153 1.00 0.00 N ATOM 518 CA THR A 115 34.718 -20.436 -6.412 1.00 0.00 C ATOM 519 C THR A 115 34.384 -19.481 -5.276 1.00 0.00 C ATOM 520 O THR A 115 34.340 -19.877 -4.111 1.00 0.00 O ATOM 521 CB THR A 115 33.616 -21.484 -6.550 1.00 0.00 C ATOM 522 OG1 THR A 115 33.945 -22.369 -7.613 1.00 0.00 O ATOM 523 CG2 THR A 115 32.288 -20.789 -6.852 1.00 0.00 C ATOM 0 H THR A 115 36.078 -21.514 -5.227 1.00 0.00 H new ATOM 0 HA THR A 115 34.791 -19.870 -7.340 1.00 0.00 H new ATOM 0 HB THR A 115 33.524 -22.047 -5.621 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.242 -23.045 -7.705 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.501 -21.536 -6.951 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.041 -20.107 -6.038 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.374 -20.228 -7.782 1.00 0.00 H new ATOM 531 N SER A 116 34.150 -18.218 -5.620 1.00 0.00 N ATOM 532 CA SER A 116 33.821 -17.213 -4.615 1.00 0.00 C ATOM 533 C SER A 116 32.313 -17.061 -4.486 1.00 0.00 C ATOM 534 O SER A 116 31.626 -16.754 -5.461 1.00 0.00 O ATOM 535 CB SER A 116 34.426 -15.867 -5.008 1.00 0.00 C ATOM 536 OG SER A 116 35.842 -15.942 -4.917 1.00 0.00 O ATOM 0 H SER A 116 34.182 -17.869 -6.578 1.00 0.00 H new ATOM 0 HA SER A 116 34.231 -17.538 -3.659 1.00 0.00 H new ATOM 0 HB2 SER A 116 34.129 -15.605 -6.024 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.049 -15.081 -4.353 1.00 0.00 H new ATOM 0 HG SER A 116 36.128 -15.653 -4.026 1.00 0.00 H new ATOM 542 N THR A 117 31.798 -17.279 -3.278 1.00 0.00 N ATOM 543 CA THR A 117 30.361 -17.167 -3.024 1.00 0.00 C ATOM 544 C THR A 117 30.080 -15.988 -2.106 1.00 0.00 C ATOM 545 O THR A 117 30.670 -15.871 -1.034 1.00 0.00 O ATOM 546 CB THR A 117 29.847 -18.452 -2.371 1.00 0.00 C ATOM 547 OG1 THR A 117 30.029 -19.541 -3.264 1.00 0.00 O ATOM 548 CG2 THR A 117 28.362 -18.298 -2.050 1.00 0.00 C ATOM 0 H THR A 117 32.352 -17.534 -2.460 1.00 0.00 H new ATOM 0 HA THR A 117 29.850 -17.011 -3.974 1.00 0.00 H new ATOM 0 HB THR A 117 30.400 -18.641 -1.451 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.702 -20.365 -2.846 1.00 0.00 H new ATOM 0 HG21 THR A 117 27.994 -19.212 -1.585 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.223 -17.461 -1.366 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.808 -18.111 -2.970 1.00 0.00 H new ATOM 556 N VAL A 118 29.174 -15.113 -2.536 1.00 0.00 N ATOM 557 CA VAL A 118 28.813 -13.931 -1.752 1.00 0.00 C ATOM 558 C VAL A 118 27.377 -14.046 -1.269 1.00 0.00 C ATOM 559 O VAL A 118 26.521 -14.588 -1.967 1.00 0.00 O ATOM 560 CB VAL A 118 28.964 -12.669 -2.603 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.937 -12.686 -3.738 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.736 -11.438 -1.724 1.00 0.00 C ATOM 0 H VAL A 118 28.676 -15.199 -3.422 1.00 0.00 H new ATOM 0 HA VAL A 118 29.479 -13.866 -0.892 1.00 0.00 H new ATOM 0 HB VAL A 118 29.967 -12.635 -3.028 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.047 -11.785 -4.342 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.100 -13.564 -4.363 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.932 -12.720 -3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.843 -10.536 -2.326 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.733 -11.475 -1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.470 -11.425 -0.918 1.00 0.00 H new ATOM 572 N GLU A 119 27.122 -13.535 -0.066 1.00 0.00 N ATOM 573 CA GLU A 119 25.781 -13.581 0.521 1.00 0.00 C ATOM 574 C GLU A 119 25.330 -12.191 0.940 1.00 0.00 C ATOM 575 O GLU A 119 26.074 -11.453 1.581 1.00 0.00 O ATOM 576 CB GLU A 119 25.777 -14.509 1.735 1.00 0.00 C ATOM 577 CG GLU A 119 24.351 -14.637 2.277 1.00 0.00 C ATOM 578 CD GLU A 119 24.327 -15.590 3.465 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.394 -15.912 3.962 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.243 -15.983 3.862 1.00 0.00 O1- ATOM 0 H GLU A 119 27.824 -13.085 0.522 1.00 0.00 H new ATOM 0 HA GLU A 119 25.089 -13.961 -0.230 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.161 -15.491 1.457 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.437 -14.116 2.508 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.979 -13.658 2.579 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.687 -15.003 1.494 1.00 0.00 H new ATOM 587 N PHE A 120 24.101 -11.845 0.574 1.00 0.00 N ATOM 588 CA PHE A 120 23.555 -10.538 0.930 1.00 0.00 C ATOM 589 C PHE A 120 22.047 -10.505 0.691 1.00 0.00 C ATOM 590 O PHE A 120 21.522 -11.284 -0.102 1.00 0.00 O ATOM 591 CB PHE A 120 24.230 -9.441 0.108 1.00 0.00 C ATOM 592 CG PHE A 120 23.858 -9.597 -1.345 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.693 -8.996 -1.833 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.674 -10.340 -2.203 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.343 -9.138 -3.181 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.327 -10.482 -3.551 1.00 0.00 C ATOM 597 CZ PHE A 120 23.162 -9.879 -4.040 1.00 0.00 C ATOM 0 H PHE A 120 23.470 -12.441 0.038 1.00 0.00 H new ATOM 0 HA PHE A 120 23.749 -10.363 1.988 1.00 0.00 H new ATOM 0 HB2 PHE A 120 23.922 -8.460 0.469 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.312 -9.498 0.225 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.063 -8.422 -1.169 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.573 -10.805 -1.825 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.442 -8.676 -3.557 1.00 0.00 H new ATOM 0 HE2 PHE A 120 24.957 -11.056 -4.214 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.895 -9.986 -5.081 1.00 0.00 H new ATOM 607 N ALA A 121 21.357 -9.591 1.366 1.00 0.00 N ATOM 608 CA ALA A 121 19.912 -9.468 1.205 1.00 0.00 C ATOM 609 C ALA A 121 19.226 -10.811 1.436 1.00 0.00 C ATOM 610 O ALA A 121 18.091 -11.023 1.007 1.00 0.00 O ATOM 611 CB ALA A 121 19.580 -8.956 -0.197 1.00 0.00 C ATOM 0 H ALA A 121 21.770 -8.930 2.024 1.00 0.00 H new ATOM 0 HA ALA A 121 19.546 -8.756 1.945 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.499 -8.868 -0.306 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.040 -7.979 -0.346 1.00 0.00 H new ATOM 0 HB3 ALA A 121 19.964 -9.655 -0.940 1.00 0.00 H new ATOM 617 N GLY A 122 19.923 -11.714 2.118 1.00 0.00 N ATOM 618 CA GLY A 122 19.369 -13.034 2.403 1.00 0.00 C ATOM 619 C GLY A 122 19.439 -13.936 1.176 1.00 0.00 C ATOM 620 O GLY A 122 18.702 -14.914 1.071 1.00 0.00 O ATOM 0 H GLY A 122 20.864 -11.559 2.481 1.00 0.00 H new ATOM 0 HA2 GLY A 122 19.917 -13.492 3.226 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.333 -12.935 2.726 1.00 0.00 H new ATOM 624 N LYS A 123 20.330 -13.601 0.250 1.00 0.00 N ATOM 625 CA LYS A 123 20.501 -14.383 -0.976 1.00 0.00 C ATOM 626 C LYS A 123 21.973 -14.648 -1.227 1.00 0.00 C ATOM 627 O LYS A 123 22.830 -13.867 -0.816 1.00 0.00 O ATOM 628 CB LYS A 123 19.893 -13.635 -2.162 1.00 0.00 C ATOM 629 CG LYS A 123 18.371 -13.629 -2.029 1.00 0.00 C ATOM 630 CD LYS A 123 17.761 -12.890 -3.220 1.00 0.00 C ATOM 631 CE LYS A 123 16.238 -12.882 -3.092 1.00 0.00 C ATOM 632 NZ LYS A 123 15.645 -12.149 -4.245 1.00 0.00 N1+ ATOM 0 H LYS A 123 20.948 -12.792 0.322 1.00 0.00 H new ATOM 0 HA LYS A 123 19.988 -15.338 -0.859 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.271 -12.613 -2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.186 -14.113 -3.097 1.00 0.00 H new ATOM 0 HG2 LYS A 123 17.994 -14.651 -1.989 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.078 -13.145 -1.097 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.138 -11.868 -3.259 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.055 -13.374 -4.151 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.860 -13.904 -3.064 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.944 -12.407 -2.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.609 -12.144 -4.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.997 -11.170 -4.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.915 -12.620 -5.132 1.00 0.00 H new ATOM 646 N VAL A 124 22.263 -15.758 -1.905 1.00 0.00 N ATOM 647 CA VAL A 124 23.647 -16.130 -2.209 1.00 0.00 C ATOM 648 C VAL A 124 23.861 -16.239 -3.710 1.00 0.00 C ATOM 649 O VAL A 124 23.117 -16.934 -4.404 1.00 0.00 O ATOM 650 CB VAL A 124 23.970 -17.477 -1.558 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.069 -18.568 -2.151 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.436 -17.827 -1.820 1.00 0.00 C ATOM 0 H VAL A 124 21.563 -16.413 -2.253 1.00 0.00 H new ATOM 0 HA VAL A 124 24.305 -15.355 -1.815 1.00 0.00 H new ATOM 0 HB VAL A 124 23.795 -17.412 -0.484 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.302 -19.525 -1.685 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.024 -18.318 -1.965 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.239 -18.636 -3.225 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.669 -18.786 -1.358 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.608 -17.891 -2.894 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.076 -17.054 -1.395 1.00 0.00 H new ATOM 662 N PHE A 125 24.882 -15.545 -4.209 1.00 0.00 N ATOM 663 CA PHE A 125 25.198 -15.566 -5.639 1.00 0.00 C ATOM 664 C PHE A 125 26.536 -16.257 -5.871 1.00 0.00 C ATOM 665 O PHE A 125 27.570 -15.819 -5.361 1.00 0.00 O ATOM 666 CB PHE A 125 25.262 -14.137 -6.174 1.00 0.00 C ATOM 667 CG PHE A 125 23.894 -13.504 -6.076 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.420 -13.063 -4.836 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.103 -13.352 -7.221 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.155 -12.474 -4.742 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.838 -12.762 -7.125 1.00 0.00 C ATOM 672 CZ PHE A 125 21.365 -12.322 -5.885 1.00 0.00 C ATOM 0 H PHE A 125 25.504 -14.963 -3.648 1.00 0.00 H new ATOM 0 HA PHE A 125 24.417 -16.116 -6.164 1.00 0.00 H new ATOM 0 HB2 PHE A 125 25.986 -13.555 -5.603 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.601 -14.139 -7.210 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.030 -13.177 -3.952 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.469 -13.690 -8.179 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.788 -12.136 -3.784 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.227 -12.647 -8.008 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.389 -11.865 -5.810 1.00 0.00 H new ATOM 682 N SER A 126 26.509 -17.338 -6.643 1.00 0.00 N ATOM 683 CA SER A 126 27.726 -18.086 -6.940 1.00 0.00 C ATOM 684 C SER A 126 28.478 -17.442 -8.099 1.00 0.00 C ATOM 685 O SER A 126 27.873 -17.016 -9.084 1.00 0.00 O ATOM 686 CB SER A 126 27.377 -19.530 -7.295 1.00 0.00 C ATOM 687 OG SER A 126 26.801 -20.166 -6.163 1.00 0.00 O ATOM 0 H SER A 126 25.664 -17.714 -7.072 1.00 0.00 H new ATOM 0 HA SER A 126 28.364 -18.075 -6.056 1.00 0.00 H new ATOM 0 HB2 SER A 126 26.680 -19.552 -8.133 1.00 0.00 H new ATOM 0 HB3 SER A 126 28.272 -20.065 -7.611 1.00 0.00 H new ATOM 0 HG SER A 126 26.574 -21.092 -6.388 1.00 0.00 H new ATOM 693 N GLY A 127 29.801 -17.378 -7.979 1.00 0.00 N ATOM 694 CA GLY A 127 30.629 -16.787 -9.023 1.00 0.00 C ATOM 695 C GLY A 127 30.949 -17.814 -10.097 1.00 0.00 C ATOM 696 O GLY A 127 30.366 -18.901 -10.123 1.00 0.00 O ATOM 0 H GLY A 127 30.320 -17.727 -7.173 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.111 -15.937 -9.468 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.554 -16.406 -8.589 1.00 0.00 H new ATOM 700 N GLU A 128 31.873 -17.465 -10.989 1.00 0.00 N ATOM 701 CA GLU A 128 32.260 -18.364 -12.070 1.00 0.00 C ATOM 702 C GLU A 128 33.536 -19.138 -11.710 1.00 0.00 C ATOM 703 O GLU A 128 34.514 -18.558 -11.239 1.00 0.00 O ATOM 704 CB GLU A 128 32.472 -17.564 -13.373 1.00 0.00 C ATOM 705 CG GLU A 128 33.909 -17.037 -13.445 1.00 0.00 C ATOM 706 CD GLU A 128 34.021 -15.932 -14.478 1.00 0.00 C ATOM 707 OE1 GLU A 128 33.316 -16.005 -15.470 1.00 0.00 O ATOM 708 OE2 GLU A 128 34.812 -15.031 -14.262 1.00 0.00 O1- ATOM 0 H GLU A 128 32.364 -16.571 -10.984 1.00 0.00 H new ATOM 0 HA GLU A 128 31.456 -19.085 -12.221 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.266 -18.199 -14.235 1.00 0.00 H new ATOM 0 HB3 GLU A 128 31.770 -16.732 -13.415 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.214 -16.661 -12.468 1.00 0.00 H new ATOM 0 HG3 GLU A 128 34.588 -17.851 -13.700 1.00 0.00 H new ATOM 715 N GLU A 129 33.527 -20.439 -11.930 1.00 0.00 N ATOM 716 CA GLU A 129 34.699 -21.248 -11.627 1.00 0.00 C ATOM 717 C GLU A 129 35.929 -20.699 -12.349 1.00 0.00 C ATOM 718 O GLU A 129 35.833 -20.179 -13.461 1.00 0.00 O ATOM 719 CB GLU A 129 34.454 -22.691 -12.064 1.00 0.00 C ATOM 720 CG GLU A 129 33.385 -23.318 -11.168 1.00 0.00 C ATOM 721 CD GLU A 129 33.063 -24.728 -11.649 1.00 0.00 C ATOM 722 OE1 GLU A 129 33.647 -25.142 -12.636 1.00 0.00 O ATOM 723 OE2 GLU A 129 32.239 -25.372 -11.023 1.00 0.00 O1- ATOM 0 H GLU A 129 32.735 -20.955 -12.312 1.00 0.00 H new ATOM 0 HA GLU A 129 34.877 -21.215 -10.552 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.133 -22.718 -13.105 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.379 -23.264 -12.001 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.735 -23.348 -10.136 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.483 -22.706 -11.181 1.00 0.00 H new ATOM 730 N ALA A 130 37.085 -20.819 -11.705 1.00 0.00 N ATOM 731 CA ALA A 130 38.329 -20.334 -12.289 1.00 0.00 C ATOM 732 C ALA A 130 39.523 -20.818 -11.479 1.00 0.00 C ATOM 733 O ALA A 130 39.385 -21.193 -10.315 1.00 0.00 O ATOM 734 CB ALA A 130 38.327 -18.807 -12.336 1.00 0.00 C ATOM 0 H ALA A 130 37.186 -21.245 -10.784 1.00 0.00 H new ATOM 0 HA ALA A 130 38.408 -20.726 -13.303 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.261 -18.455 -12.774 1.00 0.00 H new ATOM 0 HB2 ALA A 130 37.489 -18.463 -12.943 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.229 -18.412 -11.325 1.00 0.00 H new ATOM 740 N LYS A 131 40.699 -20.801 -12.096 1.00 0.00 N ATOM 741 CA LYS A 131 41.921 -21.237 -11.423 1.00 0.00 C ATOM 742 C LYS A 131 42.604 -20.057 -10.740 1.00 0.00 C ATOM 743 O LYS A 131 43.828 -20.002 -10.644 1.00 0.00 O ATOM 744 CB LYS A 131 42.881 -21.877 -12.431 1.00 0.00 C ATOM 745 CG LYS A 131 43.871 -22.790 -11.698 1.00 0.00 C ATOM 746 CD LYS A 131 44.726 -23.545 -12.715 1.00 0.00 C ATOM 747 CE LYS A 131 45.731 -22.591 -13.369 1.00 0.00 C ATOM 748 NZ LYS A 131 46.805 -23.380 -14.025 1.00 0.00 N1+ ATOM 0 H LYS A 131 40.834 -20.491 -13.058 1.00 0.00 H new ATOM 0 HA LYS A 131 41.652 -21.975 -10.667 1.00 0.00 H new ATOM 0 HB2 LYS A 131 42.319 -22.451 -13.168 1.00 0.00 H new ATOM 0 HB3 LYS A 131 43.421 -21.102 -12.975 1.00 0.00 H new ATOM 0 HG2 LYS A 131 44.508 -22.198 -11.041 1.00 0.00 H new ATOM 0 HG3 LYS A 131 43.331 -23.496 -11.067 1.00 0.00 H new ATOM 0 HD2 LYS A 131 45.255 -24.361 -12.223 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.088 -23.992 -13.477 1.00 0.00 H new ATOM 0 HE2 LYS A 131 45.227 -21.961 -14.103 1.00 0.00 H new ATOM 0 HE3 LYS A 131 46.159 -21.926 -12.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 47.488 -22.734 -14.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 47.291 -23.963 -13.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 46.388 -23.997 -14.752 1.00 0.00 H new ATOM 762 N THR A 132 41.804 -19.113 -10.273 1.00 0.00 N ATOM 763 CA THR A 132 42.343 -17.928 -9.602 1.00 0.00 C ATOM 764 C THR A 132 41.344 -17.386 -8.589 1.00 0.00 C ATOM 765 O THR A 132 40.138 -17.373 -8.839 1.00 0.00 O ATOM 766 CB THR A 132 42.671 -16.841 -10.648 1.00 0.00 C ATOM 767 OG1 THR A 132 42.316 -15.564 -10.138 1.00 0.00 O ATOM 768 CG2 THR A 132 41.890 -17.110 -11.937 1.00 0.00 C ATOM 0 H THR A 132 40.787 -19.137 -10.342 1.00 0.00 H new ATOM 0 HA THR A 132 43.254 -18.210 -9.074 1.00 0.00 H new ATOM 0 HB THR A 132 43.740 -16.862 -10.862 1.00 0.00 H new ATOM 0 HG1 THR A 132 42.375 -14.898 -10.854 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.125 -16.340 -12.672 1.00 0.00 H new ATOM 0 HG22 THR A 132 42.167 -18.087 -12.333 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.821 -17.095 -11.725 1.00 0.00 H new ATOM 776 N LYS A 133 41.852 -16.940 -7.447 1.00 0.00 N ATOM 777 CA LYS A 133 40.994 -16.396 -6.403 1.00 0.00 C ATOM 778 C LYS A 133 40.495 -15.004 -6.765 1.00 0.00 C ATOM 779 O LYS A 133 39.309 -14.701 -6.628 1.00 0.00 O ATOM 780 CB LYS A 133 41.762 -16.332 -5.084 1.00 0.00 C ATOM 781 CG LYS A 133 40.774 -16.243 -3.920 1.00 0.00 C ATOM 782 CD LYS A 133 41.537 -16.216 -2.592 1.00 0.00 C ATOM 783 CE LYS A 133 42.274 -17.546 -2.367 1.00 0.00 C ATOM 784 NZ LYS A 133 42.513 -17.736 -0.913 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.847 -16.944 -7.221 1.00 0.00 H new ATOM 0 HA LYS A 133 40.131 -17.054 -6.300 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.391 -17.216 -4.974 1.00 0.00 H new ATOM 0 HB3 LYS A 133 42.425 -15.467 -5.079 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.163 -15.345 -4.017 1.00 0.00 H new ATOM 0 HG3 LYS A 133 40.094 -17.095 -3.942 1.00 0.00 H new ATOM 0 HD2 LYS A 133 42.252 -15.393 -2.593 1.00 0.00 H new ATOM 0 HD3 LYS A 133 40.843 -16.034 -1.771 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.684 -18.373 -2.761 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.222 -17.545 -2.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.012 -18.635 -0.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 43.092 -16.952 -0.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 41.602 -17.754 -0.411 1.00 0.00 H new ATOM 798 N LYS A 134 41.413 -14.158 -7.213 1.00 0.00 N ATOM 799 CA LYS A 134 41.065 -12.793 -7.577 1.00 0.00 C ATOM 800 C LYS A 134 39.920 -12.784 -8.583 1.00 0.00 C ATOM 801 O LYS A 134 38.970 -12.013 -8.442 1.00 0.00 O ATOM 802 CB LYS A 134 42.286 -12.079 -8.172 1.00 0.00 C ATOM 803 CG LYS A 134 42.950 -12.974 -9.224 1.00 0.00 C ATOM 804 CD LYS A 134 44.192 -12.285 -9.779 1.00 0.00 C ATOM 805 CE LYS A 134 44.857 -13.201 -10.808 1.00 0.00 C ATOM 806 NZ LYS A 134 46.070 -12.529 -11.353 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.399 -14.392 -7.332 1.00 0.00 H new ATOM 0 HA LYS A 134 40.745 -12.267 -6.678 1.00 0.00 H new ATOM 0 HB2 LYS A 134 41.982 -11.135 -8.624 1.00 0.00 H new ATOM 0 HB3 LYS A 134 42.999 -11.839 -7.383 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.222 -13.932 -8.780 1.00 0.00 H new ATOM 0 HG3 LYS A 134 42.248 -13.184 -10.031 1.00 0.00 H new ATOM 0 HD2 LYS A 134 43.920 -11.336 -10.241 1.00 0.00 H new ATOM 0 HD3 LYS A 134 44.889 -12.059 -8.972 1.00 0.00 H new ATOM 0 HE2 LYS A 134 45.129 -14.150 -10.345 1.00 0.00 H new ATOM 0 HE3 LYS A 134 44.160 -13.428 -11.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 46.525 -13.149 -12.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 45.797 -11.635 -11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 46.736 -12.334 -10.579 1.00 0.00 H new ATOM 820 N LEU A 135 40.019 -13.628 -9.600 1.00 0.00 N ATOM 821 CA LEU A 135 38.997 -13.701 -10.617 1.00 0.00 C ATOM 822 C LEU A 135 37.682 -14.206 -10.034 1.00 0.00 C ATOM 823 O LEU A 135 36.607 -13.731 -10.399 1.00 0.00 O ATOM 824 CB LEU A 135 39.453 -14.647 -11.739 1.00 0.00 C ATOM 825 CG LEU A 135 38.754 -14.268 -13.059 1.00 0.00 C ATOM 826 CD1 LEU A 135 39.530 -13.124 -13.741 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.699 -15.487 -13.989 1.00 0.00 C ATOM 0 H LEU A 135 40.800 -14.270 -9.737 1.00 0.00 H new ATOM 0 HA LEU A 135 38.838 -12.699 -11.016 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.535 -14.588 -11.860 1.00 0.00 H new ATOM 0 HB3 LEU A 135 39.218 -15.678 -11.476 1.00 0.00 H new ATOM 0 HG LEU A 135 37.737 -13.939 -12.847 1.00 0.00 H new ATOM 0 HD11 LEU A 135 39.036 -12.855 -14.675 1.00 0.00 H new ATOM 0 HD12 LEU A 135 39.554 -12.257 -13.081 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.549 -13.450 -13.950 1.00 0.00 H new ATOM 0 HD21 LEU A 135 38.204 -15.212 -14.920 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.712 -15.827 -14.204 1.00 0.00 H new ATOM 0 HD23 LEU A 135 38.142 -16.289 -13.505 1.00 0.00 H new ATOM 839 N ALA A 136 37.779 -15.179 -9.136 1.00 0.00 N ATOM 840 CA ALA A 136 36.590 -15.752 -8.521 1.00 0.00 C ATOM 841 C ALA A 136 35.772 -14.674 -7.820 1.00 0.00 C ATOM 842 O ALA A 136 34.572 -14.545 -8.056 1.00 0.00 O ATOM 843 CB ALA A 136 36.992 -16.823 -7.506 1.00 0.00 C ATOM 0 H ALA A 136 38.660 -15.584 -8.820 1.00 0.00 H new ATOM 0 HA ALA A 136 35.982 -16.201 -9.307 1.00 0.00 H new ATOM 0 HB1 ALA A 136 36.097 -17.247 -7.050 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.550 -17.611 -8.011 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.616 -16.375 -6.732 1.00 0.00 H new ATOM 849 N GLU A 137 36.426 -13.902 -6.960 1.00 0.00 N ATOM 850 CA GLU A 137 35.744 -12.842 -6.228 1.00 0.00 C ATOM 851 C GLU A 137 35.094 -11.857 -7.192 1.00 0.00 C ATOM 852 O GLU A 137 33.973 -11.399 -6.967 1.00 0.00 O ATOM 853 CB GLU A 137 36.745 -12.103 -5.341 1.00 0.00 C ATOM 854 CG GLU A 137 37.233 -13.032 -4.224 1.00 0.00 C ATOM 855 CD GLU A 137 36.103 -13.299 -3.237 1.00 0.00 C ATOM 856 OE1 GLU A 137 35.516 -12.340 -2.766 1.00 0.00 O ATOM 857 OE2 GLU A 137 35.842 -14.459 -2.964 1.00 0.00 O1- ATOM 0 H GLU A 137 37.421 -13.989 -6.753 1.00 0.00 H new ATOM 0 HA GLU A 137 34.967 -13.291 -5.610 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.591 -11.761 -5.938 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.279 -11.216 -4.911 1.00 0.00 H new ATOM 0 HG2 GLU A 137 37.585 -13.972 -4.649 1.00 0.00 H new ATOM 0 HG3 GLU A 137 38.079 -12.579 -3.707 1.00 0.00 H new ATOM 864 N MET A 138 35.804 -11.527 -8.262 1.00 0.00 N ATOM 865 CA MET A 138 35.287 -10.591 -9.250 1.00 0.00 C ATOM 866 C MET A 138 34.043 -11.158 -9.926 1.00 0.00 C ATOM 867 O MET A 138 33.076 -10.435 -10.165 1.00 0.00 O ATOM 868 CB MET A 138 36.356 -10.303 -10.306 1.00 0.00 C ATOM 869 CG MET A 138 37.430 -9.391 -9.710 1.00 0.00 C ATOM 870 SD MET A 138 38.775 -9.183 -10.904 1.00 0.00 S ATOM 871 CE MET A 138 37.853 -8.232 -12.137 1.00 0.00 C ATOM 0 H MET A 138 36.734 -11.891 -8.467 1.00 0.00 H new ATOM 0 HA MET A 138 35.020 -9.665 -8.740 1.00 0.00 H new ATOM 0 HB2 MET A 138 36.805 -11.236 -10.648 1.00 0.00 H new ATOM 0 HB3 MET A 138 35.903 -9.829 -11.177 1.00 0.00 H new ATOM 0 HG2 MET A 138 37.000 -8.422 -9.458 1.00 0.00 H new ATOM 0 HG3 MET A 138 37.814 -9.820 -8.784 1.00 0.00 H new ATOM 0 HE1 MET A 138 38.458 -7.390 -12.474 1.00 0.00 H new ATOM 0 HE2 MET A 138 37.616 -8.872 -12.987 1.00 0.00 H new ATOM 0 HE3 MET A 138 36.929 -7.861 -11.694 1.00 0.00 H new ATOM 881 N SER A 139 34.075 -12.451 -10.243 1.00 0.00 N ATOM 882 CA SER A 139 32.943 -13.097 -10.899 1.00 0.00 C ATOM 883 C SER A 139 31.722 -13.088 -9.996 1.00 0.00 C ATOM 884 O SER A 139 30.603 -12.892 -10.463 1.00 0.00 O ATOM 885 CB SER A 139 33.312 -14.541 -11.253 1.00 0.00 C ATOM 886 OG SER A 139 34.542 -14.518 -11.959 1.00 0.00 O ATOM 0 H SER A 139 34.867 -13.067 -10.057 1.00 0.00 H new ATOM 0 HA SER A 139 32.705 -12.545 -11.808 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.402 -15.144 -10.349 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.531 -14.996 -11.863 1.00 0.00 H new ATOM 0 HG SER A 139 34.400 -14.138 -12.851 1.00 0.00 H new ATOM 892 N ALA A 140 31.942 -13.308 -8.701 1.00 0.00 N ATOM 893 CA ALA A 140 30.842 -13.324 -7.742 1.00 0.00 C ATOM 894 C ALA A 140 30.202 -11.944 -7.628 1.00 0.00 C ATOM 895 O ALA A 140 28.978 -11.815 -7.610 1.00 0.00 O ATOM 896 CB ALA A 140 31.357 -13.769 -6.372 1.00 0.00 C ATOM 0 H ALA A 140 32.863 -13.476 -8.296 1.00 0.00 H new ATOM 0 HA ALA A 140 30.087 -14.027 -8.094 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.532 -13.779 -5.659 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.782 -14.770 -6.450 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.124 -13.075 -6.029 1.00 0.00 H new ATOM 902 N ALA A 141 31.037 -10.919 -7.547 1.00 0.00 N ATOM 903 CA ALA A 141 30.542 -9.554 -7.435 1.00 0.00 C ATOM 904 C ALA A 141 29.936 -9.094 -8.756 1.00 0.00 C ATOM 905 O ALA A 141 29.083 -8.207 -8.784 1.00 0.00 O ATOM 906 CB ALA A 141 31.683 -8.613 -7.042 1.00 0.00 C ATOM 0 H ALA A 141 32.053 -11.004 -7.557 1.00 0.00 H new ATOM 0 HA ALA A 141 29.771 -9.531 -6.665 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.303 -7.595 -6.961 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.097 -8.924 -6.083 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.463 -8.650 -7.802 1.00 0.00 H new ATOM 912 N LYS A 142 30.381 -9.705 -9.849 1.00 0.00 N ATOM 913 CA LYS A 142 29.873 -9.355 -11.171 1.00 0.00 C ATOM 914 C LYS A 142 28.436 -9.840 -11.357 1.00 0.00 C ATOM 915 O LYS A 142 27.568 -9.090 -11.806 1.00 0.00 O ATOM 916 CB LYS A 142 30.763 -9.972 -12.245 1.00 0.00 C ATOM 917 CG LYS A 142 30.318 -9.476 -13.627 1.00 0.00 C ATOM 918 CD LYS A 142 31.188 -10.118 -14.712 1.00 0.00 C ATOM 919 CE LYS A 142 32.578 -9.470 -14.737 1.00 0.00 C ATOM 920 NZ LYS A 142 33.275 -9.844 -15.995 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.088 -10.440 -9.847 1.00 0.00 H new ATOM 0 HA LYS A 142 29.883 -8.269 -11.262 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.804 -9.702 -12.068 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.703 -11.059 -12.201 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.270 -9.725 -13.793 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.399 -8.390 -13.678 1.00 0.00 H new ATOM 0 HD2 LYS A 142 31.282 -11.188 -14.526 1.00 0.00 H new ATOM 0 HD3 LYS A 142 30.710 -10.005 -15.685 1.00 0.00 H new ATOM 0 HE2 LYS A 142 32.487 -8.386 -14.667 1.00 0.00 H new ATOM 0 HE3 LYS A 142 33.159 -9.797 -13.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 34.218 -9.405 -16.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 33.373 -10.878 -16.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 32.722 -9.511 -16.810 1.00 0.00 H new ATOM 934 N VAL A 143 28.203 -11.103 -11.019 1.00 0.00 N ATOM 935 CA VAL A 143 26.877 -11.690 -11.156 1.00 0.00 C ATOM 936 C VAL A 143 25.916 -11.099 -10.134 1.00 0.00 C ATOM 937 O VAL A 143 24.742 -10.877 -10.432 1.00 0.00 O ATOM 938 CB VAL A 143 26.947 -13.208 -10.984 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.537 -13.538 -9.617 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.539 -13.798 -11.087 1.00 0.00 C ATOM 0 H VAL A 143 28.912 -11.737 -10.650 1.00 0.00 H new ATOM 0 HA VAL A 143 26.507 -11.461 -12.155 1.00 0.00 H new ATOM 0 HB VAL A 143 27.578 -13.633 -11.765 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.587 -14.620 -9.494 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.540 -13.117 -9.542 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.906 -13.113 -8.836 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.588 -14.880 -10.965 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.908 -13.373 -10.306 1.00 0.00 H new ATOM 0 HG23 VAL A 143 25.116 -13.562 -12.064 1.00 0.00 H new ATOM 950 N ALA A 144 26.415 -10.848 -8.926 1.00 0.00 N ATOM 951 CA ALA A 144 25.588 -10.288 -7.869 1.00 0.00 C ATOM 952 C ALA A 144 25.107 -8.892 -8.241 1.00 0.00 C ATOM 953 O ALA A 144 23.929 -8.575 -8.104 1.00 0.00 O ATOM 954 CB ALA A 144 26.391 -10.223 -6.570 1.00 0.00 C ATOM 0 H ALA A 144 27.384 -11.024 -8.659 1.00 0.00 H new ATOM 0 HA ALA A 144 24.718 -10.930 -7.733 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.770 -9.803 -5.779 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.708 -11.227 -6.288 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.268 -9.593 -6.716 1.00 0.00 H new ATOM 960 N PHE A 145 26.029 -8.064 -8.717 1.00 0.00 N ATOM 961 CA PHE A 145 25.693 -6.701 -9.110 1.00 0.00 C ATOM 962 C PHE A 145 24.663 -6.700 -10.223 1.00 0.00 C ATOM 963 O PHE A 145 23.720 -5.915 -10.192 1.00 0.00 O ATOM 964 CB PHE A 145 26.947 -5.959 -9.572 1.00 0.00 C ATOM 965 CG PHE A 145 26.591 -4.534 -9.924 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.199 -4.214 -11.229 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.650 -3.531 -8.945 1.00 0.00 C ATOM 968 CE1 PHE A 145 25.867 -2.895 -11.558 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.318 -2.213 -9.276 1.00 0.00 C ATOM 970 CZ PHE A 145 25.926 -1.895 -10.581 1.00 0.00 C ATOM 0 H PHE A 145 27.011 -8.311 -8.840 1.00 0.00 H new ATOM 0 HA PHE A 145 25.272 -6.193 -8.242 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.701 -5.972 -8.785 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.381 -6.461 -10.437 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.153 -4.986 -11.983 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.951 -3.776 -7.937 1.00 0.00 H new ATOM 0 HE1 PHE A 145 25.565 -2.649 -12.565 1.00 0.00 H new ATOM 0 HE2 PHE A 145 26.364 -1.440 -8.523 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.669 -0.877 -10.834 1.00 0.00 H new ATOM 980 N MET A 146 24.852 -7.574 -11.203 1.00 0.00 N ATOM 981 CA MET A 146 23.933 -7.653 -12.329 1.00 0.00 C ATOM 982 C MET A 146 22.524 -7.994 -11.863 1.00 0.00 C ATOM 983 O MET A 146 21.543 -7.468 -12.388 1.00 0.00 O ATOM 984 CB MET A 146 24.411 -8.722 -13.315 1.00 0.00 C ATOM 985 CG MET A 146 23.481 -8.752 -14.531 1.00 0.00 C ATOM 986 SD MET A 146 24.128 -9.917 -15.757 1.00 0.00 S ATOM 987 CE MET A 146 23.879 -11.432 -14.799 1.00 0.00 C ATOM 0 H MET A 146 25.629 -8.234 -11.241 1.00 0.00 H new ATOM 0 HA MET A 146 23.912 -6.679 -12.818 1.00 0.00 H new ATOM 0 HB2 MET A 146 25.432 -8.509 -13.631 1.00 0.00 H new ATOM 0 HB3 MET A 146 24.424 -9.698 -12.830 1.00 0.00 H new ATOM 0 HG2 MET A 146 22.477 -9.048 -14.227 1.00 0.00 H new ATOM 0 HG3 MET A 146 23.402 -7.756 -14.966 1.00 0.00 H new ATOM 0 HE1 MET A 146 23.820 -12.285 -15.475 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.715 -11.570 -14.113 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.952 -11.355 -14.230 1.00 0.00 H new ATOM 997 N SER A 147 22.427 -8.875 -10.876 1.00 0.00 N ATOM 998 CA SER A 147 21.127 -9.273 -10.347 1.00 0.00 C ATOM 999 C SER A 147 20.500 -8.151 -9.524 1.00 0.00 C ATOM 1000 O SER A 147 19.302 -7.885 -9.629 1.00 0.00 O ATOM 1001 CB SER A 147 21.278 -10.514 -9.480 1.00 0.00 C ATOM 1002 OG SER A 147 21.851 -11.558 -10.255 1.00 0.00 O ATOM 0 H SER A 147 23.225 -9.325 -10.428 1.00 0.00 H new ATOM 0 HA SER A 147 20.472 -9.490 -11.191 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.909 -10.296 -8.619 1.00 0.00 H new ATOM 0 HB3 SER A 147 20.307 -10.823 -9.094 1.00 0.00 H new ATOM 0 HG SER A 147 22.809 -11.390 -10.372 1.00 0.00 H new ATOM 1008 N ILE A 148 21.314 -7.500 -8.702 1.00 0.00 N ATOM 1009 CA ILE A 148 20.825 -6.412 -7.860 1.00 0.00 C ATOM 1010 C ILE A 148 20.135 -5.349 -8.704 1.00 0.00 C ATOM 1011 O ILE A 148 19.280 -4.613 -8.210 1.00 0.00 O ATOM 1012 CB ILE A 148 21.990 -5.786 -7.080 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.453 -6.755 -5.988 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.542 -4.470 -6.434 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.787 -6.277 -5.410 1.00 0.00 C ATOM 0 H ILE A 148 22.308 -7.703 -8.600 1.00 0.00 H new ATOM 0 HA ILE A 148 20.100 -6.820 -7.155 1.00 0.00 H new ATOM 0 HB ILE A 148 22.812 -5.586 -7.768 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.704 -6.814 -5.199 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.562 -7.758 -6.400 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.375 -4.033 -5.883 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.216 -3.776 -7.209 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.716 -4.663 -5.750 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.115 -6.967 -4.633 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.535 -6.240 -6.202 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.663 -5.282 -4.982 1.00 0.00 H new ATOM 1027 N LYS A 149 20.511 -5.269 -9.966 1.00 0.00 N ATOM 1028 CA LYS A 149 19.917 -4.279 -10.855 1.00 0.00 C ATOM 1029 C LYS A 149 18.409 -4.478 -10.946 1.00 0.00 C ATOM 1030 O LYS A 149 17.646 -3.512 -10.943 1.00 0.00 O ATOM 1031 CB LYS A 149 20.522 -4.393 -12.254 1.00 0.00 C ATOM 1032 CG LYS A 149 22.008 -4.007 -12.219 1.00 0.00 C ATOM 1033 CD LYS A 149 22.484 -3.642 -13.624 1.00 0.00 C ATOM 1034 CE LYS A 149 22.113 -4.757 -14.605 1.00 0.00 C ATOM 1035 NZ LYS A 149 22.934 -4.624 -15.838 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.215 -5.867 -10.398 1.00 0.00 H new ATOM 0 HA LYS A 149 20.125 -3.290 -10.447 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.412 -5.412 -12.625 1.00 0.00 H new ATOM 0 HB3 LYS A 149 19.985 -3.743 -12.945 1.00 0.00 H new ATOM 0 HG2 LYS A 149 22.158 -3.164 -11.544 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.599 -4.836 -11.829 1.00 0.00 H new ATOM 0 HD2 LYS A 149 22.030 -2.703 -13.939 1.00 0.00 H new ATOM 0 HD3 LYS A 149 23.563 -3.490 -13.624 1.00 0.00 H new ATOM 0 HE2 LYS A 149 22.282 -5.731 -14.146 1.00 0.00 H new ATOM 0 HE3 LYS A 149 21.053 -4.701 -14.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 22.683 -5.381 -16.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 22.752 -3.700 -16.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.942 -4.698 -15.594 1.00 0.00 H new