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 Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 161:sc= -0.0427 (180deg=-0.497) USER MOD Single : A 85 ASN : amide:sc= -0.0117 K(o=-0.012,f=-1.4!) 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=-0.32) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.53 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 44:sc= 0.223 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) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -100:sc= -0.677 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 163:sc= -0.0253 (180deg=-0.409) USER MOD Single : A 126 SER OG : rot -14:sc= 0.439! USER MOD Single : A 131 LYS NZ :NH3+ -134:sc= -0.0932 (180deg=-0.696) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 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 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 81:sc= -0.108 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -146:sc= -0.173 (180deg=-0.901) USER MOD Single : A 147 SER OG : rot -152:sc= 0.382 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 16 N ALA A 82 35.529 -0.485 -6.719 1.00 0.00 N ATOM 17 CA ALA A 82 35.265 -1.784 -6.129 1.00 0.00 C ATOM 18 C ALA A 82 33.794 -1.905 -5.753 1.00 0.00 C ATOM 19 O ALA A 82 33.378 -1.481 -4.679 1.00 0.00 O ATOM 20 CB ALA A 82 36.130 -1.972 -4.882 1.00 0.00 C ATOM 0 HA ALA A 82 35.508 -2.556 -6.859 1.00 0.00 H new ATOM 0 HB1 ALA A 82 35.928 -2.949 -4.443 1.00 0.00 H new ATOM 0 HB2 ALA A 82 37.183 -1.908 -5.157 1.00 0.00 H new ATOM 0 HB3 ALA A 82 35.897 -1.193 -4.156 1.00 0.00 H new ATOM 26 N TYR A 83 33.016 -2.500 -6.640 1.00 0.00 N ATOM 27 CA TYR A 83 31.587 -2.685 -6.399 1.00 0.00 C ATOM 28 C TYR A 83 31.356 -3.217 -4.988 1.00 0.00 C ATOM 29 O TYR A 83 30.245 -3.165 -4.467 1.00 0.00 O ATOM 30 CB TYR A 83 31.000 -3.669 -7.420 1.00 0.00 C ATOM 31 CG TYR A 83 31.678 -3.473 -8.756 1.00 0.00 C ATOM 32 CD1 TYR A 83 31.804 -2.187 -9.299 1.00 0.00 C ATOM 33 CD2 TYR A 83 32.183 -4.579 -9.452 1.00 0.00 C ATOM 34 CE1 TYR A 83 32.434 -2.008 -10.534 1.00 0.00 C ATOM 35 CE2 TYR A 83 32.814 -4.398 -10.688 1.00 0.00 C ATOM 36 CZ TYR A 83 32.938 -3.114 -11.230 1.00 0.00 C ATOM 37 OH TYR A 83 33.559 -2.937 -12.449 1.00 0.00 O ATOM 0 H TYR A 83 33.345 -2.865 -7.534 1.00 0.00 H new ATOM 0 HA TYR A 83 31.091 -1.720 -6.505 1.00 0.00 H new ATOM 0 HB2 TYR A 83 31.140 -4.694 -7.076 1.00 0.00 H new ATOM 0 HB3 TYR A 83 29.926 -3.510 -7.518 1.00 0.00 H new ATOM 0 HD1 TYR A 83 31.414 -1.334 -8.763 1.00 0.00 H new ATOM 0 HD2 TYR A 83 32.085 -5.570 -9.035 1.00 0.00 H new ATOM 0 HE1 TYR A 83 32.532 -1.017 -10.951 1.00 0.00 H new ATOM 0 HE2 TYR A 83 33.206 -5.250 -11.224 1.00 0.00 H new ATOM 0 HH TYR A 83 33.851 -3.806 -12.796 1.00 0.00 H new ATOM 47 N LYS A 84 32.420 -3.717 -4.375 1.00 0.00 N ATOM 48 CA LYS A 84 32.327 -4.247 -3.017 1.00 0.00 C ATOM 49 C LYS A 84 31.948 -3.135 -2.043 1.00 0.00 C ATOM 50 O LYS A 84 31.158 -3.343 -1.123 1.00 0.00 O ATOM 51 CB LYS A 84 33.664 -4.861 -2.600 1.00 0.00 C ATOM 52 CG LYS A 84 33.969 -6.065 -3.494 1.00 0.00 C ATOM 53 CD LYS A 84 35.277 -6.717 -3.041 1.00 0.00 C ATOM 54 CE LYS A 84 35.561 -7.944 -3.907 1.00 0.00 C ATOM 55 NZ LYS A 84 35.762 -7.519 -5.321 1.00 0.00 N1+ ATOM 0 H LYS A 84 33.351 -3.768 -4.790 1.00 0.00 H new ATOM 0 HA LYS A 84 31.557 -5.018 -2.996 1.00 0.00 H new ATOM 0 HB2 LYS A 84 34.459 -4.120 -2.684 1.00 0.00 H new ATOM 0 HB3 LYS A 84 33.625 -5.170 -1.555 1.00 0.00 H new ATOM 0 HG2 LYS A 84 33.153 -6.786 -3.442 1.00 0.00 H new ATOM 0 HG3 LYS A 84 34.049 -5.749 -4.534 1.00 0.00 H new ATOM 0 HD2 LYS A 84 36.098 -6.004 -3.121 1.00 0.00 H new ATOM 0 HD3 LYS A 84 35.207 -7.007 -1.993 1.00 0.00 H new ATOM 0 HE2 LYS A 84 36.448 -8.462 -3.542 1.00 0.00 H new ATOM 0 HE3 LYS A 84 34.731 -8.648 -3.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 36.260 -8.269 -5.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 34.838 -7.344 -5.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 36.328 -6.647 -5.344 1.00 0.00 H new ATOM 69 N ASN A 85 32.531 -1.956 -2.249 1.00 0.00 N ATOM 70 CA ASN A 85 32.252 -0.821 -1.371 1.00 0.00 C ATOM 71 C ASN A 85 30.800 -0.378 -1.505 1.00 0.00 C ATOM 72 O ASN A 85 30.100 -0.191 -0.509 1.00 0.00 O ATOM 73 CB ASN A 85 33.179 0.346 -1.714 1.00 0.00 C ATOM 74 CG ASN A 85 33.047 1.445 -0.667 1.00 0.00 C ATOM 75 OD1 ASN A 85 32.744 1.166 0.493 1.00 0.00 O ATOM 76 ND2 ASN A 85 33.254 2.686 -1.010 1.00 0.00 N ATOM 0 H ASN A 85 33.189 -1.762 -3.004 1.00 0.00 H new ATOM 0 HA ASN A 85 32.428 -1.134 -0.342 1.00 0.00 H new ATOM 0 HB2 ASN A 85 34.211 -0.001 -1.760 1.00 0.00 H new ATOM 0 HB3 ASN A 85 32.931 0.740 -2.699 1.00 0.00 H new ATOM 0 HD21 ASN A 85 33.165 3.428 -0.316 1.00 0.00 H new ATOM 0 HD22 ASN A 85 33.505 2.914 -1.972 1.00 0.00 H new ATOM 83 N LEU A 86 30.356 -0.210 -2.742 1.00 0.00 N ATOM 84 CA LEU A 86 28.992 0.221 -2.996 1.00 0.00 C ATOM 85 C LEU A 86 27.994 -0.784 -2.435 1.00 0.00 C ATOM 86 O LEU A 86 26.970 -0.406 -1.866 1.00 0.00 O ATOM 87 CB LEU A 86 28.769 0.382 -4.498 1.00 0.00 C ATOM 88 CG LEU A 86 27.360 0.960 -4.761 1.00 0.00 C ATOM 89 CD1 LEU A 86 27.432 2.007 -5.875 1.00 0.00 C ATOM 90 CD2 LEU A 86 26.412 -0.168 -5.183 1.00 0.00 C ATOM 0 H LEU A 86 30.917 -0.365 -3.580 1.00 0.00 H new ATOM 0 HA LEU A 86 28.837 1.179 -2.500 1.00 0.00 H new ATOM 0 HB2 LEU A 86 29.527 1.043 -4.918 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.875 -0.582 -4.996 1.00 0.00 H new ATOM 0 HG LEU A 86 26.987 1.426 -3.849 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.437 2.413 -6.058 1.00 0.00 H new ATOM 0 HD12 LEU A 86 28.102 2.812 -5.575 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.808 1.543 -6.787 1.00 0.00 H new ATOM 0 HD21 LEU A 86 25.419 0.241 -5.368 1.00 0.00 H new ATOM 0 HD22 LEU A 86 26.787 -0.637 -6.093 1.00 0.00 H new ATOM 0 HD23 LEU A 86 26.355 -0.912 -4.388 1.00 0.00 H new ATOM 102 N LEU A 87 28.296 -2.063 -2.606 1.00 0.00 N ATOM 103 CA LEU A 87 27.413 -3.116 -2.120 1.00 0.00 C ATOM 104 C LEU A 87 27.165 -2.950 -0.627 1.00 0.00 C ATOM 105 O LEU A 87 26.063 -3.205 -0.139 1.00 0.00 O ATOM 106 CB LEU A 87 28.043 -4.485 -2.389 1.00 0.00 C ATOM 107 CG LEU A 87 27.851 -4.858 -3.863 1.00 0.00 C ATOM 108 CD1 LEU A 87 28.776 -6.024 -4.221 1.00 0.00 C ATOM 109 CD2 LEU A 87 26.389 -5.267 -4.113 1.00 0.00 C ATOM 0 H LEU A 87 29.139 -2.396 -3.074 1.00 0.00 H new ATOM 0 HA LEU A 87 26.461 -3.046 -2.646 1.00 0.00 H new ATOM 0 HB2 LEU A 87 29.105 -4.462 -2.144 1.00 0.00 H new ATOM 0 HB3 LEU A 87 27.585 -5.240 -1.750 1.00 0.00 H new ATOM 0 HG LEU A 87 28.094 -3.996 -4.485 1.00 0.00 H new ATOM 0 HD11 LEU A 87 28.639 -6.289 -5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 87 29.812 -5.731 -4.053 1.00 0.00 H new ATOM 0 HD13 LEU A 87 28.536 -6.884 -3.595 1.00 0.00 H new ATOM 0 HD21 LEU A 87 26.259 -5.531 -5.163 1.00 0.00 H new ATOM 0 HD22 LEU A 87 26.140 -6.126 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU A 87 25.731 -4.435 -3.864 1.00 0.00 H new ATOM 121 N GLN A 88 28.192 -2.525 0.090 1.00 0.00 N ATOM 122 CA GLN A 88 28.070 -2.317 1.527 1.00 0.00 C ATOM 123 C GLN A 88 27.178 -1.113 1.821 1.00 0.00 C ATOM 124 O GLN A 88 26.438 -1.101 2.808 1.00 0.00 O ATOM 125 CB GLN A 88 29.451 -2.087 2.144 1.00 0.00 C ATOM 126 CG GLN A 88 30.265 -3.380 2.066 1.00 0.00 C ATOM 127 CD GLN A 88 31.657 -3.157 2.643 1.00 0.00 C ATOM 128 OE1 GLN A 88 31.967 -2.063 3.113 1.00 0.00 O ATOM 129 NE2 GLN A 88 32.518 -4.139 2.641 1.00 0.00 N ATOM 0 H GLN A 88 29.114 -2.318 -0.294 1.00 0.00 H new ATOM 0 HA GLN A 88 27.620 -3.208 1.964 1.00 0.00 H new ATOM 0 HB2 GLN A 88 29.969 -1.286 1.616 1.00 0.00 H new ATOM 0 HB3 GLN A 88 29.349 -1.770 3.182 1.00 0.00 H new ATOM 0 HG2 GLN A 88 29.757 -4.172 2.616 1.00 0.00 H new ATOM 0 HG3 GLN A 88 30.341 -3.709 1.030 1.00 0.00 H new ATOM 0 HE21 GLN A 88 32.258 -5.045 2.251 1.00 0.00 H new ATOM 0 HE22 GLN A 88 33.451 -4.000 3.030 1.00 0.00 H new ATOM 138 N GLU A 89 27.266 -0.091 0.969 1.00 0.00 N ATOM 139 CA GLU A 89 26.476 1.121 1.170 1.00 0.00 C ATOM 140 C GLU A 89 24.983 0.818 1.118 1.00 0.00 C ATOM 141 O GLU A 89 24.230 1.214 2.007 1.00 0.00 O ATOM 142 CB GLU A 89 26.826 2.148 0.089 1.00 0.00 C ATOM 143 CG GLU A 89 28.287 2.575 0.238 1.00 0.00 C ATOM 144 CD GLU A 89 28.466 3.384 1.518 1.00 0.00 C ATOM 145 OE1 GLU A 89 28.308 4.592 1.458 1.00 0.00 O1- ATOM 146 OE2 GLU A 89 28.764 2.784 2.539 1.00 0.00 O ATOM 0 H GLU A 89 27.867 -0.078 0.145 1.00 0.00 H new ATOM 0 HA GLU A 89 26.712 1.523 2.155 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.661 1.720 -0.900 1.00 0.00 H new ATOM 0 HB3 GLU A 89 26.173 3.016 0.174 1.00 0.00 H new ATOM 0 HG2 GLU A 89 28.931 1.696 0.261 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.590 3.170 -0.623 1.00 0.00 H new ATOM 153 N ILE A 90 24.566 0.107 0.079 1.00 0.00 N ATOM 154 CA ILE A 90 23.161 -0.247 -0.079 1.00 0.00 C ATOM 155 C ILE A 90 22.713 -1.178 1.040 1.00 0.00 C ATOM 156 O ILE A 90 21.569 -1.126 1.483 1.00 0.00 O ATOM 157 CB ILE A 90 22.939 -0.914 -1.436 1.00 0.00 C ATOM 158 CG1 ILE A 90 23.894 -2.100 -1.579 1.00 0.00 C ATOM 159 CG2 ILE A 90 23.203 0.092 -2.556 1.00 0.00 C ATOM 160 CD1 ILE A 90 23.615 -2.827 -2.896 1.00 0.00 C ATOM 0 H ILE A 90 25.176 -0.235 -0.663 1.00 0.00 H new ATOM 0 HA ILE A 90 22.566 0.665 -0.028 1.00 0.00 H new ATOM 0 HB ILE A 90 21.909 -1.263 -1.503 1.00 0.00 H new ATOM 0 HG12 ILE A 90 24.927 -1.753 -1.555 1.00 0.00 H new ATOM 0 HG13 ILE A 90 23.768 -2.785 -0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 90 23.043 -0.388 -3.521 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.522 0.937 -2.454 1.00 0.00 H new ATOM 0 HG23 ILE A 90 24.232 0.446 -2.492 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.296 -3.672 -2.997 1.00 0.00 H new ATOM 0 HD12 ILE A 90 22.586 -3.188 -2.902 1.00 0.00 H new ATOM 0 HD13 ILE A 90 23.763 -2.140 -3.729 1.00 0.00 H new ATOM 172 N ALA A 91 23.621 -2.041 1.483 1.00 0.00 N ATOM 173 CA ALA A 91 23.303 -2.991 2.541 1.00 0.00 C ATOM 174 C ALA A 91 22.763 -2.264 3.768 1.00 0.00 C ATOM 175 O ALA A 91 21.713 -2.624 4.301 1.00 0.00 O ATOM 176 CB ALA A 91 24.557 -3.776 2.929 1.00 0.00 C ATOM 0 H ALA A 91 24.576 -2.102 1.129 1.00 0.00 H new ATOM 0 HA ALA A 91 22.541 -3.677 2.171 1.00 0.00 H new ATOM 0 HB1 ALA A 91 24.312 -4.484 3.720 1.00 0.00 H new ATOM 0 HB2 ALA A 91 24.931 -4.318 2.060 1.00 0.00 H new ATOM 0 HB3 ALA A 91 25.323 -3.086 3.284 1.00 0.00 H new ATOM 182 N GLN A 92 23.485 -1.241 4.209 1.00 0.00 N ATOM 183 CA GLN A 92 23.067 -0.473 5.375 1.00 0.00 C ATOM 184 C GLN A 92 21.764 0.268 5.098 1.00 0.00 C ATOM 185 O GLN A 92 20.872 0.314 5.946 1.00 0.00 O ATOM 186 CB GLN A 92 24.157 0.533 5.754 1.00 0.00 C ATOM 187 CG GLN A 92 25.403 -0.215 6.232 1.00 0.00 C ATOM 188 CD GLN A 92 26.503 0.779 6.591 1.00 0.00 C ATOM 189 OE1 GLN A 92 26.242 1.780 7.258 1.00 0.00 O ATOM 190 NE2 GLN A 92 27.724 0.558 6.189 1.00 0.00 N ATOM 0 H GLN A 92 24.356 -0.926 3.781 1.00 0.00 H new ATOM 0 HA GLN A 92 22.905 -1.166 6.201 1.00 0.00 H new ATOM 0 HB2 GLN A 92 24.403 1.158 4.896 1.00 0.00 H new ATOM 0 HB3 GLN A 92 23.796 1.197 6.539 1.00 0.00 H new ATOM 0 HG2 GLN A 92 25.159 -0.828 7.099 1.00 0.00 H new ATOM 0 HG3 GLN A 92 25.753 -0.891 5.452 1.00 0.00 H new ATOM 0 HE21 GLN A 92 27.937 -0.273 5.636 1.00 0.00 H new ATOM 0 HE22 GLN A 92 28.466 1.216 6.427 1.00 0.00 H new ATOM 199 N LYS A 93 21.662 0.852 3.908 1.00 0.00 N ATOM 200 CA LYS A 93 20.462 1.598 3.540 1.00 0.00 C ATOM 201 C LYS A 93 19.243 0.686 3.546 1.00 0.00 C ATOM 202 O LYS A 93 18.203 1.034 4.101 1.00 0.00 O ATOM 203 CB LYS A 93 20.648 2.205 2.146 1.00 0.00 C ATOM 204 CG LYS A 93 21.839 3.171 2.152 1.00 0.00 C ATOM 205 CD LYS A 93 21.407 4.528 2.716 1.00 0.00 C ATOM 206 CE LYS A 93 22.581 5.502 2.659 1.00 0.00 C ATOM 207 NZ LYS A 93 22.156 6.820 3.210 1.00 0.00 N1+ ATOM 0 H LYS A 93 22.386 0.825 3.190 1.00 0.00 H new ATOM 0 HA LYS A 93 20.303 2.393 4.269 1.00 0.00 H new ATOM 0 HB2 LYS A 93 20.814 1.414 1.415 1.00 0.00 H new ATOM 0 HB3 LYS A 93 19.742 2.732 1.846 1.00 0.00 H new ATOM 0 HG2 LYS A 93 22.650 2.759 2.753 1.00 0.00 H new ATOM 0 HG3 LYS A 93 22.224 3.294 1.140 1.00 0.00 H new ATOM 0 HD2 LYS A 93 20.567 4.921 2.143 1.00 0.00 H new ATOM 0 HD3 LYS A 93 21.065 4.414 3.745 1.00 0.00 H new ATOM 0 HE2 LYS A 93 23.422 5.110 3.231 1.00 0.00 H new ATOM 0 HE3 LYS A 93 22.922 5.618 1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 22.954 7.486 3.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 21.366 7.194 2.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 21.850 6.701 4.197 1.00 0.00 H new ATOM 221 N GLU A 94 19.379 -0.478 2.922 1.00 0.00 N ATOM 222 CA GLU A 94 18.280 -1.434 2.863 1.00 0.00 C ATOM 223 C GLU A 94 17.996 -2.004 4.248 1.00 0.00 C ATOM 224 O GLU A 94 16.912 -2.529 4.501 1.00 0.00 O ATOM 225 CB GLU A 94 18.628 -2.571 1.901 1.00 0.00 C ATOM 226 CG GLU A 94 18.735 -2.023 0.477 1.00 0.00 C ATOM 227 CD GLU A 94 17.369 -1.553 -0.008 1.00 0.00 C ATOM 228 OE1 GLU A 94 16.379 -2.010 0.540 1.00 0.00 O ATOM 229 OE2 GLU A 94 17.330 -0.740 -0.917 1.00 0.00 O1- ATOM 0 H GLU A 94 20.233 -0.781 2.453 1.00 0.00 H new ATOM 0 HA GLU A 94 17.390 -0.917 2.505 1.00 0.00 H new ATOM 0 HB2 GLU A 94 19.570 -3.034 2.195 1.00 0.00 H new ATOM 0 HB3 GLU A 94 17.863 -3.346 1.947 1.00 0.00 H new ATOM 0 HG2 GLU A 94 19.444 -1.195 0.450 1.00 0.00 H new ATOM 0 HG3 GLU A 94 19.120 -2.794 -0.190 1.00 0.00 H new ATOM 236 N SER A 95 18.977 -1.900 5.139 1.00 0.00 N ATOM 237 CA SER A 95 18.821 -2.413 6.495 1.00 0.00 C ATOM 238 C SER A 95 18.863 -3.939 6.500 1.00 0.00 C ATOM 239 O SER A 95 18.399 -4.579 7.444 1.00 0.00 O ATOM 240 CB SER A 95 17.491 -1.932 7.086 1.00 0.00 C ATOM 241 OG SER A 95 17.620 -1.821 8.497 1.00 0.00 O ATOM 0 H SER A 95 19.881 -1.469 4.949 1.00 0.00 H new ATOM 0 HA SER A 95 19.644 -2.038 7.103 1.00 0.00 H new ATOM 0 HB2 SER A 95 17.216 -0.968 6.657 1.00 0.00 H new ATOM 0 HB3 SER A 95 16.694 -2.632 6.836 1.00 0.00 H new ATOM 0 HG SER A 95 16.772 -1.512 8.880 1.00 0.00 H new ATOM 247 N SER A 96 19.417 -4.514 5.438 1.00 0.00 N ATOM 248 CA SER A 96 19.512 -5.965 5.329 1.00 0.00 C ATOM 249 C SER A 96 20.697 -6.478 6.138 1.00 0.00 C ATOM 250 O SER A 96 20.742 -6.327 7.359 1.00 0.00 O ATOM 251 CB SER A 96 19.674 -6.369 3.866 1.00 0.00 C ATOM 252 OG SER A 96 18.493 -6.032 3.151 1.00 0.00 O ATOM 0 H SER A 96 19.805 -4.002 4.646 1.00 0.00 H new ATOM 0 HA SER A 96 18.596 -6.405 5.724 1.00 0.00 H new ATOM 0 HB2 SER A 96 20.534 -5.861 3.430 1.00 0.00 H new ATOM 0 HB3 SER A 96 19.865 -7.440 3.792 1.00 0.00 H new ATOM 0 HG SER A 96 18.595 -6.289 2.211 1.00 0.00 H new ATOM 258 N LEU A 97 21.659 -7.085 5.450 1.00 0.00 N ATOM 259 CA LEU A 97 22.845 -7.612 6.110 1.00 0.00 C ATOM 260 C LEU A 97 24.079 -7.417 5.235 1.00 0.00 C ATOM 261 O LEU A 97 24.105 -7.846 4.081 1.00 0.00 O ATOM 262 CB LEU A 97 22.657 -9.101 6.414 1.00 0.00 C ATOM 263 CG LEU A 97 23.953 -9.678 6.996 1.00 0.00 C ATOM 264 CD1 LEU A 97 24.370 -8.870 8.230 1.00 0.00 C ATOM 265 CD2 LEU A 97 23.725 -11.137 7.394 1.00 0.00 C ATOM 0 H LEU A 97 21.640 -7.223 4.440 1.00 0.00 H new ATOM 0 HA LEU A 97 22.990 -7.068 7.044 1.00 0.00 H new ATOM 0 HB2 LEU A 97 21.838 -9.237 7.120 1.00 0.00 H new ATOM 0 HB3 LEU A 97 22.386 -9.636 5.504 1.00 0.00 H new ATOM 0 HG LEU A 97 24.742 -9.623 6.246 1.00 0.00 H new ATOM 0 HD11 LEU A 97 25.291 -9.283 8.641 1.00 0.00 H new ATOM 0 HD12 LEU A 97 24.533 -7.830 7.946 1.00 0.00 H new ATOM 0 HD13 LEU A 97 23.582 -8.921 8.982 1.00 0.00 H new ATOM 0 HD21 LEU A 97 24.645 -11.549 7.808 1.00 0.00 H new ATOM 0 HD22 LEU A 97 22.934 -11.191 8.142 1.00 0.00 H new ATOM 0 HD23 LEU A 97 23.433 -11.712 6.516 1.00 0.00 H new ATOM 277 N LEU A 98 25.100 -6.774 5.792 1.00 0.00 N ATOM 278 CA LEU A 98 26.325 -6.527 5.053 1.00 0.00 C ATOM 279 C LEU A 98 26.760 -7.778 4.284 1.00 0.00 C ATOM 280 O LEU A 98 26.612 -8.898 4.777 1.00 0.00 O ATOM 281 CB LEU A 98 27.446 -6.102 6.007 1.00 0.00 C ATOM 282 CG LEU A 98 27.247 -4.639 6.411 1.00 0.00 C ATOM 283 CD1 LEU A 98 25.929 -4.495 7.178 1.00 0.00 C ATOM 284 CD2 LEU A 98 28.408 -4.194 7.299 1.00 0.00 C ATOM 0 H LEU A 98 25.101 -6.418 6.748 1.00 0.00 H new ATOM 0 HA LEU A 98 26.131 -5.725 4.341 1.00 0.00 H new ATOM 0 HB2 LEU A 98 27.445 -6.738 6.892 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.415 -6.228 5.525 1.00 0.00 H new ATOM 0 HG LEU A 98 27.215 -4.016 5.517 1.00 0.00 H new ATOM 0 HD11 LEU A 98 25.787 -3.453 7.466 1.00 0.00 H new ATOM 0 HD12 LEU A 98 25.102 -4.812 6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.959 -5.118 8.072 1.00 0.00 H new ATOM 0 HD21 LEU A 98 28.267 -3.152 7.587 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.442 -4.816 8.193 1.00 0.00 H new ATOM 0 HD23 LEU A 98 29.345 -4.295 6.751 1.00 0.00 H new ATOM 296 N PRO A 99 27.288 -7.605 3.097 1.00 0.00 N ATOM 297 CA PRO A 99 27.746 -8.744 2.249 1.00 0.00 C ATOM 298 C PRO A 99 28.986 -9.419 2.821 1.00 0.00 C ATOM 299 O PRO A 99 29.849 -8.757 3.399 1.00 0.00 O ATOM 300 CB PRO A 99 28.046 -8.095 0.890 1.00 0.00 C ATOM 301 CG PRO A 99 28.324 -6.655 1.188 1.00 0.00 C ATOM 302 CD PRO A 99 27.513 -6.310 2.436 1.00 0.00 C ATOM 0 HA PRO A 99 26.998 -9.535 2.186 1.00 0.00 H new ATOM 0 HB2 PRO A 99 28.902 -8.569 0.409 1.00 0.00 H new ATOM 0 HB3 PRO A 99 27.200 -8.199 0.210 1.00 0.00 H new ATOM 0 HG2 PRO A 99 29.388 -6.492 1.359 1.00 0.00 H new ATOM 0 HG3 PRO A 99 28.035 -6.022 0.349 1.00 0.00 H new ATOM 0 HD2 PRO A 99 28.055 -5.622 3.085 1.00 0.00 H new ATOM 0 HD3 PRO A 99 26.571 -5.827 2.177 1.00 0.00 H new ATOM 310 N PHE A 100 29.080 -10.739 2.648 1.00 0.00 N ATOM 311 CA PHE A 100 30.226 -11.490 3.146 1.00 0.00 C ATOM 312 C PHE A 100 30.823 -12.315 2.017 1.00 0.00 C ATOM 313 O PHE A 100 30.116 -13.060 1.331 1.00 0.00 O ATOM 314 CB PHE A 100 29.798 -12.401 4.293 1.00 0.00 C ATOM 315 CG PHE A 100 30.987 -13.200 4.764 1.00 0.00 C ATOM 316 CD1 PHE A 100 31.965 -12.595 5.564 1.00 0.00 C ATOM 317 CD2 PHE A 100 31.114 -14.545 4.402 1.00 0.00 C ATOM 318 CE1 PHE A 100 33.068 -13.337 6.001 1.00 0.00 C ATOM 319 CE2 PHE A 100 32.218 -15.287 4.839 1.00 0.00 C ATOM 320 CZ PHE A 100 33.195 -14.683 5.638 1.00 0.00 C ATOM 0 H PHE A 100 28.379 -11.304 2.169 1.00 0.00 H new ATOM 0 HA PHE A 100 30.978 -10.793 3.517 1.00 0.00 H new ATOM 0 HB2 PHE A 100 29.396 -11.807 5.114 1.00 0.00 H new ATOM 0 HB3 PHE A 100 29.003 -13.070 3.964 1.00 0.00 H new ATOM 0 HD1 PHE A 100 31.868 -11.556 5.843 1.00 0.00 H new ATOM 0 HD2 PHE A 100 30.360 -15.011 3.785 1.00 0.00 H new ATOM 0 HE1 PHE A 100 33.822 -12.871 6.619 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.315 -16.326 4.559 1.00 0.00 H new ATOM 0 HZ PHE A 100 34.047 -15.255 5.975 1.00 0.00 H new ATOM 330 N TYR A 101 32.133 -12.188 1.828 1.00 0.00 N ATOM 331 CA TYR A 101 32.813 -12.923 0.770 1.00 0.00 C ATOM 332 C TYR A 101 33.435 -14.207 1.311 1.00 0.00 C ATOM 333 O TYR A 101 33.919 -14.246 2.443 1.00 0.00 O ATOM 334 CB TYR A 101 33.912 -12.049 0.154 1.00 0.00 C ATOM 335 CG TYR A 101 33.304 -10.766 -0.355 1.00 0.00 C ATOM 336 CD1 TYR A 101 32.657 -10.740 -1.595 1.00 0.00 C ATOM 337 CD2 TYR A 101 33.385 -9.598 0.417 1.00 0.00 C ATOM 338 CE1 TYR A 101 32.092 -9.548 -2.065 1.00 0.00 C ATOM 339 CE2 TYR A 101 32.819 -8.408 -0.053 1.00 0.00 C ATOM 340 CZ TYR A 101 32.173 -8.383 -1.294 1.00 0.00 C ATOM 341 OH TYR A 101 31.611 -7.209 -1.755 1.00 0.00 O ATOM 0 H TYR A 101 32.739 -11.589 2.388 1.00 0.00 H new ATOM 0 HA TYR A 101 32.077 -13.184 0.010 1.00 0.00 H new ATOM 0 HB2 TYR A 101 34.679 -11.831 0.898 1.00 0.00 H new ATOM 0 HB3 TYR A 101 34.401 -12.581 -0.662 1.00 0.00 H new ATOM 0 HD1 TYR A 101 32.593 -11.639 -2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 101 33.884 -9.617 1.374 1.00 0.00 H new ATOM 0 HE1 TYR A 101 31.594 -9.528 -3.023 1.00 0.00 H new ATOM 0 HE2 TYR A 101 32.881 -7.509 0.542 1.00 0.00 H new ATOM 0 HH TYR A 101 31.756 -6.497 -1.098 1.00 0.00 H new ATOM 351 N ALA A 102 33.423 -15.257 0.495 1.00 0.00 N ATOM 352 CA ALA A 102 33.989 -16.540 0.903 1.00 0.00 C ATOM 353 C ALA A 102 34.661 -17.223 -0.277 1.00 0.00 C ATOM 354 O ALA A 102 34.206 -17.108 -1.416 1.00 0.00 O ATOM 355 CB ALA A 102 32.885 -17.442 1.455 1.00 0.00 C ATOM 0 H ALA A 102 33.031 -15.246 -0.446 1.00 0.00 H new ATOM 0 HA ALA A 102 34.734 -16.360 1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 102 33.313 -18.398 1.758 1.00 0.00 H new ATOM 0 HB2 ALA A 102 32.421 -16.963 2.317 1.00 0.00 H new ATOM 0 HB3 ALA A 102 32.133 -17.609 0.684 1.00 0.00 H new ATOM 361 N THR A 103 35.751 -17.938 -0.002 1.00 0.00 N ATOM 362 CA THR A 103 36.485 -18.639 -1.053 1.00 0.00 C ATOM 363 C THR A 103 36.576 -20.125 -0.738 1.00 0.00 C ATOM 364 O THR A 103 37.002 -20.514 0.350 1.00 0.00 O ATOM 365 CB THR A 103 37.891 -18.056 -1.184 1.00 0.00 C ATOM 366 OG1 THR A 103 37.800 -16.682 -1.535 1.00 0.00 O ATOM 367 CG2 THR A 103 38.657 -18.812 -2.270 1.00 0.00 C ATOM 0 H THR A 103 36.143 -18.047 0.933 1.00 0.00 H new ATOM 0 HA THR A 103 35.950 -18.510 -1.994 1.00 0.00 H new ATOM 0 HB THR A 103 38.417 -18.155 -0.235 1.00 0.00 H new ATOM 0 HG1 THR A 103 38.701 -16.305 -1.618 1.00 0.00 H new ATOM 0 HG21 THR A 103 39.660 -18.396 -2.364 1.00 0.00 H new ATOM 0 HG22 THR A 103 38.725 -19.866 -2.001 1.00 0.00 H new ATOM 0 HG23 THR A 103 38.133 -18.713 -3.221 1.00 0.00 H new ATOM 375 N ALA A 104 36.178 -20.958 -1.697 1.00 0.00 N ATOM 376 CA ALA A 104 36.224 -22.406 -1.511 1.00 0.00 C ATOM 377 C ALA A 104 37.379 -23.001 -2.305 1.00 0.00 C ATOM 378 O ALA A 104 37.586 -22.655 -3.467 1.00 0.00 O ATOM 379 CB ALA A 104 34.909 -23.031 -1.973 1.00 0.00 C ATOM 0 H ALA A 104 35.822 -20.658 -2.605 1.00 0.00 H new ATOM 0 HA ALA A 104 36.373 -22.619 -0.452 1.00 0.00 H new ATOM 0 HB1 ALA A 104 34.950 -24.111 -1.832 1.00 0.00 H new ATOM 0 HB2 ALA A 104 34.086 -22.620 -1.389 1.00 0.00 H new ATOM 0 HB3 ALA A 104 34.752 -22.809 -3.028 1.00 0.00 H new ATOM 385 N THR A 105 38.130 -23.906 -1.674 1.00 0.00 N ATOM 386 CA THR A 105 39.257 -24.551 -2.333 1.00 0.00 C ATOM 387 C THR A 105 38.991 -26.043 -2.503 1.00 0.00 C ATOM 388 O THR A 105 38.807 -26.768 -1.524 1.00 0.00 O ATOM 389 CB THR A 105 40.520 -24.344 -1.503 1.00 0.00 C ATOM 390 OG1 THR A 105 40.255 -24.650 -0.141 1.00 0.00 O ATOM 391 CG2 THR A 105 40.984 -22.892 -1.623 1.00 0.00 C ATOM 0 H THR A 105 37.975 -24.205 -0.711 1.00 0.00 H new ATOM 0 HA THR A 105 39.391 -24.106 -3.319 1.00 0.00 H new ATOM 0 HB THR A 105 41.304 -25.004 -1.874 1.00 0.00 H new ATOM 0 HG1 THR A 105 39.728 -25.474 -0.088 1.00 0.00 H new ATOM 0 HG21 THR A 105 41.886 -22.748 -1.029 1.00 0.00 H new ATOM 0 HG22 THR A 105 41.197 -22.663 -2.667 1.00 0.00 H new ATOM 0 HG23 THR A 105 40.200 -22.228 -1.259 1.00 0.00 H new ATOM 399 N SER A 106 38.972 -26.495 -3.751 1.00 0.00 N ATOM 400 CA SER A 106 38.729 -27.903 -4.039 1.00 0.00 C ATOM 401 C SER A 106 39.217 -28.250 -5.436 1.00 0.00 C ATOM 402 O SER A 106 39.455 -27.367 -6.260 1.00 0.00 O ATOM 403 CB SER A 106 37.236 -28.210 -3.928 1.00 0.00 C ATOM 404 OG SER A 106 36.592 -27.860 -5.146 1.00 0.00 O ATOM 0 H SER A 106 39.121 -25.912 -4.574 1.00 0.00 H new ATOM 0 HA SER A 106 39.276 -28.504 -3.313 1.00 0.00 H new ATOM 0 HB2 SER A 106 37.086 -29.268 -3.715 1.00 0.00 H new ATOM 0 HB3 SER A 106 36.799 -27.653 -3.099 1.00 0.00 H new ATOM 0 HG SER A 106 35.634 -28.057 -5.078 1.00 0.00 H new ATOM 410 N GLY A 107 39.362 -29.545 -5.706 1.00 0.00 N ATOM 411 CA GLY A 107 39.817 -30.005 -7.015 1.00 0.00 C ATOM 412 C GLY A 107 41.079 -30.847 -6.886 1.00 0.00 C ATOM 413 O GLY A 107 41.707 -30.891 -5.829 1.00 0.00 O ATOM 0 H GLY A 107 39.172 -30.292 -5.038 1.00 0.00 H new ATOM 0 HA2 GLY A 107 39.031 -30.591 -7.492 1.00 0.00 H new ATOM 0 HA3 GLY A 107 40.011 -29.147 -7.659 1.00 0.00 H new ATOM 417 N PRO A 108 41.460 -31.502 -7.944 1.00 0.00 N ATOM 418 CA PRO A 108 42.682 -32.361 -7.967 1.00 0.00 C ATOM 419 C PRO A 108 43.956 -31.557 -7.712 1.00 0.00 C ATOM 420 O PRO A 108 44.034 -30.377 -8.047 1.00 0.00 O ATOM 421 CB PRO A 108 42.687 -32.954 -9.390 1.00 0.00 C ATOM 422 CG PRO A 108 41.820 -32.051 -10.198 1.00 0.00 C ATOM 423 CD PRO A 108 40.767 -31.501 -9.241 1.00 0.00 C ATOM 0 HA PRO A 108 42.662 -33.119 -7.184 1.00 0.00 H new ATOM 0 HB2 PRO A 108 43.698 -32.994 -9.795 1.00 0.00 H new ATOM 0 HB3 PRO A 108 42.302 -33.974 -9.392 1.00 0.00 H new ATOM 0 HG2 PRO A 108 42.404 -31.243 -10.640 1.00 0.00 H new ATOM 0 HG3 PRO A 108 41.353 -32.593 -11.020 1.00 0.00 H new ATOM 0 HD2 PRO A 108 40.448 -30.499 -9.526 1.00 0.00 H new ATOM 0 HD3 PRO A 108 39.875 -32.126 -9.221 1.00 0.00 H new ATOM 431 N SER A 109 44.955 -32.215 -7.135 1.00 0.00 N ATOM 432 CA SER A 109 46.228 -31.563 -6.860 1.00 0.00 C ATOM 433 C SER A 109 46.904 -31.150 -8.163 1.00 0.00 C ATOM 434 O SER A 109 47.810 -30.316 -8.169 1.00 0.00 O ATOM 435 CB SER A 109 47.145 -32.507 -6.083 1.00 0.00 C ATOM 436 OG SER A 109 47.352 -33.690 -6.843 1.00 0.00 O ATOM 0 H SER A 109 44.908 -33.193 -6.850 1.00 0.00 H new ATOM 0 HA SER A 109 46.038 -30.673 -6.261 1.00 0.00 H new ATOM 0 HB2 SER A 109 48.099 -32.020 -5.879 1.00 0.00 H new ATOM 0 HB3 SER A 109 46.700 -32.753 -5.119 1.00 0.00 H new ATOM 0 HG SER A 109 47.941 -34.297 -6.349 1.00 0.00 H new ATOM 442 N HIS A 110 46.457 -31.740 -9.272 1.00 0.00 N ATOM 443 CA HIS A 110 47.023 -31.418 -10.580 1.00 0.00 C ATOM 444 C HIS A 110 46.258 -30.271 -11.224 1.00 0.00 C ATOM 445 O HIS A 110 46.856 -29.354 -11.790 1.00 0.00 O ATOM 446 CB HIS A 110 46.968 -32.643 -11.491 1.00 0.00 C ATOM 447 CG HIS A 110 47.765 -33.760 -10.877 1.00 0.00 C ATOM 448 ND1 HIS A 110 47.167 -34.803 -10.187 1.00 0.00 N ATOM 449 CD2 HIS A 110 49.115 -34.008 -10.834 1.00 0.00 C ATOM 450 CE1 HIS A 110 48.144 -35.624 -9.763 1.00 0.00 C ATOM 451 NE2 HIS A 110 49.352 -35.186 -10.131 1.00 0.00 N ATOM 0 H HIS A 110 45.712 -32.437 -9.291 1.00 0.00 H new ATOM 0 HA HIS A 110 48.061 -31.117 -10.441 1.00 0.00 H new ATOM 0 HB2 HIS A 110 45.934 -32.956 -11.635 1.00 0.00 H new ATOM 0 HB3 HIS A 110 47.366 -32.396 -12.475 1.00 0.00 H new ATOM 0 HD2 HIS A 110 49.877 -33.384 -11.278 1.00 0.00 H new ATOM 0 HE1 HIS A 110 47.973 -36.527 -9.195 1.00 0.00 H new ATOM 0 HE2 HIS A 110 50.254 -35.621 -9.938 1.00 0.00 H new ATOM 459 N ALA A 111 44.929 -30.324 -11.128 1.00 0.00 N ATOM 460 CA ALA A 111 44.082 -29.276 -11.700 1.00 0.00 C ATOM 461 C ALA A 111 43.152 -28.699 -10.629 1.00 0.00 C ATOM 462 O ALA A 111 41.965 -29.023 -10.587 1.00 0.00 O ATOM 463 CB ALA A 111 43.262 -29.843 -12.865 1.00 0.00 C ATOM 0 H ALA A 111 44.419 -31.075 -10.663 1.00 0.00 H new ATOM 0 HA ALA A 111 44.719 -28.474 -12.074 1.00 0.00 H new ATOM 0 HB1 ALA A 111 42.635 -29.057 -13.285 1.00 0.00 H new ATOM 0 HB2 ALA A 111 43.936 -30.220 -13.635 1.00 0.00 H new ATOM 0 HB3 ALA A 111 42.632 -30.656 -12.505 1.00 0.00 H new ATOM 469 N PRO A 112 43.662 -27.848 -9.785 1.00 0.00 N ATOM 470 CA PRO A 112 42.864 -27.216 -8.698 1.00 0.00 C ATOM 471 C PRO A 112 41.956 -26.110 -9.217 1.00 0.00 C ATOM 472 O PRO A 112 42.136 -25.626 -10.330 1.00 0.00 O ATOM 473 CB PRO A 112 43.925 -26.666 -7.741 1.00 0.00 C ATOM 474 CG PRO A 112 45.139 -26.426 -8.586 1.00 0.00 C ATOM 475 CD PRO A 112 45.060 -27.388 -9.778 1.00 0.00 C ATOM 0 HA PRO A 112 42.187 -27.924 -8.221 1.00 0.00 H new ATOM 0 HB2 PRO A 112 43.587 -25.744 -7.268 1.00 0.00 H new ATOM 0 HB3 PRO A 112 44.137 -27.375 -6.941 1.00 0.00 H new ATOM 0 HG2 PRO A 112 45.171 -25.392 -8.928 1.00 0.00 H new ATOM 0 HG3 PRO A 112 46.048 -26.600 -8.011 1.00 0.00 H new ATOM 0 HD2 PRO A 112 45.318 -26.887 -10.711 1.00 0.00 H new ATOM 0 HD3 PRO A 112 45.752 -28.222 -9.662 1.00 0.00 H new ATOM 483 N THR A 113 40.988 -25.712 -8.398 1.00 0.00 N ATOM 484 CA THR A 113 40.060 -24.652 -8.780 1.00 0.00 C ATOM 485 C THR A 113 39.455 -24.001 -7.549 1.00 0.00 C ATOM 486 O THR A 113 39.332 -24.630 -6.499 1.00 0.00 O ATOM 487 CB THR A 113 38.950 -25.231 -9.660 1.00 0.00 C ATOM 488 OG1 THR A 113 38.374 -26.354 -9.007 1.00 0.00 O ATOM 489 CG2 THR A 113 39.527 -25.664 -11.009 1.00 0.00 C ATOM 0 H THR A 113 40.826 -26.104 -7.471 1.00 0.00 H new ATOM 0 HA THR A 113 40.608 -23.893 -9.339 1.00 0.00 H new ATOM 0 HB THR A 113 38.187 -24.471 -9.827 1.00 0.00 H new ATOM 0 HG1 THR A 113 37.661 -26.728 -9.566 1.00 0.00 H new ATOM 0 HG21 THR A 113 38.731 -26.075 -11.630 1.00 0.00 H new ATOM 0 HG22 THR A 113 39.969 -24.802 -11.509 1.00 0.00 H new ATOM 0 HG23 THR A 113 40.292 -26.424 -10.850 1.00 0.00 H new ATOM 497 N PHE A 114 39.083 -22.730 -7.681 1.00 0.00 N ATOM 498 CA PHE A 114 38.495 -21.996 -6.560 1.00 0.00 C ATOM 499 C PHE A 114 37.230 -21.275 -7.005 1.00 0.00 C ATOM 500 O PHE A 114 37.151 -20.772 -8.125 1.00 0.00 O ATOM 501 CB PHE A 114 39.510 -20.976 -6.022 1.00 0.00 C ATOM 502 CG PHE A 114 40.913 -21.469 -6.296 1.00 0.00 C ATOM 503 CD1 PHE A 114 41.436 -22.542 -5.568 1.00 0.00 C ATOM 504 CD2 PHE A 114 41.685 -20.858 -7.289 1.00 0.00 C ATOM 505 CE1 PHE A 114 42.733 -22.998 -5.822 1.00 0.00 C ATOM 506 CE2 PHE A 114 42.979 -21.312 -7.544 1.00 0.00 C ATOM 507 CZ PHE A 114 43.507 -22.383 -6.812 1.00 0.00 C ATOM 0 H PHE A 114 39.176 -22.191 -8.542 1.00 0.00 H new ATOM 0 HA PHE A 114 38.237 -22.704 -5.772 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.354 -20.007 -6.496 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.366 -20.833 -4.951 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.836 -23.020 -4.807 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.279 -20.035 -7.858 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.137 -23.824 -5.255 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.576 -20.836 -8.308 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.509 -22.733 -7.011 1.00 0.00 H new ATOM 517 N THR A 115 36.247 -21.212 -6.113 1.00 0.00 N ATOM 518 CA THR A 115 34.987 -20.536 -6.416 1.00 0.00 C ATOM 519 C THR A 115 34.622 -19.568 -5.302 1.00 0.00 C ATOM 520 O THR A 115 34.549 -19.947 -4.133 1.00 0.00 O ATOM 521 CB THR A 115 33.874 -21.568 -6.590 1.00 0.00 C ATOM 522 OG1 THR A 115 34.210 -22.448 -7.654 1.00 0.00 O ATOM 523 CG2 THR A 115 32.560 -20.854 -6.910 1.00 0.00 C ATOM 0 H THR A 115 36.296 -21.618 -5.179 1.00 0.00 H new ATOM 0 HA THR A 115 35.106 -19.974 -7.342 1.00 0.00 H new ATOM 0 HB THR A 115 33.759 -22.139 -5.669 1.00 0.00 H new ATOM 0 HG1 THR A 115 33.498 -23.112 -7.766 1.00 0.00 H new ATOM 0 HG21 THR A 115 31.766 -21.591 -7.034 1.00 0.00 H new ATOM 0 HG22 THR A 115 32.304 -20.179 -6.093 1.00 0.00 H new ATOM 0 HG23 THR A 115 32.672 -20.282 -7.831 1.00 0.00 H new ATOM 531 N SER A 116 34.389 -18.311 -5.669 1.00 0.00 N ATOM 532 CA SER A 116 34.034 -17.292 -4.687 1.00 0.00 C ATOM 533 C SER A 116 32.527 -17.102 -4.634 1.00 0.00 C ATOM 534 O SER A 116 31.891 -16.807 -5.647 1.00 0.00 O ATOM 535 CB SER A 116 34.696 -15.964 -5.054 1.00 0.00 C ATOM 536 OG SER A 116 34.321 -14.975 -4.103 1.00 0.00 O ATOM 0 H SER A 116 34.439 -17.976 -6.631 1.00 0.00 H new ATOM 0 HA SER A 116 34.385 -17.621 -3.709 1.00 0.00 H new ATOM 0 HB2 SER A 116 35.780 -16.077 -5.071 1.00 0.00 H new ATOM 0 HB3 SER A 116 34.392 -15.657 -6.055 1.00 0.00 H new ATOM 0 HG SER A 116 33.604 -14.420 -4.474 1.00 0.00 H new ATOM 542 N THR A 117 31.952 -17.280 -3.448 1.00 0.00 N ATOM 543 CA THR A 117 30.508 -17.129 -3.270 1.00 0.00 C ATOM 544 C THR A 117 30.208 -15.951 -2.357 1.00 0.00 C ATOM 545 O THR A 117 30.797 -15.817 -1.283 1.00 0.00 O ATOM 546 CB THR A 117 29.918 -18.405 -2.667 1.00 0.00 C ATOM 547 OG1 THR A 117 30.064 -19.473 -3.591 1.00 0.00 O ATOM 548 CG2 THR A 117 28.435 -18.188 -2.364 1.00 0.00 C ATOM 0 H THR A 117 32.459 -17.528 -2.599 1.00 0.00 H new ATOM 0 HA THR A 117 30.057 -16.947 -4.245 1.00 0.00 H new ATOM 0 HB THR A 117 30.443 -18.649 -1.743 1.00 0.00 H new ATOM 0 HG1 THR A 117 29.688 -20.292 -3.206 1.00 0.00 H new ATOM 0 HG21 THR A 117 28.015 -19.097 -1.934 1.00 0.00 H new ATOM 0 HG22 THR A 117 28.325 -17.367 -1.655 1.00 0.00 H new ATOM 0 HG23 THR A 117 27.907 -17.945 -3.286 1.00 0.00 H new ATOM 556 N VAL A 118 29.286 -15.093 -2.790 1.00 0.00 N ATOM 557 CA VAL A 118 28.911 -13.918 -2.000 1.00 0.00 C ATOM 558 C VAL A 118 27.488 -14.062 -1.485 1.00 0.00 C ATOM 559 O VAL A 118 26.614 -14.578 -2.183 1.00 0.00 O ATOM 560 CB VAL A 118 29.021 -12.655 -2.853 1.00 0.00 C ATOM 561 CG1 VAL A 118 27.953 -12.678 -3.945 1.00 0.00 C ATOM 562 CG2 VAL A 118 28.817 -11.427 -1.963 1.00 0.00 C ATOM 0 H VAL A 118 28.788 -15.186 -3.675 1.00 0.00 H new ATOM 0 HA VAL A 118 29.591 -13.839 -1.152 1.00 0.00 H new ATOM 0 HB VAL A 118 30.007 -12.612 -3.316 1.00 0.00 H new ATOM 0 HG11 VAL A 118 28.034 -11.776 -4.552 1.00 0.00 H new ATOM 0 HG12 VAL A 118 28.097 -13.555 -4.577 1.00 0.00 H new ATOM 0 HG13 VAL A 118 26.965 -12.720 -3.487 1.00 0.00 H new ATOM 0 HG21 VAL A 118 28.895 -10.523 -2.567 1.00 0.00 H new ATOM 0 HG22 VAL A 118 27.830 -11.472 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 118 29.581 -11.410 -1.185 1.00 0.00 H new ATOM 572 N GLU A 119 27.259 -13.611 -0.253 1.00 0.00 N ATOM 573 CA GLU A 119 25.934 -13.700 0.355 1.00 0.00 C ATOM 574 C GLU A 119 25.473 -12.331 0.840 1.00 0.00 C ATOM 575 O GLU A 119 26.227 -11.606 1.488 1.00 0.00 O ATOM 576 CB GLU A 119 25.968 -14.677 1.532 1.00 0.00 C ATOM 577 CG GLU A 119 24.551 -14.869 2.075 1.00 0.00 C ATOM 578 CD GLU A 119 24.558 -15.893 3.204 1.00 0.00 C ATOM 579 OE1 GLU A 119 25.540 -16.609 3.322 1.00 0.00 O ATOM 580 OE2 GLU A 119 23.583 -15.947 3.936 1.00 0.00 O1- ATOM 0 H GLU A 119 27.970 -13.183 0.340 1.00 0.00 H new ATOM 0 HA GLU A 119 25.232 -14.059 -0.397 1.00 0.00 H new ATOM 0 HB2 GLU A 119 26.379 -15.634 1.212 1.00 0.00 H new ATOM 0 HB3 GLU A 119 26.621 -14.295 2.317 1.00 0.00 H new ATOM 0 HG2 GLU A 119 24.160 -13.918 2.438 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.889 -15.202 1.276 1.00 0.00 H new ATOM 587 N PHE A 120 24.227 -11.990 0.526 1.00 0.00 N ATOM 588 CA PHE A 120 23.672 -10.707 0.947 1.00 0.00 C ATOM 589 C PHE A 120 22.158 -10.696 0.759 1.00 0.00 C ATOM 590 O PHE A 120 21.619 -11.450 -0.051 1.00 0.00 O ATOM 591 CB PHE A 120 24.304 -9.573 0.142 1.00 0.00 C ATOM 592 CG PHE A 120 23.855 -9.664 -1.297 1.00 0.00 C ATOM 593 CD1 PHE A 120 22.667 -9.042 -1.698 1.00 0.00 C ATOM 594 CD2 PHE A 120 24.625 -10.370 -2.227 1.00 0.00 C ATOM 595 CE1 PHE A 120 22.248 -9.126 -3.030 1.00 0.00 C ATOM 596 CE2 PHE A 120 24.207 -10.453 -3.559 1.00 0.00 C ATOM 597 CZ PHE A 120 23.019 -9.830 -3.962 1.00 0.00 C ATOM 0 H PHE A 120 23.588 -12.576 -0.012 1.00 0.00 H new ATOM 0 HA PHE A 120 23.895 -10.561 2.004 1.00 0.00 H new ATOM 0 HB2 PHE A 120 24.016 -8.610 0.563 1.00 0.00 H new ATOM 0 HB3 PHE A 120 25.391 -9.634 0.199 1.00 0.00 H new ATOM 0 HD1 PHE A 120 22.074 -8.497 -0.979 1.00 0.00 H new ATOM 0 HD2 PHE A 120 25.541 -10.850 -1.917 1.00 0.00 H new ATOM 0 HE1 PHE A 120 21.330 -8.648 -3.339 1.00 0.00 H new ATOM 0 HE2 PHE A 120 24.801 -10.998 -4.278 1.00 0.00 H new ATOM 0 HZ PHE A 120 22.698 -9.893 -4.991 1.00 0.00 H new ATOM 607 N ALA A 121 21.477 -9.825 1.496 1.00 0.00 N ATOM 608 CA ALA A 121 20.026 -9.721 1.396 1.00 0.00 C ATOM 609 C ALA A 121 19.378 -11.090 1.578 1.00 0.00 C ATOM 610 O ALA A 121 18.271 -11.331 1.098 1.00 0.00 O ATOM 611 CB ALA A 121 19.634 -9.144 0.035 1.00 0.00 C ATOM 0 H ALA A 121 21.903 -9.184 2.165 1.00 0.00 H new ATOM 0 HA ALA A 121 19.673 -9.057 2.185 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.548 -9.070 -0.030 1.00 0.00 H new ATOM 0 HB2 ALA A 121 20.073 -8.153 -0.080 1.00 0.00 H new ATOM 0 HB3 ALA A 121 20.001 -9.797 -0.757 1.00 0.00 H new ATOM 617 N GLY A 122 20.078 -11.981 2.269 1.00 0.00 N ATOM 618 CA GLY A 122 19.561 -13.323 2.510 1.00 0.00 C ATOM 619 C GLY A 122 19.598 -14.160 1.240 1.00 0.00 C ATOM 620 O GLY A 122 18.860 -15.135 1.105 1.00 0.00 O ATOM 0 H GLY A 122 20.998 -11.801 2.670 1.00 0.00 H new ATOM 0 HA2 GLY A 122 20.151 -13.809 3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 122 18.537 -13.261 2.879 1.00 0.00 H new ATOM 624 N LYS A 123 20.465 -13.778 0.309 1.00 0.00 N ATOM 625 CA LYS A 123 20.599 -14.503 -0.956 1.00 0.00 C ATOM 626 C LYS A 123 22.061 -14.781 -1.252 1.00 0.00 C ATOM 627 O LYS A 123 22.942 -14.035 -0.829 1.00 0.00 O ATOM 628 CB LYS A 123 19.984 -13.693 -2.094 1.00 0.00 C ATOM 629 CG LYS A 123 18.460 -13.702 -1.965 1.00 0.00 C ATOM 630 CD LYS A 123 17.846 -12.899 -3.112 1.00 0.00 C ATOM 631 CE LYS A 123 16.323 -13.010 -3.054 1.00 0.00 C ATOM 632 NZ LYS A 123 15.827 -12.416 -1.781 1.00 0.00 N1+ ATOM 0 H LYS A 123 21.085 -12.974 0.403 1.00 0.00 H new ATOM 0 HA LYS A 123 20.071 -15.452 -0.870 1.00 0.00 H new ATOM 0 HB2 LYS A 123 20.355 -12.669 -2.067 1.00 0.00 H new ATOM 0 HB3 LYS A 123 20.280 -14.114 -3.055 1.00 0.00 H new ATOM 0 HG2 LYS A 123 18.089 -14.727 -1.985 1.00 0.00 H new ATOM 0 HG3 LYS A 123 18.163 -13.274 -1.008 1.00 0.00 H new ATOM 0 HD2 LYS A 123 18.148 -11.854 -3.041 1.00 0.00 H new ATOM 0 HD3 LYS A 123 18.212 -13.272 -4.068 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.878 -12.495 -3.905 1.00 0.00 H new ATOM 0 HE3 LYS A 123 16.022 -14.055 -3.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 14.807 -12.228 -1.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.997 -13.080 -0.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.330 -11.525 -1.594 1.00 0.00 H new ATOM 646 N VAL A 124 22.319 -15.865 -1.981 1.00 0.00 N ATOM 647 CA VAL A 124 23.688 -16.241 -2.326 1.00 0.00 C ATOM 648 C VAL A 124 23.860 -16.325 -3.833 1.00 0.00 C ATOM 649 O VAL A 124 23.085 -16.988 -4.522 1.00 0.00 O ATOM 650 CB VAL A 124 24.023 -17.598 -1.702 1.00 0.00 C ATOM 651 CG1 VAL A 124 23.094 -18.671 -2.273 1.00 0.00 C ATOM 652 CG2 VAL A 124 25.474 -17.960 -2.025 1.00 0.00 C ATOM 0 H VAL A 124 21.603 -16.495 -2.342 1.00 0.00 H new ATOM 0 HA VAL A 124 24.362 -15.478 -1.938 1.00 0.00 H new ATOM 0 HB VAL A 124 23.890 -17.542 -0.622 1.00 0.00 H new ATOM 0 HG11 VAL A 124 23.335 -19.636 -1.827 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.059 -18.415 -2.046 1.00 0.00 H new ATOM 0 HG13 VAL A 124 23.225 -18.728 -3.354 1.00 0.00 H new ATOM 0 HG21 VAL A 124 25.715 -18.926 -1.582 1.00 0.00 H new ATOM 0 HG22 VAL A 124 25.604 -18.014 -3.106 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.138 -17.198 -1.618 1.00 0.00 H new ATOM 662 N PHE A 125 24.881 -15.644 -4.348 1.00 0.00 N ATOM 663 CA PHE A 125 25.151 -15.648 -5.784 1.00 0.00 C ATOM 664 C PHE A 125 26.464 -16.367 -6.077 1.00 0.00 C ATOM 665 O PHE A 125 27.517 -16.003 -5.544 1.00 0.00 O ATOM 666 CB PHE A 125 25.235 -14.212 -6.303 1.00 0.00 C ATOM 667 CG PHE A 125 23.906 -13.525 -6.093 1.00 0.00 C ATOM 668 CD1 PHE A 125 23.505 -13.164 -4.801 1.00 0.00 C ATOM 669 CD2 PHE A 125 23.076 -13.245 -7.186 1.00 0.00 C ATOM 670 CE1 PHE A 125 22.277 -12.526 -4.603 1.00 0.00 C ATOM 671 CE2 PHE A 125 21.847 -12.606 -6.985 1.00 0.00 C ATOM 672 CZ PHE A 125 21.447 -12.246 -5.694 1.00 0.00 C ATOM 0 H PHE A 125 25.532 -15.085 -3.796 1.00 0.00 H new ATOM 0 HA PHE A 125 24.338 -16.172 -6.286 1.00 0.00 H new ATOM 0 HB2 PHE A 125 26.024 -13.670 -5.781 1.00 0.00 H new ATOM 0 HB3 PHE A 125 25.495 -14.211 -7.362 1.00 0.00 H new ATOM 0 HD1 PHE A 125 24.144 -13.378 -3.957 1.00 0.00 H new ATOM 0 HD2 PHE A 125 23.384 -13.522 -8.183 1.00 0.00 H new ATOM 0 HE1 PHE A 125 21.968 -12.249 -3.606 1.00 0.00 H new ATOM 0 HE2 PHE A 125 21.207 -12.391 -7.828 1.00 0.00 H new ATOM 0 HZ PHE A 125 20.499 -11.753 -5.540 1.00 0.00 H new ATOM 682 N SER A 126 26.393 -17.393 -6.922 1.00 0.00 N ATOM 683 CA SER A 126 27.584 -18.155 -7.281 1.00 0.00 C ATOM 684 C SER A 126 28.393 -17.403 -8.333 1.00 0.00 C ATOM 685 O SER A 126 27.865 -17.013 -9.374 1.00 0.00 O ATOM 686 CB SER A 126 27.184 -19.527 -7.827 1.00 0.00 C ATOM 687 OG SER A 126 26.994 -19.435 -9.232 1.00 0.00 O ATOM 0 H SER A 126 25.532 -17.713 -7.366 1.00 0.00 H new ATOM 0 HA SER A 126 28.195 -18.287 -6.388 1.00 0.00 H new ATOM 0 HB2 SER A 126 27.957 -20.261 -7.600 1.00 0.00 H new ATOM 0 HB3 SER A 126 26.268 -19.870 -7.346 1.00 0.00 H new ATOM 0 HG SER A 126 26.942 -18.492 -9.494 1.00 0.00 H new ATOM 693 N GLY A 127 29.676 -17.200 -8.052 1.00 0.00 N ATOM 694 CA GLY A 127 30.550 -16.486 -8.978 1.00 0.00 C ATOM 695 C GLY A 127 31.068 -17.418 -10.068 1.00 0.00 C ATOM 696 O GLY A 127 30.637 -18.567 -10.169 1.00 0.00 O ATOM 0 H GLY A 127 30.132 -17.517 -7.197 1.00 0.00 H new ATOM 0 HA2 GLY A 127 30.006 -15.657 -9.431 1.00 0.00 H new ATOM 0 HA3 GLY A 127 31.390 -16.056 -8.433 1.00 0.00 H new ATOM 700 N GLU A 128 31.996 -16.920 -10.883 1.00 0.00 N ATOM 701 CA GLU A 128 32.564 -17.711 -11.956 1.00 0.00 C ATOM 702 C GLU A 128 33.613 -18.670 -11.413 1.00 0.00 C ATOM 703 O GLU A 128 34.062 -18.533 -10.277 1.00 0.00 O ATOM 704 CB GLU A 128 33.187 -16.794 -13.010 1.00 0.00 C ATOM 705 CG GLU A 128 33.749 -17.631 -14.150 1.00 0.00 C ATOM 706 CD GLU A 128 34.024 -16.752 -15.364 1.00 0.00 C ATOM 707 OE1 GLU A 128 34.020 -15.545 -15.207 1.00 0.00 O ATOM 708 OE2 GLU A 128 34.229 -17.301 -16.436 1.00 0.00 O1- ATOM 0 H GLU A 128 32.366 -15.972 -10.815 1.00 0.00 H new ATOM 0 HA GLU A 128 31.767 -18.294 -12.418 1.00 0.00 H new ATOM 0 HB2 GLU A 128 32.438 -16.100 -13.391 1.00 0.00 H new ATOM 0 HB3 GLU A 128 33.979 -16.194 -12.562 1.00 0.00 H new ATOM 0 HG2 GLU A 128 34.669 -18.121 -13.831 1.00 0.00 H new ATOM 0 HG3 GLU A 128 33.043 -18.418 -14.415 1.00 0.00 H new ATOM 715 N GLU A 129 34.020 -19.632 -12.239 1.00 0.00 N ATOM 716 CA GLU A 129 35.040 -20.601 -11.842 1.00 0.00 C ATOM 717 C GLU A 129 36.338 -20.348 -12.605 1.00 0.00 C ATOM 718 O GLU A 129 36.321 -19.958 -13.773 1.00 0.00 O ATOM 719 CB GLU A 129 34.536 -22.015 -12.115 1.00 0.00 C ATOM 720 CG GLU A 129 34.243 -22.183 -13.609 1.00 0.00 C ATOM 721 CD GLU A 129 35.539 -22.420 -14.376 1.00 0.00 C ATOM 722 OE1 GLU A 129 36.400 -23.104 -13.845 1.00 0.00 O ATOM 723 OE2 GLU A 129 35.655 -21.914 -15.478 1.00 0.00 O1- ATOM 0 H GLU A 129 33.660 -19.761 -13.185 1.00 0.00 H new ATOM 0 HA GLU A 129 35.240 -20.491 -10.776 1.00 0.00 H new ATOM 0 HB2 GLU A 129 35.281 -22.744 -11.797 1.00 0.00 H new ATOM 0 HB3 GLU A 129 33.634 -22.208 -11.534 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.563 -23.021 -13.762 1.00 0.00 H new ATOM 0 HG3 GLU A 129 33.743 -21.293 -13.991 1.00 0.00 H new ATOM 730 N ALA A 130 37.461 -20.586 -11.937 1.00 0.00 N ATOM 731 CA ALA A 130 38.766 -20.390 -12.557 1.00 0.00 C ATOM 732 C ALA A 130 39.878 -20.868 -11.630 1.00 0.00 C ATOM 733 O ALA A 130 39.639 -21.158 -10.460 1.00 0.00 O ATOM 734 CB ALA A 130 38.961 -18.910 -12.886 1.00 0.00 C ATOM 0 H ALA A 130 37.495 -20.913 -10.971 1.00 0.00 H new ATOM 0 HA ALA A 130 38.809 -20.974 -13.476 1.00 0.00 H new ATOM 0 HB1 ALA A 130 39.937 -18.766 -13.349 1.00 0.00 H new ATOM 0 HB2 ALA A 130 38.181 -18.584 -13.574 1.00 0.00 H new ATOM 0 HB3 ALA A 130 38.904 -18.323 -11.969 1.00 0.00 H new ATOM 740 N LYS A 131 41.093 -20.926 -12.154 1.00 0.00 N ATOM 741 CA LYS A 131 42.250 -21.343 -11.368 1.00 0.00 C ATOM 742 C LYS A 131 42.843 -20.149 -10.628 1.00 0.00 C ATOM 743 O LYS A 131 44.058 -20.045 -10.472 1.00 0.00 O ATOM 744 CB LYS A 131 43.311 -21.968 -12.268 1.00 0.00 C ATOM 745 CG LYS A 131 42.843 -23.349 -12.722 1.00 0.00 C ATOM 746 CD LYS A 131 43.878 -23.953 -13.671 1.00 0.00 C ATOM 747 CE LYS A 131 43.360 -25.289 -14.210 1.00 0.00 C ATOM 748 NZ LYS A 131 43.164 -26.238 -13.078 1.00 0.00 N1+ ATOM 0 H LYS A 131 41.306 -20.689 -13.123 1.00 0.00 H new ATOM 0 HA LYS A 131 41.921 -22.087 -10.642 1.00 0.00 H new ATOM 0 HB2 LYS A 131 43.491 -21.330 -13.134 1.00 0.00 H new ATOM 0 HB3 LYS A 131 44.256 -22.051 -11.731 1.00 0.00 H new ATOM 0 HG2 LYS A 131 42.703 -23.999 -11.858 1.00 0.00 H new ATOM 0 HG3 LYS A 131 41.878 -23.271 -13.222 1.00 0.00 H new ATOM 0 HD2 LYS A 131 44.074 -23.268 -14.496 1.00 0.00 H new ATOM 0 HD3 LYS A 131 44.823 -24.102 -13.148 1.00 0.00 H new ATOM 0 HE2 LYS A 131 42.420 -25.139 -14.740 1.00 0.00 H new ATOM 0 HE3 LYS A 131 44.068 -25.703 -14.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 43.569 -27.163 -13.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 43.638 -25.869 -12.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 42.147 -26.345 -12.887 1.00 0.00 H new ATOM 762 N THR A 132 41.980 -19.248 -10.174 1.00 0.00 N ATOM 763 CA THR A 132 42.434 -18.057 -9.456 1.00 0.00 C ATOM 764 C THR A 132 41.322 -17.513 -8.565 1.00 0.00 C ATOM 765 O THR A 132 40.142 -17.629 -8.887 1.00 0.00 O ATOM 766 CB THR A 132 42.871 -16.988 -10.456 1.00 0.00 C ATOM 767 OG1 THR A 132 43.226 -15.803 -9.756 1.00 0.00 O ATOM 768 CG2 THR A 132 41.723 -16.690 -11.418 1.00 0.00 C ATOM 0 H THR A 132 40.969 -19.316 -10.288 1.00 0.00 H new ATOM 0 HA THR A 132 43.280 -18.329 -8.825 1.00 0.00 H new ATOM 0 HB THR A 132 43.731 -17.347 -11.021 1.00 0.00 H new ATOM 0 HG1 THR A 132 43.508 -15.117 -10.396 1.00 0.00 H new ATOM 0 HG21 THR A 132 42.035 -15.927 -12.131 1.00 0.00 H new ATOM 0 HG22 THR A 132 41.452 -17.600 -11.954 1.00 0.00 H new ATOM 0 HG23 THR A 132 40.861 -16.330 -10.856 1.00 0.00 H new ATOM 776 N LYS A 133 41.710 -16.912 -7.446 1.00 0.00 N ATOM 777 CA LYS A 133 40.742 -16.344 -6.518 1.00 0.00 C ATOM 778 C LYS A 133 40.306 -14.953 -6.963 1.00 0.00 C ATOM 779 O LYS A 133 39.171 -14.540 -6.729 1.00 0.00 O ATOM 780 CB LYS A 133 41.346 -16.270 -5.115 1.00 0.00 C ATOM 781 CG LYS A 133 41.593 -17.687 -4.592 1.00 0.00 C ATOM 782 CD LYS A 133 42.229 -17.614 -3.202 1.00 0.00 C ATOM 783 CE LYS A 133 42.478 -19.031 -2.678 1.00 0.00 C ATOM 784 NZ LYS A 133 43.126 -18.957 -1.338 1.00 0.00 N1+ ATOM 0 H LYS A 133 42.684 -16.806 -7.161 1.00 0.00 H new ATOM 0 HA LYS A 133 39.865 -16.991 -6.505 1.00 0.00 H new ATOM 0 HB2 LYS A 133 42.282 -15.711 -5.139 1.00 0.00 H new ATOM 0 HB3 LYS A 133 40.673 -15.736 -4.445 1.00 0.00 H new ATOM 0 HG2 LYS A 133 40.654 -18.238 -4.545 1.00 0.00 H new ATOM 0 HG3 LYS A 133 42.247 -18.229 -5.275 1.00 0.00 H new ATOM 0 HD2 LYS A 133 43.168 -17.062 -3.249 1.00 0.00 H new ATOM 0 HD3 LYS A 133 41.574 -17.072 -2.519 1.00 0.00 H new ATOM 0 HE2 LYS A 133 41.536 -19.576 -2.609 1.00 0.00 H new ATOM 0 HE3 LYS A 133 43.114 -19.581 -3.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 43.296 -19.919 -0.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 44.032 -18.452 -1.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 42.503 -18.448 -0.679 1.00 0.00 H new ATOM 798 N LYS A 134 41.228 -14.222 -7.583 1.00 0.00 N ATOM 799 CA LYS A 134 40.935 -12.863 -8.018 1.00 0.00 C ATOM 800 C LYS A 134 39.762 -12.841 -8.983 1.00 0.00 C ATOM 801 O LYS A 134 38.798 -12.100 -8.782 1.00 0.00 O ATOM 802 CB LYS A 134 42.168 -12.269 -8.712 1.00 0.00 C ATOM 803 CG LYS A 134 43.388 -12.389 -7.793 1.00 0.00 C ATOM 804 CD LYS A 134 43.190 -11.513 -6.552 1.00 0.00 C ATOM 805 CE LYS A 134 44.534 -11.297 -5.859 1.00 0.00 C ATOM 806 NZ LYS A 134 44.329 -10.486 -4.627 1.00 0.00 N1+ ATOM 0 H LYS A 134 42.173 -14.544 -7.793 1.00 0.00 H new ATOM 0 HA LYS A 134 40.676 -12.271 -7.140 1.00 0.00 H new ATOM 0 HB2 LYS A 134 42.355 -12.791 -9.650 1.00 0.00 H new ATOM 0 HB3 LYS A 134 41.989 -11.223 -8.959 1.00 0.00 H new ATOM 0 HG2 LYS A 134 43.531 -13.428 -7.497 1.00 0.00 H new ATOM 0 HG3 LYS A 134 44.288 -12.083 -8.326 1.00 0.00 H new ATOM 0 HD2 LYS A 134 42.758 -10.554 -6.837 1.00 0.00 H new ATOM 0 HD3 LYS A 134 42.488 -11.988 -5.867 1.00 0.00 H new ATOM 0 HE2 LYS A 134 44.984 -12.257 -5.605 1.00 0.00 H new ATOM 0 HE3 LYS A 134 45.225 -10.789 -6.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 45.243 -10.337 -4.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 43.917 -9.566 -4.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 43.683 -10.988 -3.984 1.00 0.00 H new ATOM 820 N LEU A 135 39.842 -13.651 -10.028 1.00 0.00 N ATOM 821 CA LEU A 135 38.781 -13.703 -11.019 1.00 0.00 C ATOM 822 C LEU A 135 37.483 -14.207 -10.402 1.00 0.00 C ATOM 823 O LEU A 135 36.401 -13.718 -10.725 1.00 0.00 O ATOM 824 CB LEU A 135 39.193 -14.630 -12.176 1.00 0.00 C ATOM 825 CG LEU A 135 38.454 -14.218 -13.454 1.00 0.00 C ATOM 826 CD1 LEU A 135 38.991 -12.861 -13.949 1.00 0.00 C ATOM 827 CD2 LEU A 135 38.675 -15.280 -14.534 1.00 0.00 C ATOM 0 H LEU A 135 40.626 -14.277 -10.210 1.00 0.00 H new ATOM 0 HA LEU A 135 38.617 -12.694 -11.396 1.00 0.00 H new ATOM 0 HB2 LEU A 135 40.270 -14.575 -12.333 1.00 0.00 H new ATOM 0 HB3 LEU A 135 38.960 -15.665 -11.927 1.00 0.00 H new ATOM 0 HG LEU A 135 37.388 -14.128 -13.243 1.00 0.00 H new ATOM 0 HD11 LEU A 135 38.464 -12.571 -14.858 1.00 0.00 H new ATOM 0 HD12 LEU A 135 38.833 -12.105 -13.180 1.00 0.00 H new ATOM 0 HD13 LEU A 135 40.057 -12.947 -14.160 1.00 0.00 H new ATOM 0 HD21 LEU A 135 38.150 -14.989 -15.444 1.00 0.00 H new ATOM 0 HD22 LEU A 135 39.741 -15.370 -14.743 1.00 0.00 H new ATOM 0 HD23 LEU A 135 38.292 -16.239 -14.185 1.00 0.00 H new ATOM 839 N ALA A 136 37.601 -15.198 -9.526 1.00 0.00 N ATOM 840 CA ALA A 136 36.426 -15.773 -8.886 1.00 0.00 C ATOM 841 C ALA A 136 35.679 -14.712 -8.089 1.00 0.00 C ATOM 842 O ALA A 136 34.480 -14.508 -8.283 1.00 0.00 O ATOM 843 CB ALA A 136 36.849 -16.910 -7.952 1.00 0.00 C ATOM 0 H ALA A 136 38.488 -15.616 -9.245 1.00 0.00 H new ATOM 0 HA ALA A 136 35.765 -16.162 -9.660 1.00 0.00 H new ATOM 0 HB1 ALA A 136 35.966 -17.337 -7.476 1.00 0.00 H new ATOM 0 HB2 ALA A 136 37.360 -17.682 -8.527 1.00 0.00 H new ATOM 0 HB3 ALA A 136 37.522 -16.522 -7.188 1.00 0.00 H new ATOM 849 N GLU A 137 36.387 -14.046 -7.182 1.00 0.00 N ATOM 850 CA GLU A 137 35.772 -13.016 -6.353 1.00 0.00 C ATOM 851 C GLU A 137 35.187 -11.908 -7.217 1.00 0.00 C ATOM 852 O GLU A 137 34.068 -11.451 -6.981 1.00 0.00 O ATOM 853 CB GLU A 137 36.816 -12.428 -5.398 1.00 0.00 C ATOM 854 CG GLU A 137 37.255 -13.495 -4.393 1.00 0.00 C ATOM 855 CD GLU A 137 38.319 -12.925 -3.458 1.00 0.00 C ATOM 856 OE1 GLU A 137 38.650 -11.761 -3.610 1.00 0.00 O ATOM 857 OE2 GLU A 137 38.783 -13.660 -2.603 1.00 0.00 O1- ATOM 0 H GLU A 137 37.379 -14.200 -7.003 1.00 0.00 H new ATOM 0 HA GLU A 137 34.966 -13.471 -5.778 1.00 0.00 H new ATOM 0 HB2 GLU A 137 37.677 -12.069 -5.962 1.00 0.00 H new ATOM 0 HB3 GLU A 137 36.399 -11.569 -4.872 1.00 0.00 H new ATOM 0 HG2 GLU A 137 36.397 -13.837 -3.815 1.00 0.00 H new ATOM 0 HG3 GLU A 137 37.650 -14.363 -4.921 1.00 0.00 H new ATOM 864 N MET A 138 35.948 -11.481 -8.218 1.00 0.00 N ATOM 865 CA MET A 138 35.494 -10.421 -9.108 1.00 0.00 C ATOM 866 C MET A 138 34.216 -10.839 -9.827 1.00 0.00 C ATOM 867 O MET A 138 33.288 -10.045 -9.976 1.00 0.00 O ATOM 868 CB MET A 138 36.582 -10.103 -10.138 1.00 0.00 C ATOM 869 CG MET A 138 36.123 -8.943 -11.025 1.00 0.00 C ATOM 870 SD MET A 138 37.447 -8.502 -12.175 1.00 0.00 S ATOM 871 CE MET A 138 38.221 -7.227 -11.151 1.00 0.00 C ATOM 0 H MET A 138 36.875 -11.849 -8.432 1.00 0.00 H new ATOM 0 HA MET A 138 35.288 -9.532 -8.511 1.00 0.00 H new ATOM 0 HB2 MET A 138 37.511 -9.842 -9.632 1.00 0.00 H new ATOM 0 HB3 MET A 138 36.788 -10.982 -10.749 1.00 0.00 H new ATOM 0 HG2 MET A 138 35.227 -9.226 -11.577 1.00 0.00 H new ATOM 0 HG3 MET A 138 35.860 -8.083 -10.410 1.00 0.00 H new ATOM 0 HE1 MET A 138 39.079 -6.809 -11.677 1.00 0.00 H new ATOM 0 HE2 MET A 138 37.499 -6.436 -10.948 1.00 0.00 H new ATOM 0 HE3 MET A 138 38.551 -7.667 -10.210 1.00 0.00 H new ATOM 881 N SER A 139 34.173 -12.090 -10.271 1.00 0.00 N ATOM 882 CA SER A 139 33.002 -12.603 -10.968 1.00 0.00 C ATOM 883 C SER A 139 31.796 -12.642 -10.040 1.00 0.00 C ATOM 884 O SER A 139 30.664 -12.411 -10.466 1.00 0.00 O ATOM 885 CB SER A 139 33.283 -14.005 -11.498 1.00 0.00 C ATOM 886 OG SER A 139 34.184 -13.918 -12.595 1.00 0.00 O ATOM 0 H SER A 139 34.931 -12.763 -10.161 1.00 0.00 H new ATOM 0 HA SER A 139 32.781 -11.936 -11.801 1.00 0.00 H new ATOM 0 HB2 SER A 139 33.709 -14.626 -10.710 1.00 0.00 H new ATOM 0 HB3 SER A 139 32.354 -14.481 -11.812 1.00 0.00 H new ATOM 0 HG SER A 139 35.101 -13.832 -12.259 1.00 0.00 H new ATOM 892 N ALA A 140 32.043 -12.938 -8.767 1.00 0.00 N ATOM 893 CA ALA A 140 30.964 -13.010 -7.787 1.00 0.00 C ATOM 894 C ALA A 140 30.282 -11.654 -7.633 1.00 0.00 C ATOM 895 O ALA A 140 29.057 -11.562 -7.600 1.00 0.00 O ATOM 896 CB ALA A 140 31.522 -13.461 -6.434 1.00 0.00 C ATOM 0 H ALA A 140 32.972 -13.130 -8.392 1.00 0.00 H new ATOM 0 HA ALA A 140 30.227 -13.732 -8.138 1.00 0.00 H new ATOM 0 HB1 ALA A 140 30.713 -13.513 -5.706 1.00 0.00 H new ATOM 0 HB2 ALA A 140 31.980 -14.445 -6.539 1.00 0.00 H new ATOM 0 HB3 ALA A 140 32.271 -12.747 -6.093 1.00 0.00 H new ATOM 902 N ALA A 141 31.085 -10.604 -7.523 1.00 0.00 N ATOM 903 CA ALA A 141 30.551 -9.257 -7.366 1.00 0.00 C ATOM 904 C ALA A 141 29.939 -8.765 -8.673 1.00 0.00 C ATOM 905 O ALA A 141 29.086 -7.876 -8.677 1.00 0.00 O ATOM 906 CB ALA A 141 31.659 -8.297 -6.929 1.00 0.00 C ATOM 0 H ALA A 141 32.103 -10.658 -7.539 1.00 0.00 H new ATOM 0 HA ALA A 141 29.775 -9.286 -6.601 1.00 0.00 H new ATOM 0 HB1 ALA A 141 31.248 -7.294 -6.815 1.00 0.00 H new ATOM 0 HB2 ALA A 141 32.074 -8.629 -5.977 1.00 0.00 H new ATOM 0 HB3 ALA A 141 32.446 -8.283 -7.683 1.00 0.00 H new ATOM 912 N LYS A 142 30.383 -9.349 -9.783 1.00 0.00 N ATOM 913 CA LYS A 142 29.869 -8.963 -11.092 1.00 0.00 C ATOM 914 C LYS A 142 28.436 -9.449 -11.291 1.00 0.00 C ATOM 915 O LYS A 142 27.558 -8.683 -11.686 1.00 0.00 O ATOM 916 CB LYS A 142 30.763 -9.544 -12.190 1.00 0.00 C ATOM 917 CG LYS A 142 30.302 -9.022 -13.553 1.00 0.00 C ATOM 918 CD LYS A 142 31.229 -9.560 -14.646 1.00 0.00 C ATOM 919 CE LYS A 142 30.778 -9.025 -16.007 1.00 0.00 C ATOM 920 NZ LYS A 142 31.711 -9.510 -17.064 1.00 0.00 N1+ ATOM 0 H LYS A 142 31.090 -10.084 -9.802 1.00 0.00 H new ATOM 0 HA LYS A 142 29.872 -7.874 -11.148 1.00 0.00 H new ATOM 0 HB2 LYS A 142 31.802 -9.264 -12.014 1.00 0.00 H new ATOM 0 HB3 LYS A 142 30.719 -10.633 -12.172 1.00 0.00 H new ATOM 0 HG2 LYS A 142 29.276 -9.334 -13.746 1.00 0.00 H new ATOM 0 HG3 LYS A 142 30.310 -7.932 -13.559 1.00 0.00 H new ATOM 0 HD2 LYS A 142 32.257 -9.258 -14.447 1.00 0.00 H new ATOM 0 HD3 LYS A 142 31.212 -10.650 -14.648 1.00 0.00 H new ATOM 0 HE2 LYS A 142 29.763 -9.358 -16.222 1.00 0.00 H new ATOM 0 HE3 LYS A 142 30.761 -7.935 -15.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 31.406 -9.147 -17.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 32.673 -9.172 -16.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 31.706 -10.550 -17.081 1.00 0.00 H new ATOM 934 N VAL A 143 28.213 -10.734 -11.023 1.00 0.00 N ATOM 935 CA VAL A 143 26.887 -11.319 -11.185 1.00 0.00 C ATOM 936 C VAL A 143 25.912 -10.728 -10.178 1.00 0.00 C ATOM 937 O VAL A 143 24.760 -10.446 -10.506 1.00 0.00 O ATOM 938 CB VAL A 143 26.960 -12.837 -11.009 1.00 0.00 C ATOM 939 CG1 VAL A 143 27.584 -13.163 -9.652 1.00 0.00 C ATOM 940 CG2 VAL A 143 25.549 -13.425 -11.075 1.00 0.00 C ATOM 0 H VAL A 143 28.928 -11.384 -10.696 1.00 0.00 H new ATOM 0 HA VAL A 143 26.530 -11.090 -12.189 1.00 0.00 H new ATOM 0 HB VAL A 143 27.571 -13.266 -11.803 1.00 0.00 H new ATOM 0 HG11 VAL A 143 27.636 -14.244 -9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 143 28.589 -12.743 -9.603 1.00 0.00 H new ATOM 0 HG13 VAL A 143 26.973 -12.734 -8.858 1.00 0.00 H new ATOM 0 HG21 VAL A 143 25.599 -14.507 -10.950 1.00 0.00 H new ATOM 0 HG22 VAL A 143 24.938 -12.996 -10.281 1.00 0.00 H new ATOM 0 HG23 VAL A 143 25.103 -13.192 -12.042 1.00 0.00 H new ATOM 950 N ALA A 144 26.378 -10.545 -8.947 1.00 0.00 N ATOM 951 CA ALA A 144 25.534 -9.987 -7.899 1.00 0.00 C ATOM 952 C ALA A 144 25.082 -8.581 -8.271 1.00 0.00 C ATOM 953 O ALA A 144 23.920 -8.224 -8.094 1.00 0.00 O ATOM 954 CB ALA A 144 26.303 -9.945 -6.576 1.00 0.00 C ATOM 0 H ALA A 144 27.328 -10.773 -8.653 1.00 0.00 H new ATOM 0 HA ALA A 144 24.655 -10.622 -7.788 1.00 0.00 H new ATOM 0 HB1 ALA A 144 25.665 -9.527 -5.798 1.00 0.00 H new ATOM 0 HB2 ALA A 144 26.601 -10.955 -6.296 1.00 0.00 H new ATOM 0 HB3 ALA A 144 27.191 -9.323 -6.691 1.00 0.00 H new ATOM 960 N PHE A 145 26.011 -7.784 -8.787 1.00 0.00 N ATOM 961 CA PHE A 145 25.697 -6.417 -9.177 1.00 0.00 C ATOM 962 C PHE A 145 24.617 -6.406 -10.248 1.00 0.00 C ATOM 963 O PHE A 145 23.707 -5.585 -10.212 1.00 0.00 O ATOM 964 CB PHE A 145 26.952 -5.716 -9.706 1.00 0.00 C ATOM 965 CG PHE A 145 26.655 -4.254 -9.942 1.00 0.00 C ATOM 966 CD1 PHE A 145 26.705 -3.348 -8.873 1.00 0.00 C ATOM 967 CD2 PHE A 145 26.329 -3.804 -11.227 1.00 0.00 C ATOM 968 CE1 PHE A 145 26.431 -1.992 -9.095 1.00 0.00 C ATOM 969 CE2 PHE A 145 26.055 -2.448 -11.445 1.00 0.00 C ATOM 970 CZ PHE A 145 26.106 -1.543 -10.379 1.00 0.00 C ATOM 0 H PHE A 145 26.981 -8.059 -8.944 1.00 0.00 H new ATOM 0 HA PHE A 145 25.332 -5.884 -8.299 1.00 0.00 H new ATOM 0 HB2 PHE A 145 27.768 -5.821 -8.991 1.00 0.00 H new ATOM 0 HB3 PHE A 145 27.279 -6.185 -10.634 1.00 0.00 H new ATOM 0 HD1 PHE A 145 26.954 -3.695 -7.881 1.00 0.00 H new ATOM 0 HD2 PHE A 145 26.289 -4.502 -12.050 1.00 0.00 H new ATOM 0 HE1 PHE A 145 26.471 -1.292 -8.273 1.00 0.00 H new ATOM 0 HE2 PHE A 145 25.804 -2.101 -12.436 1.00 0.00 H new ATOM 0 HZ PHE A 145 25.894 -0.497 -10.548 1.00 0.00 H new ATOM 980 N MET A 146 24.731 -7.320 -11.202 1.00 0.00 N ATOM 981 CA MET A 146 23.765 -7.400 -12.291 1.00 0.00 C ATOM 982 C MET A 146 22.379 -7.753 -11.767 1.00 0.00 C ATOM 983 O MET A 146 21.377 -7.219 -12.233 1.00 0.00 O ATOM 984 CB MET A 146 24.213 -8.462 -13.301 1.00 0.00 C ATOM 985 CG MET A 146 25.402 -7.937 -14.111 1.00 0.00 C ATOM 986 SD MET A 146 24.866 -6.564 -15.164 1.00 0.00 S ATOM 987 CE MET A 146 23.918 -7.542 -16.356 1.00 0.00 C ATOM 0 H MET A 146 25.478 -8.013 -11.245 1.00 0.00 H new ATOM 0 HA MET A 146 23.715 -6.425 -12.775 1.00 0.00 H new ATOM 0 HB2 MET A 146 24.492 -9.378 -12.780 1.00 0.00 H new ATOM 0 HB3 MET A 146 23.389 -8.713 -13.969 1.00 0.00 H new ATOM 0 HG2 MET A 146 26.194 -7.605 -13.439 1.00 0.00 H new ATOM 0 HG3 MET A 146 25.818 -8.737 -14.724 1.00 0.00 H new ATOM 0 HE1 MET A 146 24.002 -7.092 -17.345 1.00 0.00 H new ATOM 0 HE2 MET A 146 24.310 -8.559 -16.386 1.00 0.00 H new ATOM 0 HE3 MET A 146 22.870 -7.565 -16.056 1.00 0.00 H new ATOM 997 N SER A 147 22.329 -8.659 -10.799 1.00 0.00 N ATOM 998 CA SER A 147 21.058 -9.071 -10.222 1.00 0.00 C ATOM 999 C SER A 147 20.415 -7.930 -9.440 1.00 0.00 C ATOM 1000 O SER A 147 19.214 -7.683 -9.557 1.00 0.00 O ATOM 1001 CB SER A 147 21.269 -10.265 -9.295 1.00 0.00 C ATOM 1002 OG SER A 147 20.130 -10.418 -8.458 1.00 0.00 O ATOM 0 H SER A 147 23.147 -9.119 -10.400 1.00 0.00 H new ATOM 0 HA SER A 147 20.392 -9.352 -11.038 1.00 0.00 H new ATOM 0 HB2 SER A 147 21.429 -11.171 -9.880 1.00 0.00 H new ATOM 0 HB3 SER A 147 22.162 -10.116 -8.689 1.00 0.00 H new ATOM 0 HG SER A 147 20.399 -10.832 -7.611 1.00 0.00 H new ATOM 1008 N ILE A 148 21.220 -7.248 -8.636 1.00 0.00 N ATOM 1009 CA ILE A 148 20.716 -6.146 -7.826 1.00 0.00 C ATOM 1010 C ILE A 148 19.997 -5.126 -8.698 1.00 0.00 C ATOM 1011 O ILE A 148 19.030 -4.497 -8.264 1.00 0.00 O ATOM 1012 CB ILE A 148 21.866 -5.468 -7.078 1.00 0.00 C ATOM 1013 CG1 ILE A 148 22.381 -6.401 -5.979 1.00 0.00 C ATOM 1014 CG2 ILE A 148 21.376 -4.160 -6.448 1.00 0.00 C ATOM 1015 CD1 ILE A 148 23.690 -5.850 -5.413 1.00 0.00 C ATOM 0 H ILE A 148 22.217 -7.436 -8.527 1.00 0.00 H new ATOM 0 HA ILE A 148 20.009 -6.550 -7.102 1.00 0.00 H new ATOM 0 HB ILE A 148 22.671 -5.250 -7.780 1.00 0.00 H new ATOM 0 HG12 ILE A 148 21.639 -6.490 -5.186 1.00 0.00 H new ATOM 0 HG13 ILE A 148 22.539 -7.402 -6.381 1.00 0.00 H new ATOM 0 HG21 ILE A 148 22.199 -3.681 -5.917 1.00 0.00 H new ATOM 0 HG22 ILE A 148 21.012 -3.493 -7.230 1.00 0.00 H new ATOM 0 HG23 ILE A 148 20.568 -4.373 -5.748 1.00 0.00 H new ATOM 0 HD11 ILE A 148 24.056 -6.515 -4.631 1.00 0.00 H new ATOM 0 HD12 ILE A 148 24.431 -5.784 -6.209 1.00 0.00 H new ATOM 0 HD13 ILE A 148 23.517 -4.858 -4.995 1.00 0.00 H new ATOM 1027 N LYS A 149 20.477 -4.964 -9.922 1.00 0.00 N ATOM 1028 CA LYS A 149 19.873 -4.015 -10.846 1.00 0.00 C ATOM 1029 C LYS A 149 18.421 -4.387 -11.121 1.00 0.00 C ATOM 1030 O LYS A 149 17.546 -3.523 -11.165 1.00 0.00 O ATOM 1031 CB LYS A 149 20.652 -4.004 -12.160 1.00 0.00 C ATOM 1032 CG LYS A 149 22.021 -3.356 -11.939 1.00 0.00 C ATOM 1033 CD LYS A 149 22.854 -3.462 -13.220 1.00 0.00 C ATOM 1034 CE LYS A 149 22.381 -2.413 -14.232 1.00 0.00 C ATOM 1035 NZ LYS A 149 23.338 -2.353 -15.369 1.00 0.00 N1+ ATOM 0 H LYS A 149 21.277 -5.473 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 149 19.904 -3.024 -10.393 1.00 0.00 H new ATOM 0 HB2 LYS A 149 20.776 -5.022 -12.530 1.00 0.00 H new ATOM 0 HB3 LYS A 149 20.096 -3.454 -12.919 1.00 0.00 H new ATOM 0 HG2 LYS A 149 21.898 -2.310 -11.659 1.00 0.00 H new ATOM 0 HG3 LYS A 149 22.538 -3.848 -11.115 1.00 0.00 H new ATOM 0 HD2 LYS A 149 23.909 -3.312 -12.992 1.00 0.00 H new ATOM 0 HD3 LYS A 149 22.759 -4.461 -13.646 1.00 0.00 H new ATOM 0 HE2 LYS A 149 21.385 -2.666 -14.595 1.00 0.00 H new ATOM 0 HE3 LYS A 149 22.308 -1.437 -13.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 23.017 -1.641 -16.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 24.281 -2.093 -15.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 23.386 -3.283 -15.832 1.00 0.00 H new