USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1101 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 LYS NZ :NH3+ 154:sc= -1.15 (180deg=-3.89!) USER MOD Set 1.2: A 157 SER OG : rot -59:sc= -1.13! USER MOD Set 2.1: A 11 TYR OH : rot -171:sc= -3.88! USER MOD Set 2.2: A 25 MET CE :methyl 177:sc= -4.63! (180deg=-4.32!) USER MOD Set 2.3: A 37 ASN : amide:sc= -6.63! C(o=-15!,f=-20!) USER MOD Set 2.4: A 154 MET CE :methyl 179:sc= -0.0208 (180deg=-0.0208) USER MOD Set 3.1: A 62 ASN :FLIP amide:sc= -2.42! C(o=-4.9!,f=-2.7!) USER MOD Set 3.2: A 149 ASN :FLIP amide:sc= -0.252 X(o=-2.9,f=-2.7) USER MOD Set 4.1: A 106 GLN :FLIP amide:sc= -0.0542 F(o=-1.7,f=-0.78) USER MOD Set 4.2: A 146 SER OG : rot 180:sc= 0 USER MOD Set 4.3: A 151 THR OG1 : rot 180:sc= -0.724 USER MOD Set 5.1: A 99 THR OG1 : rot -100:sc= -2.53! USER MOD Set 5.2: A 120 GLN : amide:sc= -4.28! C(o=-6.8!,f=-8.7!) USER MOD Set 6.1: A 42 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 73 ASN :FLIP amide:sc= -3.77! C(o=-4.9!,f=-3.8!) USER MOD Single : A 15 ASN : amide:sc= -2.42 X(o=-2.4,f=-2.4!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -109:sc= -1.32! USER MOD Single : A 23 GLN : amide:sc= -0.0204 X(o=-0.02,f=-0.028) USER MOD Single : A 26 SER OG : rot -45:sc= 1.21 USER MOD Single : A 27 GLN : amide:sc= -0.497 K(o=-0.5,f=-1.5) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -2.24 K(o=-2.2,f=-9.9!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00636 USER MOD Single : A 44 THR OG1 : rot 125:sc= -0.999 USER MOD Single : A 48 SER OG : rot -38:sc= -0.671 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 52 ASN :FLIP amide:sc= -7.18! C(o=-13!,f=-7.2!) USER MOD Single : A 54 GLN : amide:sc= -0.0162 X(o=-0.016,f=-0.2) USER MOD Single : A 56 ASN : amide:sc= -1.13! C(o=-1.1!,f=-1.8!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc=-0.00225 X(o=-0.0023,f=0) USER MOD Single : A 66 TYR OH : rot 87:sc= 0.814 USER MOD Single : A 67 THR OG1 : rot 146:sc= -0.938 USER MOD Single : A 72 THR OG1 : rot -119:sc= 0.661 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= -0.266 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot -44:sc= 0.0978 USER MOD Single : A 90 ASN : amide:sc= -12.4! C(o=-12!,f=-15!) USER MOD Single : A 91 SER OG : rot -48:sc= -0.679 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 73:sc= 0.348 USER MOD Single : A 100 TYR OH : rot 61:sc= 0.983 USER MOD Single : A 101 HIS : no HE2:sc= -24.6! C(o=-25!,f=-40!) USER MOD Single : A 107 THR OG1 : rot -6:sc= 0.631 USER MOD Single : A 108 SER OG : rot 180:sc= 0.0772 USER MOD Single : A 111 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot -154:sc= 0.265 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 180:sc= -0.133 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc=-0.00567 X(o=-0.0057,f=-0.044) USER MOD Single : A 147 THR OG1 : rot 27:sc= -2.13! USER MOD Single : A 153 TYR OH : rot -168:sc= 0.85 USER MOD Single : A 160 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 3 -15.086 -6.301 6.010 1.00 0.00 N ATOM 22 CA LEU A 3 -14.062 -5.597 5.257 1.00 0.00 C ATOM 23 C LEU A 3 -14.676 -5.028 3.977 1.00 0.00 C ATOM 24 O LEU A 3 -15.875 -5.174 3.741 1.00 0.00 O ATOM 25 CB LEU A 3 -12.858 -6.508 5.009 1.00 0.00 C ATOM 26 CG LEU A 3 -12.098 -6.970 6.254 1.00 0.00 C ATOM 27 CD1 LEU A 3 -12.081 -8.496 6.352 1.00 0.00 C ATOM 28 CD2 LEU A 3 -10.688 -6.377 6.287 1.00 0.00 C ATOM 0 HA LEU A 3 -13.681 -4.752 5.831 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -13.201 -7.390 4.469 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -12.160 -5.985 4.355 1.00 0.00 H new ATOM 0 HG LEU A 3 -12.624 -6.598 7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -11.535 -8.797 7.246 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -13.104 -8.868 6.409 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -11.592 -8.912 5.471 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -10.169 -6.721 7.182 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -10.138 -6.698 5.403 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -10.751 -5.289 6.300 1.00 0.00 H new ATOM 40 N VAL A 4 -13.828 -4.390 3.184 1.00 0.00 N ATOM 41 CA VAL A 4 -14.272 -3.799 1.933 1.00 0.00 C ATOM 42 C VAL A 4 -13.352 -4.258 0.801 1.00 0.00 C ATOM 43 O VAL A 4 -12.141 -4.367 0.986 1.00 0.00 O ATOM 44 CB VAL A 4 -14.339 -2.276 2.070 1.00 0.00 C ATOM 45 CG1 VAL A 4 -15.232 -1.869 3.244 1.00 0.00 C ATOM 46 CG2 VAL A 4 -12.939 -1.676 2.212 1.00 0.00 C ATOM 0 H VAL A 4 -12.835 -4.269 3.384 1.00 0.00 H new ATOM 0 HA VAL A 4 -15.279 -4.135 1.688 1.00 0.00 H new ATOM 0 HB VAL A 4 -14.783 -1.877 1.158 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -15.262 -0.782 3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -16.241 -2.250 3.083 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -14.830 -2.285 4.168 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -13.015 -0.593 2.308 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -12.456 -2.085 3.099 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -12.347 -1.922 1.330 1.00 0.00 H new ATOM 56 N GLY A 5 -13.961 -4.514 -0.347 1.00 0.00 N ATOM 57 CA GLY A 5 -13.200 -4.803 -1.550 1.00 0.00 C ATOM 58 C GLY A 5 -13.487 -6.219 -2.054 1.00 0.00 C ATOM 59 O GLY A 5 -13.969 -7.064 -1.301 1.00 0.00 O ATOM 0 H GLY A 5 -14.974 -4.527 -0.470 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -13.451 -4.079 -2.326 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -12.135 -4.695 -1.345 1.00 0.00 H new ATOM 63 N PRO A 6 -13.172 -6.440 -3.358 1.00 0.00 N ATOM 64 CA PRO A 6 -13.391 -7.739 -3.972 1.00 0.00 C ATOM 65 C PRO A 6 -12.338 -8.748 -3.510 1.00 0.00 C ATOM 66 O PRO A 6 -12.665 -9.737 -2.856 1.00 0.00 O ATOM 67 CB PRO A 6 -13.349 -7.480 -5.469 1.00 0.00 C ATOM 68 CG PRO A 6 -12.649 -6.141 -5.640 1.00 0.00 C ATOM 69 CD PRO A 6 -12.600 -5.463 -4.280 1.00 0.00 C ATOM 0 HA PRO A 6 -14.344 -8.184 -3.686 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -12.809 -8.272 -5.988 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -14.354 -7.452 -5.889 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -11.642 -6.284 -6.032 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -13.185 -5.519 -6.357 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -11.578 -5.207 -4.002 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -13.172 -4.535 -4.279 1.00 0.00 H new ATOM 77 N GLY A 7 -11.094 -8.463 -3.868 1.00 0.00 N ATOM 78 CA GLY A 7 -9.991 -9.334 -3.499 1.00 0.00 C ATOM 79 C GLY A 7 -10.035 -9.671 -2.007 1.00 0.00 C ATOM 80 O GLY A 7 -9.608 -10.750 -1.598 1.00 0.00 O ATOM 0 H GLY A 7 -10.826 -7.641 -4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.036 -10.252 -4.085 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.044 -8.850 -3.738 1.00 0.00 H new ATOM 84 N CYS A 8 -10.554 -8.729 -1.235 1.00 0.00 N ATOM 85 CA CYS A 8 -10.659 -8.913 0.203 1.00 0.00 C ATOM 86 C CYS A 8 -11.236 -10.305 0.468 1.00 0.00 C ATOM 87 O CYS A 8 -10.952 -10.912 1.499 1.00 0.00 O ATOM 88 CB CYS A 8 -11.500 -7.813 0.854 1.00 0.00 C ATOM 89 SG CYS A 8 -10.768 -7.077 2.361 1.00 0.00 S ATOM 0 H CYS A 8 -10.907 -7.835 -1.577 1.00 0.00 H new ATOM 0 HA CYS A 8 -9.670 -8.839 0.655 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -11.665 -7.021 0.123 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -12.478 -8.224 1.105 1.00 0.00 H new ATOM 94 N ALA A 9 -12.035 -10.770 -0.481 1.00 0.00 N ATOM 95 CA ALA A 9 -12.654 -12.079 -0.363 1.00 0.00 C ATOM 96 C ALA A 9 -11.680 -13.146 -0.865 1.00 0.00 C ATOM 97 O ALA A 9 -11.150 -13.928 -0.077 1.00 0.00 O ATOM 98 CB ALA A 9 -13.978 -12.089 -1.131 1.00 0.00 C ATOM 0 H ALA A 9 -12.268 -10.263 -1.335 1.00 0.00 H new ATOM 0 HA ALA A 9 -12.880 -12.304 0.679 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -14.443 -13.071 -1.043 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -14.645 -11.333 -0.716 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -13.791 -11.870 -2.182 1.00 0.00 H new ATOM 104 N GLU A 10 -11.474 -13.144 -2.174 1.00 0.00 N ATOM 105 CA GLU A 10 -10.572 -14.103 -2.791 1.00 0.00 C ATOM 106 C GLU A 10 -9.290 -14.232 -1.967 1.00 0.00 C ATOM 107 O GLU A 10 -8.844 -15.341 -1.674 1.00 0.00 O ATOM 108 CB GLU A 10 -10.259 -13.709 -4.235 1.00 0.00 C ATOM 109 CG GLU A 10 -11.373 -14.162 -5.181 1.00 0.00 C ATOM 110 CD GLU A 10 -11.319 -15.674 -5.407 1.00 0.00 C ATOM 111 OE1 GLU A 10 -10.753 -16.405 -4.580 1.00 0.00 O ATOM 112 OE2 GLU A 10 -11.894 -16.085 -6.486 1.00 0.00 O ATOM 0 H GLU A 10 -11.916 -12.494 -2.824 1.00 0.00 H new ATOM 0 HA GLU A 10 -11.065 -15.075 -2.813 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.137 -12.628 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.313 -14.156 -4.541 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.342 -13.887 -4.765 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.277 -13.644 -6.135 1.00 0.00 H new ATOM 120 N TYR A 11 -8.732 -13.083 -1.615 1.00 0.00 N ATOM 121 CA TYR A 11 -7.509 -13.053 -0.831 1.00 0.00 C ATOM 122 C TYR A 11 -7.563 -14.075 0.307 1.00 0.00 C ATOM 123 O TYR A 11 -6.772 -15.016 0.339 1.00 0.00 O ATOM 124 CB TYR A 11 -7.425 -11.647 -0.233 1.00 0.00 C ATOM 125 CG TYR A 11 -6.145 -11.385 0.563 1.00 0.00 C ATOM 126 CD1 TYR A 11 -4.932 -11.297 -0.090 1.00 0.00 C ATOM 127 CD2 TYR A 11 -6.204 -11.235 1.933 1.00 0.00 C ATOM 128 CE1 TYR A 11 -3.728 -11.050 0.659 1.00 0.00 C ATOM 129 CE2 TYR A 11 -4.999 -10.988 2.682 1.00 0.00 C ATOM 130 CZ TYR A 11 -3.820 -10.908 2.008 1.00 0.00 C ATOM 131 OH TYR A 11 -2.683 -10.674 2.716 1.00 0.00 O ATOM 0 H TYR A 11 -9.105 -12.165 -1.859 1.00 0.00 H new ATOM 0 HA TYR A 11 -6.648 -13.294 -1.454 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -7.496 -10.916 -1.038 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -8.285 -11.488 0.418 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -4.886 -11.413 -1.163 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -7.153 -11.303 2.444 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -2.773 -10.979 0.160 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -5.031 -10.869 3.755 1.00 0.00 H new ATOM 0 HH TYR A 11 -2.875 -10.742 3.675 1.00 0.00 H new ATOM 141 N ALA A 12 -8.504 -13.855 1.213 1.00 0.00 N ATOM 142 CA ALA A 12 -8.671 -14.745 2.349 1.00 0.00 C ATOM 143 C ALA A 12 -8.609 -16.196 1.869 1.00 0.00 C ATOM 144 O ALA A 12 -7.837 -16.996 2.396 1.00 0.00 O ATOM 145 CB ALA A 12 -9.987 -14.423 3.061 1.00 0.00 C ATOM 0 H ALA A 12 -9.159 -13.073 1.183 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.866 -14.601 3.070 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -10.112 -15.091 3.913 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -9.969 -13.390 3.409 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -10.818 -14.559 2.369 1.00 0.00 H new ATOM 151 N ALA A 13 -9.432 -16.492 0.873 1.00 0.00 N ATOM 152 CA ALA A 13 -9.479 -17.833 0.315 1.00 0.00 C ATOM 153 C ALA A 13 -8.053 -18.348 0.114 1.00 0.00 C ATOM 154 O ALA A 13 -7.788 -19.537 0.284 1.00 0.00 O ATOM 155 CB ALA A 13 -10.283 -17.816 -0.987 1.00 0.00 C ATOM 0 H ALA A 13 -10.071 -15.826 0.438 1.00 0.00 H new ATOM 0 HA ALA A 13 -9.982 -18.516 1.000 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.318 -18.822 -1.406 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.297 -17.471 -0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -9.807 -17.143 -1.700 1.00 0.00 H new ATOM 161 N ALA A 14 -7.171 -17.427 -0.247 1.00 0.00 N ATOM 162 CA ALA A 14 -5.778 -17.773 -0.474 1.00 0.00 C ATOM 163 C ALA A 14 -5.012 -17.678 0.847 1.00 0.00 C ATOM 164 O ALA A 14 -4.193 -18.542 1.157 1.00 0.00 O ATOM 165 CB ALA A 14 -5.194 -16.860 -1.553 1.00 0.00 C ATOM 0 H ALA A 14 -7.394 -16.442 -0.388 1.00 0.00 H new ATOM 0 HA ALA A 14 -5.691 -18.799 -0.833 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.149 -17.120 -1.723 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -5.755 -16.986 -2.479 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.261 -15.822 -1.227 1.00 0.00 H new ATOM 171 N ASN A 15 -5.305 -16.621 1.590 1.00 0.00 N ATOM 172 CA ASN A 15 -4.654 -16.402 2.870 1.00 0.00 C ATOM 173 C ASN A 15 -5.714 -16.104 3.932 1.00 0.00 C ATOM 174 O ASN A 15 -5.918 -14.949 4.304 1.00 0.00 O ATOM 175 CB ASN A 15 -3.700 -15.208 2.806 1.00 0.00 C ATOM 176 CG ASN A 15 -2.715 -15.354 1.644 1.00 0.00 C ATOM 177 OD1 ASN A 15 -1.659 -15.952 1.763 1.00 0.00 O ATOM 178 ND2 ASN A 15 -3.120 -14.777 0.516 1.00 0.00 N ATOM 0 H ASN A 15 -5.985 -15.907 1.330 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.090 -17.301 3.119 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.272 -14.287 2.689 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.151 -15.126 3.744 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -2.534 -14.820 -0.318 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.017 -14.292 0.485 1.00 0.00 H new ATOM 185 N PRO A 16 -6.378 -17.193 4.403 1.00 0.00 N ATOM 186 CA PRO A 16 -7.413 -17.059 5.415 1.00 0.00 C ATOM 187 C PRO A 16 -6.801 -16.794 6.792 1.00 0.00 C ATOM 188 O PRO A 16 -7.408 -16.123 7.626 1.00 0.00 O ATOM 189 CB PRO A 16 -8.194 -18.361 5.353 1.00 0.00 C ATOM 190 CG PRO A 16 -7.292 -19.355 4.641 1.00 0.00 C ATOM 191 CD PRO A 16 -6.164 -18.575 3.986 1.00 0.00 C ATOM 0 HA PRO A 16 -8.069 -16.207 5.236 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.449 -18.712 6.353 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -9.132 -18.229 4.813 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.893 -20.082 5.348 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.855 -19.913 3.893 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.190 -18.940 4.311 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -6.195 -18.670 2.901 1.00 0.00 H new ATOM 199 N THR A 17 -5.607 -17.333 6.988 1.00 0.00 N ATOM 200 CA THR A 17 -4.907 -17.164 8.250 1.00 0.00 C ATOM 201 C THR A 17 -3.476 -16.680 8.005 1.00 0.00 C ATOM 202 O THR A 17 -3.182 -16.105 6.958 1.00 0.00 O ATOM 203 CB THR A 17 -4.979 -18.488 9.012 1.00 0.00 C ATOM 204 OG1 THR A 17 -4.279 -19.408 8.178 1.00 0.00 O ATOM 205 CG2 THR A 17 -6.400 -19.050 9.077 1.00 0.00 C ATOM 0 H THR A 17 -5.106 -17.887 6.294 1.00 0.00 H new ATOM 0 HA THR A 17 -5.376 -16.395 8.863 1.00 0.00 H new ATOM 0 HB THR A 17 -4.599 -18.345 10.024 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.276 -20.293 8.598 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.395 -19.990 9.629 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.051 -18.336 9.583 1.00 0.00 H new ATOM 0 HG23 THR A 17 -6.769 -19.224 8.066 1.00 0.00 H new ATOM 213 N GLY A 18 -2.624 -16.933 8.987 1.00 0.00 N ATOM 214 CA GLY A 18 -1.231 -16.531 8.891 1.00 0.00 C ATOM 215 C GLY A 18 -1.071 -15.035 9.170 1.00 0.00 C ATOM 216 O GLY A 18 -2.054 -14.338 9.419 1.00 0.00 O ATOM 0 H GLY A 18 -2.871 -17.411 9.853 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -0.634 -17.103 9.601 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.850 -16.762 7.896 1.00 0.00 H new ATOM 220 N PRO A 19 0.207 -14.573 9.118 1.00 0.00 N ATOM 221 CA PRO A 19 0.508 -13.173 9.362 1.00 0.00 C ATOM 222 C PRO A 19 0.111 -12.310 8.162 1.00 0.00 C ATOM 223 O PRO A 19 0.127 -11.083 8.244 1.00 0.00 O ATOM 224 CB PRO A 19 1.999 -13.136 9.653 1.00 0.00 C ATOM 225 CG PRO A 19 2.563 -14.438 9.107 1.00 0.00 C ATOM 226 CD PRO A 19 1.395 -15.370 8.827 1.00 0.00 C ATOM 0 HA PRO A 19 -0.057 -12.760 10.198 1.00 0.00 H new ATOM 0 HB2 PRO A 19 2.469 -12.276 9.175 1.00 0.00 H new ATOM 0 HB3 PRO A 19 2.186 -13.048 10.723 1.00 0.00 H new ATOM 0 HG2 PRO A 19 3.132 -14.255 8.196 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.247 -14.889 9.826 1.00 0.00 H new ATOM 0 HD2 PRO A 19 1.400 -15.711 7.792 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.439 -16.260 9.455 1.00 0.00 H new ATOM 234 N ALA A 20 -0.237 -12.986 7.077 1.00 0.00 N ATOM 235 CA ALA A 20 -0.637 -12.296 5.862 1.00 0.00 C ATOM 236 C ALA A 20 -2.154 -12.100 5.869 1.00 0.00 C ATOM 237 O ALA A 20 -2.748 -11.787 4.839 1.00 0.00 O ATOM 238 CB ALA A 20 -0.157 -13.088 4.644 1.00 0.00 C ATOM 0 H ALA A 20 -0.250 -14.004 7.014 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.177 -11.309 5.811 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.457 -12.571 3.733 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.929 -13.175 4.671 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.601 -14.083 4.659 1.00 0.00 H new ATOM 244 N SER A 21 -2.739 -12.292 7.043 1.00 0.00 N ATOM 245 CA SER A 21 -4.175 -12.139 7.198 1.00 0.00 C ATOM 246 C SER A 21 -4.505 -10.714 7.646 1.00 0.00 C ATOM 247 O SER A 21 -3.621 -9.975 8.077 1.00 0.00 O ATOM 248 CB SER A 21 -4.732 -13.153 8.200 1.00 0.00 C ATOM 249 OG SER A 21 -4.088 -13.060 9.467 1.00 0.00 O ATOM 0 H SER A 21 -2.244 -12.552 7.896 1.00 0.00 H new ATOM 0 HA SER A 21 -4.645 -12.327 6.233 1.00 0.00 H new ATOM 0 HB2 SER A 21 -5.802 -12.989 8.324 1.00 0.00 H new ATOM 0 HB3 SER A 21 -4.608 -14.161 7.803 1.00 0.00 H new ATOM 0 HG SER A 21 -3.517 -13.845 9.602 1.00 0.00 H new ATOM 255 N VAL A 22 -5.780 -10.371 7.530 1.00 0.00 N ATOM 256 CA VAL A 22 -6.237 -9.048 7.918 1.00 0.00 C ATOM 257 C VAL A 22 -6.004 -8.852 9.417 1.00 0.00 C ATOM 258 O VAL A 22 -5.763 -7.734 9.870 1.00 0.00 O ATOM 259 CB VAL A 22 -7.700 -8.860 7.510 1.00 0.00 C ATOM 260 CG1 VAL A 22 -7.888 -9.107 6.012 1.00 0.00 C ATOM 261 CG2 VAL A 22 -8.619 -9.762 8.335 1.00 0.00 C ATOM 0 H VAL A 22 -6.510 -10.987 7.173 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.667 -8.279 7.398 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.975 -7.825 7.715 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.936 -8.967 5.749 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.275 -8.404 5.448 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -7.587 -10.126 5.771 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -9.653 -9.609 8.025 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -8.343 -10.805 8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.517 -9.516 9.392 1.00 0.00 H new ATOM 271 N GLN A 23 -6.084 -9.956 10.145 1.00 0.00 N ATOM 272 CA GLN A 23 -5.885 -9.919 11.584 1.00 0.00 C ATOM 273 C GLN A 23 -4.453 -10.333 11.933 1.00 0.00 C ATOM 274 O GLN A 23 -3.777 -9.655 12.704 1.00 0.00 O ATOM 275 CB GLN A 23 -6.903 -10.807 12.302 1.00 0.00 C ATOM 276 CG GLN A 23 -6.809 -10.634 13.819 1.00 0.00 C ATOM 277 CD GLN A 23 -8.036 -11.226 14.515 1.00 0.00 C ATOM 278 OE1 GLN A 23 -9.168 -10.848 14.263 1.00 0.00 O ATOM 279 NE2 GLN A 23 -7.749 -12.174 15.403 1.00 0.00 N ATOM 0 H GLN A 23 -6.284 -10.881 9.766 1.00 0.00 H new ATOM 0 HA GLN A 23 -6.040 -8.896 11.926 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -7.909 -10.557 11.966 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -6.729 -11.851 12.040 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -5.906 -11.121 14.189 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -6.723 -9.575 14.063 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -6.779 -12.443 15.566 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -8.499 -12.632 15.921 1.00 0.00 H new ATOM 288 N GLY A 24 -4.034 -11.445 11.347 1.00 0.00 N ATOM 289 CA GLY A 24 -2.696 -11.958 11.586 1.00 0.00 C ATOM 290 C GLY A 24 -1.643 -10.874 11.347 1.00 0.00 C ATOM 291 O GLY A 24 -0.528 -10.964 11.860 1.00 0.00 O ATOM 0 H GLY A 24 -4.598 -12.005 10.707 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.620 -12.324 12.610 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.505 -12.807 10.929 1.00 0.00 H new ATOM 295 N MET A 25 -2.033 -9.876 10.569 1.00 0.00 N ATOM 296 CA MET A 25 -1.137 -8.776 10.257 1.00 0.00 C ATOM 297 C MET A 25 -1.299 -7.633 11.261 1.00 0.00 C ATOM 298 O MET A 25 -0.435 -6.764 11.364 1.00 0.00 O ATOM 299 CB MET A 25 -1.432 -8.261 8.846 1.00 0.00 C ATOM 300 CG MET A 25 -2.704 -7.411 8.828 1.00 0.00 C ATOM 301 SD MET A 25 -2.873 -6.599 7.247 1.00 0.00 S ATOM 302 CE MET A 25 -3.004 -8.024 6.180 1.00 0.00 C ATOM 0 H MET A 25 -2.958 -9.806 10.145 1.00 0.00 H new ATOM 0 HA MET A 25 -0.112 -9.141 10.314 1.00 0.00 H new ATOM 0 HB2 MET A 25 -0.590 -7.669 8.487 1.00 0.00 H new ATOM 0 HB3 MET A 25 -1.543 -9.103 8.163 1.00 0.00 H new ATOM 0 HG2 MET A 25 -3.574 -8.039 9.018 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.667 -6.669 9.625 1.00 0.00 H new ATOM 0 HE1 MET A 25 -3.170 -7.696 5.154 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.082 -8.603 6.232 1.00 0.00 H new ATOM 0 HE3 MET A 25 -3.841 -8.644 6.502 1.00 0.00 H new ATOM 312 N SER A 26 -2.413 -7.672 11.978 1.00 0.00 N ATOM 313 CA SER A 26 -2.700 -6.651 12.971 1.00 0.00 C ATOM 314 C SER A 26 -1.624 -6.662 14.059 1.00 0.00 C ATOM 315 O SER A 26 -1.243 -5.611 14.570 1.00 0.00 O ATOM 316 CB SER A 26 -4.083 -6.858 13.590 1.00 0.00 C ATOM 317 OG SER A 26 -4.868 -5.669 13.554 1.00 0.00 O ATOM 0 H SER A 26 -3.127 -8.395 11.891 1.00 0.00 H new ATOM 0 HA SER A 26 -2.696 -5.681 12.475 1.00 0.00 H new ATOM 0 HB2 SER A 26 -4.604 -7.653 13.056 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.972 -7.188 14.623 1.00 0.00 H new ATOM 0 HG SER A 26 -4.319 -4.906 13.832 1.00 0.00 H new ATOM 323 N GLN A 27 -1.165 -7.863 14.380 1.00 0.00 N ATOM 324 CA GLN A 27 -0.141 -8.025 15.398 1.00 0.00 C ATOM 325 C GLN A 27 1.203 -7.504 14.886 1.00 0.00 C ATOM 326 O GLN A 27 2.145 -7.339 15.660 1.00 0.00 O ATOM 327 CB GLN A 27 -0.031 -9.486 15.837 1.00 0.00 C ATOM 328 CG GLN A 27 -1.364 -9.995 16.389 1.00 0.00 C ATOM 329 CD GLN A 27 -1.663 -11.409 15.887 1.00 0.00 C ATOM 330 OE1 GLN A 27 -2.121 -11.617 14.775 1.00 0.00 O ATOM 331 NE2 GLN A 27 -1.378 -12.366 16.765 1.00 0.00 N ATOM 0 H GLN A 27 -1.483 -8.733 13.953 1.00 0.00 H new ATOM 0 HA GLN A 27 -0.428 -7.438 16.271 1.00 0.00 H new ATOM 0 HB2 GLN A 27 0.275 -10.101 14.991 1.00 0.00 H new ATOM 0 HB3 GLN A 27 0.743 -9.583 16.598 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -1.335 -9.991 17.479 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -2.167 -9.322 16.089 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -0.997 -12.122 17.679 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -1.541 -13.344 16.524 1.00 0.00 H new ATOM 340 N ASP A 28 1.250 -7.259 13.584 1.00 0.00 N ATOM 341 CA ASP A 28 2.463 -6.760 12.960 1.00 0.00 C ATOM 342 C ASP A 28 2.364 -5.241 12.805 1.00 0.00 C ATOM 343 O ASP A 28 1.286 -4.709 12.542 1.00 0.00 O ATOM 344 CB ASP A 28 2.656 -7.366 11.568 1.00 0.00 C ATOM 345 CG ASP A 28 2.880 -8.879 11.547 1.00 0.00 C ATOM 346 OD1 ASP A 28 3.865 -9.387 12.103 1.00 0.00 O ATOM 347 OD2 ASP A 28 1.979 -9.555 10.919 1.00 0.00 O ATOM 0 H ASP A 28 0.467 -7.397 12.945 1.00 0.00 H new ATOM 0 HA ASP A 28 3.306 -7.036 13.593 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.779 -7.135 10.963 1.00 0.00 H new ATOM 0 HB3 ASP A 28 3.508 -6.881 11.092 1.00 0.00 H new ATOM 353 N PRO A 29 3.533 -4.568 12.979 1.00 0.00 N ATOM 354 CA PRO A 29 3.588 -3.121 12.861 1.00 0.00 C ATOM 355 C PRO A 29 3.516 -2.687 11.395 1.00 0.00 C ATOM 356 O PRO A 29 4.531 -2.662 10.701 1.00 0.00 O ATOM 357 CB PRO A 29 4.890 -2.720 13.535 1.00 0.00 C ATOM 358 CG PRO A 29 5.735 -3.982 13.593 1.00 0.00 C ATOM 359 CD PRO A 29 4.828 -5.164 13.291 1.00 0.00 C ATOM 0 HA PRO A 29 2.740 -2.628 13.337 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.396 -1.936 12.971 1.00 0.00 H new ATOM 0 HB3 PRO A 29 4.707 -2.326 14.535 1.00 0.00 H new ATOM 0 HG2 PRO A 29 6.549 -3.930 12.869 1.00 0.00 H new ATOM 0 HG3 PRO A 29 6.190 -4.092 14.577 1.00 0.00 H new ATOM 0 HD2 PRO A 29 5.206 -5.749 12.453 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.758 -5.838 14.145 1.00 0.00 H new ATOM 367 N VAL A 30 2.306 -2.356 10.968 1.00 0.00 N ATOM 368 CA VAL A 30 2.089 -1.925 9.597 1.00 0.00 C ATOM 369 C VAL A 30 3.136 -2.575 8.690 1.00 0.00 C ATOM 370 O VAL A 30 3.090 -3.780 8.449 1.00 0.00 O ATOM 371 CB VAL A 30 2.099 -0.396 9.522 1.00 0.00 C ATOM 372 CG1 VAL A 30 3.353 0.177 10.186 1.00 0.00 C ATOM 373 CG2 VAL A 30 1.977 0.082 8.074 1.00 0.00 C ATOM 0 H VAL A 30 1.466 -2.378 11.547 1.00 0.00 H new ATOM 0 HA VAL A 30 1.109 -2.249 9.245 1.00 0.00 H new ATOM 0 HB VAL A 30 1.232 -0.027 10.070 1.00 0.00 H new ATOM 0 HG11 VAL A 30 3.335 1.265 10.119 1.00 0.00 H new ATOM 0 HG12 VAL A 30 3.379 -0.122 11.234 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.240 -0.203 9.679 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.987 1.172 8.049 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.815 -0.302 7.492 1.00 0.00 H new ATOM 0 HG23 VAL A 30 1.042 -0.283 7.648 1.00 0.00 H new ATOM 383 N ALA A 31 4.054 -1.748 8.213 1.00 0.00 N ATOM 384 CA ALA A 31 5.110 -2.227 7.338 1.00 0.00 C ATOM 385 C ALA A 31 5.117 -3.757 7.344 1.00 0.00 C ATOM 386 O ALA A 31 4.754 -4.387 6.353 1.00 0.00 O ATOM 387 CB ALA A 31 6.449 -1.635 7.782 1.00 0.00 C ATOM 0 H ALA A 31 4.088 -0.749 8.416 1.00 0.00 H new ATOM 0 HA ALA A 31 4.935 -1.903 6.312 1.00 0.00 H new ATOM 0 HB1 ALA A 31 7.241 -1.994 7.125 1.00 0.00 H new ATOM 0 HB2 ALA A 31 6.401 -0.547 7.731 1.00 0.00 H new ATOM 0 HB3 ALA A 31 6.660 -1.941 8.807 1.00 0.00 H new ATOM 393 N VAL A 32 5.535 -4.310 8.474 1.00 0.00 N ATOM 394 CA VAL A 32 5.594 -5.754 8.623 1.00 0.00 C ATOM 395 C VAL A 32 4.354 -6.380 7.982 1.00 0.00 C ATOM 396 O VAL A 32 4.457 -7.083 6.979 1.00 0.00 O ATOM 397 CB VAL A 32 5.755 -6.121 10.100 1.00 0.00 C ATOM 398 CG1 VAL A 32 5.636 -7.633 10.304 1.00 0.00 C ATOM 399 CG2 VAL A 32 7.080 -5.595 10.655 1.00 0.00 C ATOM 0 H VAL A 32 5.836 -3.784 9.294 1.00 0.00 H new ATOM 0 HA VAL A 32 6.465 -6.157 8.105 1.00 0.00 H new ATOM 0 HB VAL A 32 4.947 -5.643 10.654 1.00 0.00 H new ATOM 0 HG11 VAL A 32 5.754 -7.868 11.362 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.657 -7.970 9.965 1.00 0.00 H new ATOM 0 HG13 VAL A 32 6.413 -8.140 9.731 1.00 0.00 H new ATOM 0 HG21 VAL A 32 7.169 -5.870 11.706 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.908 -6.030 10.095 1.00 0.00 H new ATOM 0 HG23 VAL A 32 7.109 -4.510 10.560 1.00 0.00 H new ATOM 409 N ALA A 33 3.209 -6.101 8.589 1.00 0.00 N ATOM 410 CA ALA A 33 1.951 -6.628 8.090 1.00 0.00 C ATOM 411 C ALA A 33 2.026 -6.763 6.568 1.00 0.00 C ATOM 412 O ALA A 33 1.589 -7.767 6.008 1.00 0.00 O ATOM 413 CB ALA A 33 0.804 -5.720 8.539 1.00 0.00 C ATOM 0 H ALA A 33 3.127 -5.517 9.421 1.00 0.00 H new ATOM 0 HA ALA A 33 1.762 -7.620 8.499 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -0.141 -6.115 8.165 1.00 0.00 H new ATOM 0 HB2 ALA A 33 0.775 -5.682 9.628 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.959 -4.716 8.144 1.00 0.00 H new ATOM 419 N ALA A 34 2.584 -5.737 5.942 1.00 0.00 N ATOM 420 CA ALA A 34 2.722 -5.729 4.496 1.00 0.00 C ATOM 421 C ALA A 34 3.676 -6.848 4.072 1.00 0.00 C ATOM 422 O ALA A 34 3.302 -7.728 3.299 1.00 0.00 O ATOM 423 CB ALA A 34 3.201 -4.350 4.036 1.00 0.00 C ATOM 0 H ALA A 34 2.946 -4.906 6.410 1.00 0.00 H new ATOM 0 HA ALA A 34 1.760 -5.917 4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 34 3.305 -4.344 2.951 1.00 0.00 H new ATOM 0 HB2 ALA A 34 2.475 -3.594 4.335 1.00 0.00 H new ATOM 0 HB3 ALA A 34 4.165 -4.128 4.494 1.00 0.00 H new ATOM 429 N SER A 35 4.890 -6.778 4.599 1.00 0.00 N ATOM 430 CA SER A 35 5.901 -7.774 4.285 1.00 0.00 C ATOM 431 C SER A 35 5.291 -9.175 4.348 1.00 0.00 C ATOM 432 O SER A 35 5.773 -10.096 3.689 1.00 0.00 O ATOM 433 CB SER A 35 7.091 -7.670 5.240 1.00 0.00 C ATOM 434 OG SER A 35 8.236 -8.359 4.743 1.00 0.00 O ATOM 0 H SER A 35 5.196 -6.047 5.241 1.00 0.00 H new ATOM 0 HA SER A 35 6.264 -7.587 3.274 1.00 0.00 H new ATOM 0 HB2 SER A 35 7.339 -6.620 5.397 1.00 0.00 H new ATOM 0 HB3 SER A 35 6.814 -8.081 6.211 1.00 0.00 H new ATOM 0 HG SER A 35 8.975 -8.268 5.380 1.00 0.00 H new ATOM 440 N ASN A 36 4.239 -9.294 5.145 1.00 0.00 N ATOM 441 CA ASN A 36 3.558 -10.568 5.302 1.00 0.00 C ATOM 442 C ASN A 36 2.622 -10.790 4.113 1.00 0.00 C ATOM 443 O ASN A 36 2.639 -11.854 3.496 1.00 0.00 O ATOM 444 CB ASN A 36 2.715 -10.588 6.578 1.00 0.00 C ATOM 445 CG ASN A 36 3.551 -10.184 7.795 1.00 0.00 C ATOM 446 OD1 ASN A 36 3.159 -9.359 8.604 1.00 0.00 O ATOM 447 ND2 ASN A 36 4.721 -10.810 7.878 1.00 0.00 N ATOM 0 H ASN A 36 3.841 -8.528 5.689 1.00 0.00 H new ATOM 0 HA ASN A 36 4.315 -11.351 5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 36 1.870 -9.907 6.471 1.00 0.00 H new ATOM 0 HB3 ASN A 36 2.303 -11.586 6.730 1.00 0.00 H new ATOM 0 HD21 ASN A 36 5.352 -10.610 8.654 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.987 -11.490 7.166 1.00 0.00 H new ATOM 454 N ASN A 37 1.827 -9.769 3.827 1.00 0.00 N ATOM 455 CA ASN A 37 0.831 -9.868 2.774 1.00 0.00 C ATOM 456 C ASN A 37 1.505 -10.340 1.484 1.00 0.00 C ATOM 457 O ASN A 37 2.526 -9.790 1.075 1.00 0.00 O ATOM 458 CB ASN A 37 0.183 -8.510 2.499 1.00 0.00 C ATOM 459 CG ASN A 37 -1.228 -8.680 1.934 1.00 0.00 C ATOM 460 OD1 ASN A 37 -1.436 -9.248 0.874 1.00 0.00 O ATOM 461 ND2 ASN A 37 -2.184 -8.158 2.698 1.00 0.00 N ATOM 0 H ASN A 37 1.853 -8.869 4.306 1.00 0.00 H new ATOM 0 HA ASN A 37 0.066 -10.573 3.099 1.00 0.00 H new ATOM 0 HB2 ASN A 37 0.142 -7.929 3.421 1.00 0.00 H new ATOM 0 HB3 ASN A 37 0.795 -7.947 1.795 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -3.160 -8.220 2.408 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -1.941 -7.696 3.574 1.00 0.00 H new ATOM 468 N PRO A 38 0.889 -11.382 0.862 1.00 0.00 N ATOM 469 CA PRO A 38 1.418 -11.934 -0.374 1.00 0.00 C ATOM 470 C PRO A 38 1.125 -11.009 -1.557 1.00 0.00 C ATOM 471 O PRO A 38 1.441 -11.338 -2.699 1.00 0.00 O ATOM 472 CB PRO A 38 0.760 -13.298 -0.508 1.00 0.00 C ATOM 473 CG PRO A 38 -0.456 -13.265 0.403 1.00 0.00 C ATOM 474 CD PRO A 38 -0.322 -12.058 1.317 1.00 0.00 C ATOM 0 HA PRO A 38 2.504 -12.030 -0.362 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.469 -13.492 -1.541 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.446 -14.093 -0.215 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.371 -13.199 -0.185 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.519 -14.182 0.989 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -1.192 -11.406 1.242 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -0.239 -12.359 2.361 1.00 0.00 H new ATOM 482 N GLU A 39 0.526 -9.871 -1.243 1.00 0.00 N ATOM 483 CA GLU A 39 0.187 -8.896 -2.266 1.00 0.00 C ATOM 484 C GLU A 39 0.866 -7.557 -1.969 1.00 0.00 C ATOM 485 O GLU A 39 0.763 -6.617 -2.756 1.00 0.00 O ATOM 486 CB GLU A 39 -1.329 -8.728 -2.383 1.00 0.00 C ATOM 487 CG GLU A 39 -2.013 -10.075 -2.628 1.00 0.00 C ATOM 488 CD GLU A 39 -2.656 -10.118 -4.015 1.00 0.00 C ATOM 489 OE1 GLU A 39 -2.942 -9.062 -4.600 1.00 0.00 O ATOM 490 OE2 GLU A 39 -2.857 -11.302 -4.486 1.00 0.00 O ATOM 0 H GLU A 39 0.266 -9.601 -0.294 1.00 0.00 H new ATOM 0 HA GLU A 39 0.554 -9.262 -3.225 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.720 -8.278 -1.470 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.561 -8.045 -3.200 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.283 -10.880 -2.536 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.773 -10.245 -1.865 1.00 0.00 H new ATOM 498 N LEU A 40 1.545 -7.514 -0.832 1.00 0.00 N ATOM 499 CA LEU A 40 2.240 -6.306 -0.422 1.00 0.00 C ATOM 500 C LEU A 40 3.743 -6.584 -0.359 1.00 0.00 C ATOM 501 O LEU A 40 4.554 -5.699 -0.627 1.00 0.00 O ATOM 502 CB LEU A 40 1.659 -5.771 0.888 1.00 0.00 C ATOM 503 CG LEU A 40 0.134 -5.663 0.950 1.00 0.00 C ATOM 504 CD1 LEU A 40 -0.312 -4.909 2.204 1.00 0.00 C ATOM 505 CD2 LEU A 40 -0.424 -5.031 -0.327 1.00 0.00 C ATOM 0 H LEU A 40 1.629 -8.296 -0.182 1.00 0.00 H new ATOM 0 HA LEU A 40 2.092 -5.514 -1.156 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.991 -6.417 1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.081 -4.783 1.073 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.277 -6.670 1.017 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.400 -4.847 2.223 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.037 -5.439 3.090 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.109 -3.904 2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.510 -4.966 -0.256 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.008 -4.031 -0.450 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.152 -5.645 -1.186 1.00 0.00 H new ATOM 517 N THR A 41 4.070 -7.818 -0.004 1.00 0.00 N ATOM 518 CA THR A 41 5.461 -8.225 0.097 1.00 0.00 C ATOM 519 C THR A 41 6.310 -7.481 -0.936 1.00 0.00 C ATOM 520 O THR A 41 7.436 -7.078 -0.645 1.00 0.00 O ATOM 521 CB THR A 41 5.521 -9.746 -0.048 1.00 0.00 C ATOM 522 OG1 THR A 41 4.545 -10.039 -1.044 1.00 0.00 O ATOM 523 CG2 THR A 41 5.012 -10.474 1.197 1.00 0.00 C ATOM 0 H THR A 41 3.395 -8.550 0.217 1.00 0.00 H new ATOM 0 HA THR A 41 5.881 -7.961 1.068 1.00 0.00 H new ATOM 0 HB THR A 41 6.548 -10.050 -0.252 1.00 0.00 H new ATOM 0 HG1 THR A 41 4.519 -11.006 -1.202 1.00 0.00 H new ATOM 0 HG21 THR A 41 5.076 -11.551 1.041 1.00 0.00 H new ATOM 0 HG22 THR A 41 5.622 -10.195 2.056 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.975 -10.196 1.383 1.00 0.00 H new ATOM 531 N THR A 42 5.739 -7.323 -2.120 1.00 0.00 N ATOM 532 CA THR A 42 6.430 -6.635 -3.198 1.00 0.00 C ATOM 533 C THR A 42 6.690 -5.176 -2.820 1.00 0.00 C ATOM 534 O THR A 42 7.837 -4.732 -2.796 1.00 0.00 O ATOM 535 CB THR A 42 5.596 -6.794 -4.471 1.00 0.00 C ATOM 536 OG1 THR A 42 5.799 -8.151 -4.853 1.00 0.00 O ATOM 537 CG2 THR A 42 6.159 -5.989 -5.644 1.00 0.00 C ATOM 0 H THR A 42 4.806 -7.659 -2.357 1.00 0.00 H new ATOM 0 HA THR A 42 7.413 -7.070 -3.379 1.00 0.00 H new ATOM 0 HB THR A 42 4.571 -6.481 -4.274 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.292 -8.340 -5.670 1.00 0.00 H new ATOM 0 HG21 THR A 42 5.530 -6.137 -6.522 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.176 -4.931 -5.384 1.00 0.00 H new ATOM 0 HG23 THR A 42 7.173 -6.325 -5.863 1.00 0.00 H new ATOM 545 N LEU A 43 5.606 -4.470 -2.533 1.00 0.00 N ATOM 546 CA LEU A 43 5.702 -3.070 -2.157 1.00 0.00 C ATOM 547 C LEU A 43 6.595 -2.938 -0.922 1.00 0.00 C ATOM 548 O LEU A 43 7.437 -2.044 -0.853 1.00 0.00 O ATOM 549 CB LEU A 43 4.308 -2.467 -1.975 1.00 0.00 C ATOM 550 CG LEU A 43 3.996 -1.907 -0.585 1.00 0.00 C ATOM 551 CD1 LEU A 43 3.480 -0.470 -0.677 1.00 0.00 C ATOM 552 CD2 LEU A 43 3.024 -2.818 0.167 1.00 0.00 C ATOM 0 H LEU A 43 4.656 -4.842 -2.553 1.00 0.00 H new ATOM 0 HA LEU A 43 6.172 -2.493 -2.954 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.182 -1.667 -2.704 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.569 -3.233 -2.211 1.00 0.00 H new ATOM 0 HG LEU A 43 4.922 -1.881 -0.011 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.266 -0.096 0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.237 0.159 -1.145 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.569 -0.448 -1.275 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.819 -2.397 1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.093 -2.899 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.467 -3.808 0.280 1.00 0.00 H new ATOM 564 N THR A 44 6.381 -3.843 0.023 1.00 0.00 N ATOM 565 CA THR A 44 7.157 -3.839 1.252 1.00 0.00 C ATOM 566 C THR A 44 8.650 -3.726 0.939 1.00 0.00 C ATOM 567 O THR A 44 9.313 -2.792 1.387 1.00 0.00 O ATOM 568 CB THR A 44 6.795 -5.097 2.043 1.00 0.00 C ATOM 569 OG1 THR A 44 5.392 -4.978 2.261 1.00 0.00 O ATOM 570 CG2 THR A 44 7.393 -5.096 3.451 1.00 0.00 C ATOM 0 H THR A 44 5.682 -4.583 -0.038 1.00 0.00 H new ATOM 0 HA THR A 44 6.920 -2.971 1.868 1.00 0.00 H new ATOM 0 HB THR A 44 7.142 -5.978 1.503 1.00 0.00 H new ATOM 0 HG1 THR A 44 4.940 -5.779 1.924 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.105 -6.011 3.969 1.00 0.00 H new ATOM 0 HG22 THR A 44 8.480 -5.043 3.385 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.021 -4.234 4.004 1.00 0.00 H new ATOM 578 N ALA A 45 9.137 -4.692 0.174 1.00 0.00 N ATOM 579 CA ALA A 45 10.540 -4.713 -0.204 1.00 0.00 C ATOM 580 C ALA A 45 10.999 -3.289 -0.524 1.00 0.00 C ATOM 581 O ALA A 45 12.139 -2.922 -0.243 1.00 0.00 O ATOM 582 CB ALA A 45 10.738 -5.668 -1.382 1.00 0.00 C ATOM 0 H ALA A 45 8.585 -5.466 -0.195 1.00 0.00 H new ATOM 0 HA ALA A 45 11.153 -5.080 0.619 1.00 0.00 H new ATOM 0 HB1 ALA A 45 11.790 -5.683 -1.665 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.425 -6.671 -1.093 1.00 0.00 H new ATOM 0 HB3 ALA A 45 10.140 -5.331 -2.228 1.00 0.00 H new ATOM 588 N ALA A 46 10.087 -2.525 -1.108 1.00 0.00 N ATOM 589 CA ALA A 46 10.384 -1.150 -1.470 1.00 0.00 C ATOM 590 C ALA A 46 10.554 -0.317 -0.198 1.00 0.00 C ATOM 591 O ALA A 46 11.666 0.081 0.144 1.00 0.00 O ATOM 592 CB ALA A 46 9.276 -0.610 -2.377 1.00 0.00 C ATOM 0 H ALA A 46 9.142 -2.833 -1.339 1.00 0.00 H new ATOM 0 HA ALA A 46 11.319 -1.094 -2.028 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.499 0.422 -2.649 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.216 -1.218 -3.280 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.323 -0.649 -1.850 1.00 0.00 H new ATOM 598 N LEU A 47 9.434 -0.080 0.469 1.00 0.00 N ATOM 599 CA LEU A 47 9.444 0.698 1.697 1.00 0.00 C ATOM 600 C LEU A 47 10.580 0.206 2.597 1.00 0.00 C ATOM 601 O LEU A 47 11.499 0.961 2.911 1.00 0.00 O ATOM 602 CB LEU A 47 8.069 0.661 2.366 1.00 0.00 C ATOM 603 CG LEU A 47 7.237 -0.599 2.121 1.00 0.00 C ATOM 604 CD1 LEU A 47 6.905 -1.303 3.438 1.00 0.00 C ATOM 605 CD2 LEU A 47 5.980 -0.277 1.311 1.00 0.00 C ATOM 0 H LEU A 47 8.513 -0.413 0.183 1.00 0.00 H new ATOM 0 HA LEU A 47 9.639 1.749 1.481 1.00 0.00 H new ATOM 0 HB2 LEU A 47 8.207 0.778 3.441 1.00 0.00 H new ATOM 0 HB3 LEU A 47 7.497 1.523 2.022 1.00 0.00 H new ATOM 0 HG LEU A 47 7.834 -1.292 1.528 1.00 0.00 H new ATOM 0 HD11 LEU A 47 6.313 -2.195 3.234 1.00 0.00 H new ATOM 0 HD12 LEU A 47 7.829 -1.588 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 47 6.336 -0.628 4.078 1.00 0.00 H new ATOM 0 HD21 LEU A 47 5.407 -1.190 1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.370 0.443 1.856 1.00 0.00 H new ATOM 0 HD23 LEU A 47 6.266 0.145 0.348 1.00 0.00 H new ATOM 617 N SER A 48 10.479 -1.056 2.987 1.00 0.00 N ATOM 618 CA SER A 48 11.486 -1.657 3.845 1.00 0.00 C ATOM 619 C SER A 48 12.885 -1.262 3.366 1.00 0.00 C ATOM 620 O SER A 48 13.692 -0.758 4.145 1.00 0.00 O ATOM 621 CB SER A 48 11.346 -3.180 3.876 1.00 0.00 C ATOM 622 OG SER A 48 11.287 -3.737 2.566 1.00 0.00 O ATOM 0 H SER A 48 9.715 -1.679 2.725 1.00 0.00 H new ATOM 0 HA SER A 48 11.337 -1.285 4.859 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.190 -3.611 4.416 1.00 0.00 H new ATOM 0 HB3 SER A 48 10.444 -3.450 4.426 1.00 0.00 H new ATOM 0 HG SER A 48 10.762 -3.149 1.984 1.00 0.00 H new ATOM 628 N GLY A 49 13.128 -1.506 2.086 1.00 0.00 N ATOM 629 CA GLY A 49 14.415 -1.183 1.494 1.00 0.00 C ATOM 630 C GLY A 49 14.945 -2.352 0.662 1.00 0.00 C ATOM 631 O GLY A 49 15.790 -2.165 -0.211 1.00 0.00 O ATOM 0 H GLY A 49 12.455 -1.923 1.443 1.00 0.00 H new ATOM 0 HA2 GLY A 49 14.318 -0.299 0.864 1.00 0.00 H new ATOM 0 HA3 GLY A 49 15.129 -0.938 2.280 1.00 0.00 H new ATOM 635 N GLN A 50 14.426 -3.534 0.963 1.00 0.00 N ATOM 636 CA GLN A 50 14.837 -4.734 0.254 1.00 0.00 C ATOM 637 C GLN A 50 15.059 -4.425 -1.228 1.00 0.00 C ATOM 638 O GLN A 50 15.878 -5.067 -1.884 1.00 0.00 O ATOM 639 CB GLN A 50 13.810 -5.854 0.432 1.00 0.00 C ATOM 640 CG GLN A 50 13.536 -6.116 1.915 1.00 0.00 C ATOM 641 CD GLN A 50 13.142 -7.575 2.150 1.00 0.00 C ATOM 642 OE1 GLN A 50 12.548 -8.228 1.309 1.00 0.00 O ATOM 643 NE2 GLN A 50 13.506 -8.049 3.339 1.00 0.00 N ATOM 0 H GLN A 50 13.725 -3.686 1.688 1.00 0.00 H new ATOM 0 HA GLN A 50 15.780 -5.079 0.679 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.881 -5.584 -0.071 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.175 -6.766 -0.041 1.00 0.00 H new ATOM 0 HG2 GLN A 50 14.424 -5.876 2.500 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.738 -5.460 2.263 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.002 -7.448 3.998 1.00 0.00 H new ATOM 0 HE22 GLN A 50 13.289 -9.013 3.592 1.00 0.00 H new ATOM 652 N LEU A 51 14.315 -3.441 -1.713 1.00 0.00 N ATOM 653 CA LEU A 51 14.420 -3.039 -3.105 1.00 0.00 C ATOM 654 C LEU A 51 15.610 -2.092 -3.269 1.00 0.00 C ATOM 655 O LEU A 51 16.477 -2.319 -4.112 1.00 0.00 O ATOM 656 CB LEU A 51 13.094 -2.453 -3.595 1.00 0.00 C ATOM 657 CG LEU A 51 12.573 -2.995 -4.927 1.00 0.00 C ATOM 658 CD1 LEU A 51 11.256 -3.749 -4.734 1.00 0.00 C ATOM 659 CD2 LEU A 51 12.446 -1.876 -5.963 1.00 0.00 C ATOM 0 H LEU A 51 13.637 -2.910 -1.166 1.00 0.00 H new ATOM 0 HA LEU A 51 14.612 -3.905 -3.739 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.337 -2.631 -2.832 1.00 0.00 H new ATOM 0 HB3 LEU A 51 13.208 -1.373 -3.685 1.00 0.00 H new ATOM 0 HG LEU A 51 13.300 -3.710 -5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.907 -4.124 -5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 51 11.412 -4.586 -4.053 1.00 0.00 H new ATOM 0 HD13 LEU A 51 10.509 -3.075 -4.315 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.074 -2.289 -6.901 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.751 -1.120 -5.598 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.423 -1.421 -6.129 1.00 0.00 H new ATOM 671 N ASN A 52 15.614 -1.050 -2.450 1.00 0.00 N ATOM 672 CA ASN A 52 16.683 -0.068 -2.494 1.00 0.00 C ATOM 673 C ASN A 52 17.397 -0.037 -1.142 1.00 0.00 C ATOM 674 O ASN A 52 16.755 0.076 -0.099 1.00 0.00 O ATOM 675 CB ASN A 52 16.133 1.333 -2.770 1.00 0.00 C ATOM 676 CG ASN A 52 16.922 2.022 -3.886 1.00 0.00 C ATOM 677 OD1 ASN A 52 16.817 1.426 -5.070 1.00 0.00 O flip ATOM 678 ND2 ASN A 52 17.581 3.029 -3.684 1.00 0.00 N flip ATOM 0 H ASN A 52 14.893 -0.865 -1.752 1.00 0.00 H new ATOM 0 HA ASN A 52 17.368 -0.351 -3.294 1.00 0.00 H new ATOM 0 HB2 ASN A 52 15.082 1.266 -3.051 1.00 0.00 H new ATOM 0 HB3 ASN A 52 16.183 1.933 -1.861 1.00 0.00 H new ATOM 0 HD21 ASN A 52 17.618 3.435 -2.749 1.00 0.00 H new ATOM 0 HD22 ASN A 52 18.095 3.465 -4.450 1.00 0.00 H new ATOM 685 N PRO A 53 18.752 -0.141 -1.205 1.00 0.00 N ATOM 686 CA PRO A 53 19.561 -0.127 0.002 1.00 0.00 C ATOM 687 C PRO A 53 19.662 1.288 0.577 1.00 0.00 C ATOM 688 O PRO A 53 20.384 1.518 1.546 1.00 0.00 O ATOM 689 CB PRO A 53 20.906 -0.694 -0.419 1.00 0.00 C ATOM 690 CG PRO A 53 20.955 -0.573 -1.933 1.00 0.00 C ATOM 691 CD PRO A 53 19.546 -0.276 -2.422 1.00 0.00 C ATOM 0 HA PRO A 53 19.128 -0.722 0.806 1.00 0.00 H new ATOM 0 HB2 PRO A 53 21.724 -0.142 0.043 1.00 0.00 H new ATOM 0 HB3 PRO A 53 21.006 -1.734 -0.107 1.00 0.00 H new ATOM 0 HG2 PRO A 53 21.638 0.223 -2.231 1.00 0.00 H new ATOM 0 HG3 PRO A 53 21.327 -1.496 -2.378 1.00 0.00 H new ATOM 0 HD2 PRO A 53 19.518 0.637 -3.017 1.00 0.00 H new ATOM 0 HD3 PRO A 53 19.169 -1.080 -3.054 1.00 0.00 H new ATOM 699 N GLN A 54 18.928 2.199 -0.045 1.00 0.00 N ATOM 700 CA GLN A 54 18.926 3.584 0.393 1.00 0.00 C ATOM 701 C GLN A 54 17.519 4.003 0.823 1.00 0.00 C ATOM 702 O GLN A 54 17.322 5.111 1.321 1.00 0.00 O ATOM 703 CB GLN A 54 19.461 4.506 -0.704 1.00 0.00 C ATOM 704 CG GLN A 54 20.975 4.687 -0.579 1.00 0.00 C ATOM 705 CD GLN A 54 21.355 6.168 -0.606 1.00 0.00 C ATOM 706 OE1 GLN A 54 20.787 6.994 0.089 1.00 0.00 O ATOM 707 NE2 GLN A 54 22.345 6.458 -1.447 1.00 0.00 N ATOM 0 H GLN A 54 18.331 2.005 -0.849 1.00 0.00 H new ATOM 0 HA GLN A 54 19.589 3.674 1.253 1.00 0.00 H new ATOM 0 HB2 GLN A 54 19.221 4.090 -1.682 1.00 0.00 H new ATOM 0 HB3 GLN A 54 18.969 5.476 -0.640 1.00 0.00 H new ATOM 0 HG2 GLN A 54 21.323 4.236 0.350 1.00 0.00 H new ATOM 0 HG3 GLN A 54 21.476 4.165 -1.394 1.00 0.00 H new ATOM 0 HE21 GLN A 54 22.778 5.718 -2.000 1.00 0.00 H new ATOM 0 HE22 GLN A 54 22.671 7.420 -1.538 1.00 0.00 H new ATOM 716 N VAL A 55 16.576 3.095 0.616 1.00 0.00 N ATOM 717 CA VAL A 55 15.193 3.356 0.977 1.00 0.00 C ATOM 718 C VAL A 55 14.796 2.454 2.147 1.00 0.00 C ATOM 719 O VAL A 55 15.138 1.273 2.168 1.00 0.00 O ATOM 720 CB VAL A 55 14.291 3.180 -0.247 1.00 0.00 C ATOM 721 CG1 VAL A 55 14.841 3.952 -1.448 1.00 0.00 C ATOM 722 CG2 VAL A 55 14.107 1.699 -0.583 1.00 0.00 C ATOM 0 H VAL A 55 16.743 2.178 0.203 1.00 0.00 H new ATOM 0 HA VAL A 55 15.073 4.388 1.308 1.00 0.00 H new ATOM 0 HB VAL A 55 13.311 3.592 -0.005 1.00 0.00 H new ATOM 0 HG11 VAL A 55 14.182 3.810 -2.304 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.896 5.013 -1.204 1.00 0.00 H new ATOM 0 HG13 VAL A 55 15.837 3.583 -1.692 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.462 1.601 -1.456 1.00 0.00 H new ATOM 0 HG22 VAL A 55 15.077 1.251 -0.797 1.00 0.00 H new ATOM 0 HG23 VAL A 55 13.650 1.188 0.264 1.00 0.00 H new ATOM 732 N ASN A 56 14.081 3.045 3.092 1.00 0.00 N ATOM 733 CA ASN A 56 13.634 2.310 4.263 1.00 0.00 C ATOM 734 C ASN A 56 12.453 3.044 4.901 1.00 0.00 C ATOM 735 O ASN A 56 12.585 4.192 5.323 1.00 0.00 O ATOM 736 CB ASN A 56 14.747 2.207 5.307 1.00 0.00 C ATOM 737 CG ASN A 56 14.973 3.552 6.002 1.00 0.00 C ATOM 738 OD1 ASN A 56 14.393 3.853 7.032 1.00 0.00 O ATOM 739 ND2 ASN A 56 15.846 4.341 5.382 1.00 0.00 N ATOM 0 H ASN A 56 13.800 4.025 3.071 1.00 0.00 H new ATOM 0 HA ASN A 56 13.347 1.309 3.943 1.00 0.00 H new ATOM 0 HB2 ASN A 56 14.487 1.450 6.047 1.00 0.00 H new ATOM 0 HB3 ASN A 56 15.670 1.881 4.828 1.00 0.00 H new ATOM 0 HD21 ASN A 56 16.065 5.260 5.766 1.00 0.00 H new ATOM 0 HD22 ASN A 56 16.296 4.027 4.522 1.00 0.00 H new ATOM 746 N LEU A 57 11.324 2.351 4.952 1.00 0.00 N ATOM 747 CA LEU A 57 10.121 2.923 5.532 1.00 0.00 C ATOM 748 C LEU A 57 9.556 1.959 6.577 1.00 0.00 C ATOM 749 O LEU A 57 8.415 2.108 7.012 1.00 0.00 O ATOM 750 CB LEU A 57 9.122 3.294 4.434 1.00 0.00 C ATOM 751 CG LEU A 57 9.429 4.572 3.651 1.00 0.00 C ATOM 752 CD1 LEU A 57 8.266 4.945 2.731 1.00 0.00 C ATOM 753 CD2 LEU A 57 9.803 5.717 4.595 1.00 0.00 C ATOM 0 H LEU A 57 11.218 1.399 4.601 1.00 0.00 H new ATOM 0 HA LEU A 57 10.352 3.854 6.049 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.063 2.465 3.729 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.136 3.397 4.887 1.00 0.00 H new ATOM 0 HG LEU A 57 10.294 4.383 3.015 1.00 0.00 H new ATOM 0 HD11 LEU A 57 8.511 5.857 2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.089 4.136 2.022 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.368 5.108 3.327 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.016 6.614 4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 57 8.974 5.914 5.274 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.686 5.440 5.171 1.00 0.00 H new ATOM 765 N VAL A 58 10.381 0.993 6.952 1.00 0.00 N ATOM 766 CA VAL A 58 9.979 0.005 7.938 1.00 0.00 C ATOM 767 C VAL A 58 9.822 0.685 9.300 1.00 0.00 C ATOM 768 O VAL A 58 8.744 0.656 9.891 1.00 0.00 O ATOM 769 CB VAL A 58 10.980 -1.152 7.959 1.00 0.00 C ATOM 770 CG1 VAL A 58 11.015 -1.821 9.335 1.00 0.00 C ATOM 771 CG2 VAL A 58 10.664 -2.170 6.862 1.00 0.00 C ATOM 0 H VAL A 58 11.327 0.873 6.590 1.00 0.00 H new ATOM 0 HA VAL A 58 9.012 -0.425 7.676 1.00 0.00 H new ATOM 0 HB VAL A 58 11.970 -0.742 7.760 1.00 0.00 H new ATOM 0 HG11 VAL A 58 11.734 -2.640 9.323 1.00 0.00 H new ATOM 0 HG12 VAL A 58 11.310 -1.090 10.088 1.00 0.00 H new ATOM 0 HG13 VAL A 58 10.026 -2.210 9.576 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.390 -2.982 6.899 1.00 0.00 H new ATOM 0 HG22 VAL A 58 9.662 -2.572 7.016 1.00 0.00 H new ATOM 0 HG23 VAL A 58 10.714 -1.683 5.888 1.00 0.00 H new ATOM 781 N ASP A 59 10.913 1.280 9.757 1.00 0.00 N ATOM 782 CA ASP A 59 10.910 1.966 11.038 1.00 0.00 C ATOM 783 C ASP A 59 9.895 3.110 10.997 1.00 0.00 C ATOM 784 O ASP A 59 9.193 3.357 11.976 1.00 0.00 O ATOM 785 CB ASP A 59 12.285 2.564 11.346 1.00 0.00 C ATOM 786 CG ASP A 59 12.642 2.633 12.832 1.00 0.00 C ATOM 787 OD1 ASP A 59 12.424 3.658 13.494 1.00 0.00 O ATOM 788 OD2 ASP A 59 13.174 1.561 13.315 1.00 0.00 O ATOM 0 H ASP A 59 11.805 1.302 9.264 1.00 0.00 H new ATOM 0 HA ASP A 59 10.652 1.240 11.809 1.00 0.00 H new ATOM 0 HB2 ASP A 59 13.044 1.974 10.832 1.00 0.00 H new ATOM 0 HB3 ASP A 59 12.328 3.571 10.930 1.00 0.00 H new ATOM 794 N THR A 60 9.850 3.777 9.853 1.00 0.00 N ATOM 795 CA THR A 60 8.933 4.889 9.672 1.00 0.00 C ATOM 796 C THR A 60 7.484 4.404 9.750 1.00 0.00 C ATOM 797 O THR A 60 6.772 4.716 10.703 1.00 0.00 O ATOM 798 CB THR A 60 9.273 5.572 8.345 1.00 0.00 C ATOM 799 OG1 THR A 60 10.432 6.347 8.641 1.00 0.00 O ATOM 800 CG2 THR A 60 8.226 6.609 7.934 1.00 0.00 C ATOM 0 H THR A 60 10.434 3.569 9.043 1.00 0.00 H new ATOM 0 HA THR A 60 9.041 5.624 10.470 1.00 0.00 H new ATOM 0 HB THR A 60 9.364 4.819 7.562 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.722 6.823 7.835 1.00 0.00 H new ATOM 0 HG21 THR A 60 8.516 7.063 6.986 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.257 6.123 7.822 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.158 7.381 8.700 1.00 0.00 H new ATOM 808 N LEU A 61 7.091 3.647 8.736 1.00 0.00 N ATOM 809 CA LEU A 61 5.740 3.115 8.678 1.00 0.00 C ATOM 810 C LEU A 61 5.295 2.713 10.085 1.00 0.00 C ATOM 811 O LEU A 61 4.138 2.911 10.455 1.00 0.00 O ATOM 812 CB LEU A 61 5.655 1.979 7.658 1.00 0.00 C ATOM 813 CG LEU A 61 5.626 2.399 6.187 1.00 0.00 C ATOM 814 CD1 LEU A 61 4.979 1.316 5.320 1.00 0.00 C ATOM 815 CD2 LEU A 61 4.938 3.755 6.017 1.00 0.00 C ATOM 0 H LEU A 61 7.685 3.389 7.948 1.00 0.00 H new ATOM 0 HA LEU A 61 5.044 3.878 8.329 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.507 1.317 7.809 1.00 0.00 H new ATOM 0 HB3 LEU A 61 4.758 1.396 7.867 1.00 0.00 H new ATOM 0 HG LEU A 61 6.654 2.514 5.845 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.971 1.640 4.279 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.549 0.391 5.408 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.956 1.145 5.655 1.00 0.00 H new ATOM 0 HD21 LEU A 61 4.931 4.030 4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.913 3.691 6.382 1.00 0.00 H new ATOM 0 HD23 LEU A 61 5.479 4.511 6.585 1.00 0.00 H new ATOM 827 N ASN A 62 6.236 2.155 10.833 1.00 0.00 N ATOM 828 CA ASN A 62 5.955 1.723 12.191 1.00 0.00 C ATOM 829 C ASN A 62 6.139 2.905 13.146 1.00 0.00 C ATOM 830 O ASN A 62 6.841 2.793 14.149 1.00 0.00 O ATOM 831 CB ASN A 62 6.912 0.612 12.625 1.00 0.00 C ATOM 832 CG ASN A 62 6.656 0.203 14.077 1.00 0.00 C ATOM 833 OD1 ASN A 62 5.380 -0.048 14.352 1.00 0.00 O flip ATOM 834 ND2 ASN A 62 7.559 0.122 14.894 1.00 0.00 N flip ATOM 0 H ASN A 62 7.194 1.992 10.524 1.00 0.00 H new ATOM 0 HA ASN A 62 4.932 1.349 12.221 1.00 0.00 H new ATOM 0 HB2 ASN A 62 6.790 -0.253 11.973 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.942 0.951 12.515 1.00 0.00 H new ATOM 0 HD21 ASN A 62 8.518 0.329 14.616 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.354 -0.153 15.855 1.00 0.00 H new ATOM 841 N SER A 63 5.495 4.010 12.800 1.00 0.00 N ATOM 842 CA SER A 63 5.579 5.211 13.613 1.00 0.00 C ATOM 843 C SER A 63 4.497 6.206 13.190 1.00 0.00 C ATOM 844 O SER A 63 4.578 6.795 12.113 1.00 0.00 O ATOM 845 CB SER A 63 6.963 5.854 13.506 1.00 0.00 C ATOM 846 OG SER A 63 7.597 5.972 14.776 1.00 0.00 O ATOM 0 H SER A 63 4.913 4.099 11.967 1.00 0.00 H new ATOM 0 HA SER A 63 5.419 4.931 14.654 1.00 0.00 H new ATOM 0 HB2 SER A 63 7.589 5.258 12.842 1.00 0.00 H new ATOM 0 HB3 SER A 63 6.870 6.842 13.054 1.00 0.00 H new ATOM 0 HG SER A 63 8.478 6.385 14.664 1.00 0.00 H new ATOM 852 N GLY A 64 3.510 6.364 14.059 1.00 0.00 N ATOM 853 CA GLY A 64 2.413 7.278 13.789 1.00 0.00 C ATOM 854 C GLY A 64 1.282 6.571 13.039 1.00 0.00 C ATOM 855 O GLY A 64 1.520 5.600 12.322 1.00 0.00 O ATOM 0 H GLY A 64 3.447 5.874 14.951 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.034 7.684 14.727 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.774 8.121 13.199 1.00 0.00 H new ATOM 859 N GLN A 65 0.076 7.086 13.230 1.00 0.00 N ATOM 860 CA GLN A 65 -1.092 6.516 12.580 1.00 0.00 C ATOM 861 C GLN A 65 -1.046 6.784 11.075 1.00 0.00 C ATOM 862 O GLN A 65 -1.232 7.918 10.636 1.00 0.00 O ATOM 863 CB GLN A 65 -2.382 7.062 13.195 1.00 0.00 C ATOM 864 CG GLN A 65 -2.871 6.163 14.333 1.00 0.00 C ATOM 865 CD GLN A 65 -2.730 6.864 15.685 1.00 0.00 C ATOM 866 OE1 GLN A 65 -1.907 6.511 16.514 1.00 0.00 O ATOM 867 NE2 GLN A 65 -3.576 7.875 15.861 1.00 0.00 N ATOM 0 H GLN A 65 -0.117 7.891 13.825 1.00 0.00 H new ATOM 0 HA GLN A 65 -1.081 5.437 12.737 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -2.211 8.071 13.571 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -3.153 7.135 12.427 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.914 5.894 14.166 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.299 5.235 14.339 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.240 8.118 15.126 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -3.561 8.407 16.731 1.00 0.00 H new ATOM 876 N TYR A 66 -0.798 5.721 10.324 1.00 0.00 N ATOM 877 CA TYR A 66 -0.725 5.827 8.877 1.00 0.00 C ATOM 878 C TYR A 66 -1.871 5.061 8.213 1.00 0.00 C ATOM 879 O TYR A 66 -2.769 4.568 8.893 1.00 0.00 O ATOM 880 CB TYR A 66 0.603 5.183 8.473 1.00 0.00 C ATOM 881 CG TYR A 66 1.836 5.992 8.883 1.00 0.00 C ATOM 882 CD1 TYR A 66 1.684 7.218 9.498 1.00 0.00 C ATOM 883 CD2 TYR A 66 3.100 5.494 8.638 1.00 0.00 C ATOM 884 CE1 TYR A 66 2.845 7.979 9.883 1.00 0.00 C ATOM 885 CE2 TYR A 66 4.260 6.255 9.023 1.00 0.00 C ATOM 886 CZ TYR A 66 4.075 7.460 9.627 1.00 0.00 C ATOM 887 OH TYR A 66 5.171 8.178 9.991 1.00 0.00 O ATOM 0 H TYR A 66 -0.645 4.782 10.691 1.00 0.00 H new ATOM 0 HA TYR A 66 -0.797 6.869 8.565 1.00 0.00 H new ATOM 0 HB2 TYR A 66 0.666 4.192 8.922 1.00 0.00 H new ATOM 0 HB3 TYR A 66 0.614 5.045 7.392 1.00 0.00 H new ATOM 0 HD1 TYR A 66 0.695 7.607 9.691 1.00 0.00 H new ATOM 0 HD2 TYR A 66 3.219 4.534 8.158 1.00 0.00 H new ATOM 0 HE1 TYR A 66 2.741 8.940 10.364 1.00 0.00 H new ATOM 0 HE2 TYR A 66 5.255 5.878 8.837 1.00 0.00 H new ATOM 0 HH TYR A 66 5.406 7.969 10.919 1.00 0.00 H new ATOM 897 N THR A 67 -1.803 4.987 6.891 1.00 0.00 N ATOM 898 CA THR A 67 -2.824 4.290 6.128 1.00 0.00 C ATOM 899 C THR A 67 -2.234 3.735 4.830 1.00 0.00 C ATOM 900 O THR A 67 -2.284 4.391 3.790 1.00 0.00 O ATOM 901 CB THR A 67 -3.988 5.257 5.901 1.00 0.00 C ATOM 902 OG1 THR A 67 -4.323 5.710 7.210 1.00 0.00 O ATOM 903 CG2 THR A 67 -5.254 4.547 5.417 1.00 0.00 C ATOM 0 H THR A 67 -1.057 5.398 6.330 1.00 0.00 H new ATOM 0 HA THR A 67 -3.203 3.425 6.673 1.00 0.00 H new ATOM 0 HB THR A 67 -3.695 6.013 5.172 1.00 0.00 H new ATOM 0 HG1 THR A 67 -4.626 6.641 7.166 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.049 5.279 5.272 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.049 4.041 4.473 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.567 3.814 6.161 1.00 0.00 H new ATOM 911 N VAL A 68 -1.687 2.533 4.933 1.00 0.00 N ATOM 912 CA VAL A 68 -1.088 1.882 3.780 1.00 0.00 C ATOM 913 C VAL A 68 -2.085 1.890 2.619 1.00 0.00 C ATOM 914 O VAL A 68 -3.262 1.587 2.806 1.00 0.00 O ATOM 915 CB VAL A 68 -0.621 0.475 4.157 1.00 0.00 C ATOM 916 CG1 VAL A 68 0.022 -0.229 2.960 1.00 0.00 C ATOM 917 CG2 VAL A 68 0.338 0.516 5.349 1.00 0.00 C ATOM 0 H VAL A 68 -1.646 1.993 5.797 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.203 2.427 3.452 1.00 0.00 H new ATOM 0 HB VAL A 68 -1.498 -0.101 4.452 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.345 -1.227 3.255 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.704 -0.307 2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 68 0.884 0.345 2.620 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.655 -0.497 5.596 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.211 1.117 5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.168 0.958 6.208 1.00 0.00 H new ATOM 927 N PHE A 69 -1.576 2.241 1.447 1.00 0.00 N ATOM 928 CA PHE A 69 -2.408 2.293 0.256 1.00 0.00 C ATOM 929 C PHE A 69 -1.814 1.436 -0.864 1.00 0.00 C ATOM 930 O PHE A 69 -1.375 1.962 -1.886 1.00 0.00 O ATOM 931 CB PHE A 69 -2.446 3.753 -0.199 1.00 0.00 C ATOM 932 CG PHE A 69 -3.599 4.561 0.398 1.00 0.00 C ATOM 933 CD1 PHE A 69 -4.833 4.507 -0.171 1.00 0.00 C ATOM 934 CD2 PHE A 69 -3.390 5.333 1.498 1.00 0.00 C ATOM 935 CE1 PHE A 69 -5.904 5.258 0.384 1.00 0.00 C ATOM 936 CE2 PHE A 69 -4.461 6.084 2.052 1.00 0.00 C ATOM 937 CZ PHE A 69 -5.695 6.030 1.483 1.00 0.00 C ATOM 0 H PHE A 69 -0.599 2.492 1.296 1.00 0.00 H new ATOM 0 HA PHE A 69 -3.404 1.911 0.480 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -1.504 4.231 0.069 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -2.520 3.782 -1.286 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -4.999 3.894 -1.044 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -2.410 5.375 1.950 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -6.884 5.215 -0.067 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -4.295 6.698 2.925 1.00 0.00 H new ATOM 0 HZ PHE A 69 -6.509 6.601 1.905 1.00 0.00 H new ATOM 947 N ALA A 70 -1.820 0.131 -0.635 1.00 0.00 N ATOM 948 CA ALA A 70 -0.690 -0.700 -1.013 1.00 0.00 C ATOM 949 C ALA A 70 -0.964 -1.336 -2.377 1.00 0.00 C ATOM 950 O ALA A 70 -2.004 -1.963 -2.576 1.00 0.00 O ATOM 951 CB ALA A 70 -0.437 -1.744 0.077 1.00 0.00 C ATOM 0 H ALA A 70 -2.590 -0.371 -0.192 1.00 0.00 H new ATOM 0 HA ALA A 70 0.215 -0.099 -1.105 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.411 -2.368 -0.206 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.219 -1.241 1.019 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.323 -2.368 0.196 1.00 0.00 H new ATOM 957 N PRO A 71 0.012 -1.149 -3.305 1.00 0.00 N ATOM 958 CA PRO A 71 -0.114 -1.698 -4.644 1.00 0.00 C ATOM 959 C PRO A 71 0.128 -3.208 -4.643 1.00 0.00 C ATOM 960 O PRO A 71 1.187 -3.670 -4.221 1.00 0.00 O ATOM 961 CB PRO A 71 0.900 -0.934 -5.479 1.00 0.00 C ATOM 962 CG PRO A 71 1.876 -0.318 -4.490 1.00 0.00 C ATOM 963 CD PRO A 71 1.257 -0.413 -3.105 1.00 0.00 C ATOM 0 HA PRO A 71 -1.117 -1.581 -5.054 1.00 0.00 H new ATOM 0 HB2 PRO A 71 1.415 -1.599 -6.173 1.00 0.00 H new ATOM 0 HB3 PRO A 71 0.412 -0.164 -6.077 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.831 -0.843 -4.518 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.076 0.722 -4.748 1.00 0.00 H new ATOM 0 HD2 PRO A 71 1.917 -0.933 -2.411 1.00 0.00 H new ATOM 0 HD3 PRO A 71 1.070 0.576 -2.686 1.00 0.00 H new ATOM 971 N THR A 72 -0.870 -3.936 -5.121 1.00 0.00 N ATOM 972 CA THR A 72 -0.779 -5.385 -5.180 1.00 0.00 C ATOM 973 C THR A 72 0.362 -5.810 -6.107 1.00 0.00 C ATOM 974 O THR A 72 1.050 -4.965 -6.678 1.00 0.00 O ATOM 975 CB THR A 72 -2.144 -5.928 -5.609 1.00 0.00 C ATOM 976 OG1 THR A 72 -2.447 -5.205 -6.799 1.00 0.00 O ATOM 977 CG2 THR A 72 -3.261 -5.535 -4.640 1.00 0.00 C ATOM 0 H THR A 72 -1.746 -3.549 -5.471 1.00 0.00 H new ATOM 0 HA THR A 72 -0.538 -5.806 -4.204 1.00 0.00 H new ATOM 0 HB THR A 72 -2.095 -7.014 -5.685 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.268 -4.687 -6.667 1.00 0.00 H new ATOM 0 HG21 THR A 72 -4.208 -5.945 -4.991 1.00 0.00 H new ATOM 0 HG22 THR A 72 -3.039 -5.931 -3.649 1.00 0.00 H new ATOM 0 HG23 THR A 72 -3.333 -4.449 -4.589 1.00 0.00 H new ATOM 985 N ASN A 73 0.527 -7.119 -6.229 1.00 0.00 N ATOM 986 CA ASN A 73 1.573 -7.666 -7.076 1.00 0.00 C ATOM 987 C ASN A 73 1.262 -7.338 -8.538 1.00 0.00 C ATOM 988 O ASN A 73 2.166 -7.041 -9.317 1.00 0.00 O ATOM 989 CB ASN A 73 1.653 -9.187 -6.939 1.00 0.00 C ATOM 990 CG ASN A 73 1.312 -9.629 -5.515 1.00 0.00 C ATOM 991 OD1 ASN A 73 0.070 -10.084 -5.372 1.00 0.00 O flip ATOM 992 ND2 ASN A 73 2.122 -9.560 -4.605 1.00 0.00 N flip ATOM 0 H ASN A 73 -0.046 -7.817 -5.755 1.00 0.00 H new ATOM 0 HA ASN A 73 2.522 -7.226 -6.768 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.966 -9.656 -7.643 1.00 0.00 H new ATOM 0 HB3 ASN A 73 2.656 -9.527 -7.198 1.00 0.00 H new ATOM 0 HD21 ASN A 73 3.060 -9.201 -4.783 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.861 -9.862 -3.666 1.00 0.00 H new ATOM 999 N ALA A 74 -0.020 -7.404 -8.866 1.00 0.00 N ATOM 1000 CA ALA A 74 -0.462 -7.118 -10.220 1.00 0.00 C ATOM 1001 C ALA A 74 -0.357 -5.614 -10.480 1.00 0.00 C ATOM 1002 O ALA A 74 -0.514 -5.163 -11.613 1.00 0.00 O ATOM 1003 CB ALA A 74 -1.885 -7.646 -10.416 1.00 0.00 C ATOM 0 H ALA A 74 -0.767 -7.651 -8.217 1.00 0.00 H new ATOM 0 HA ALA A 74 0.175 -7.623 -10.946 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.216 -7.431 -11.432 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -1.900 -8.723 -10.250 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.554 -7.160 -9.706 1.00 0.00 H new ATOM 1009 N ALA A 75 -0.093 -4.878 -9.410 1.00 0.00 N ATOM 1010 CA ALA A 75 0.034 -3.434 -9.507 1.00 0.00 C ATOM 1011 C ALA A 75 1.428 -3.084 -10.031 1.00 0.00 C ATOM 1012 O ALA A 75 1.565 -2.276 -10.949 1.00 0.00 O ATOM 1013 CB ALA A 75 -0.252 -2.803 -8.143 1.00 0.00 C ATOM 0 H ALA A 75 0.036 -5.255 -8.471 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.694 -3.031 -10.211 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -0.157 -1.720 -8.216 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -1.264 -3.058 -7.829 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.461 -3.181 -7.410 1.00 0.00 H new ATOM 1019 N PHE A 76 2.427 -3.708 -9.426 1.00 0.00 N ATOM 1020 CA PHE A 76 3.806 -3.473 -9.820 1.00 0.00 C ATOM 1021 C PHE A 76 4.146 -4.232 -11.104 1.00 0.00 C ATOM 1022 O PHE A 76 4.752 -3.673 -12.017 1.00 0.00 O ATOM 1023 CB PHE A 76 4.691 -3.991 -8.685 1.00 0.00 C ATOM 1024 CG PHE A 76 4.764 -3.056 -7.476 1.00 0.00 C ATOM 1025 CD1 PHE A 76 5.653 -2.026 -7.466 1.00 0.00 C ATOM 1026 CD2 PHE A 76 3.942 -3.255 -6.411 1.00 0.00 C ATOM 1027 CE1 PHE A 76 5.721 -1.158 -6.345 1.00 0.00 C ATOM 1028 CE2 PHE A 76 4.010 -2.386 -5.290 1.00 0.00 C ATOM 1029 CZ PHE A 76 4.898 -1.357 -5.280 1.00 0.00 C ATOM 0 H PHE A 76 2.309 -4.377 -8.665 1.00 0.00 H new ATOM 0 HA PHE A 76 3.964 -2.411 -10.005 1.00 0.00 H new ATOM 0 HB2 PHE A 76 4.315 -4.961 -8.359 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.699 -4.152 -9.068 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.307 -1.869 -8.311 1.00 0.00 H new ATOM 0 HD2 PHE A 76 3.238 -4.074 -6.418 1.00 0.00 H new ATOM 0 HE1 PHE A 76 6.426 -0.340 -6.337 1.00 0.00 H new ATOM 0 HE2 PHE A 76 3.356 -2.543 -4.445 1.00 0.00 H new ATOM 0 HZ PHE A 76 4.950 -0.697 -4.427 1.00 0.00 H new ATOM 1039 N SER A 77 3.743 -5.493 -11.132 1.00 0.00 N ATOM 1040 CA SER A 77 3.998 -6.335 -12.289 1.00 0.00 C ATOM 1041 C SER A 77 3.593 -5.601 -13.569 1.00 0.00 C ATOM 1042 O SER A 77 4.092 -5.910 -14.650 1.00 0.00 O ATOM 1043 CB SER A 77 3.248 -7.664 -12.179 1.00 0.00 C ATOM 1044 OG SER A 77 3.184 -8.346 -13.429 1.00 0.00 O ATOM 0 H SER A 77 3.241 -5.953 -10.372 1.00 0.00 H new ATOM 0 HA SER A 77 5.065 -6.553 -12.325 1.00 0.00 H new ATOM 0 HB2 SER A 77 3.742 -8.299 -11.444 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.237 -7.481 -11.814 1.00 0.00 H new ATOM 0 HG SER A 77 2.699 -9.190 -13.317 1.00 0.00 H new ATOM 1050 N LYS A 78 2.692 -4.644 -13.405 1.00 0.00 N ATOM 1051 CA LYS A 78 2.215 -3.864 -14.534 1.00 0.00 C ATOM 1052 C LYS A 78 3.380 -3.072 -15.130 1.00 0.00 C ATOM 1053 O LYS A 78 3.428 -2.847 -16.338 1.00 0.00 O ATOM 1054 CB LYS A 78 1.027 -2.993 -14.120 1.00 0.00 C ATOM 1055 CG LYS A 78 -0.297 -3.723 -14.353 1.00 0.00 C ATOM 1056 CD LYS A 78 -1.487 -2.821 -14.023 1.00 0.00 C ATOM 1057 CE LYS A 78 -1.466 -2.402 -12.551 1.00 0.00 C ATOM 1058 NZ LYS A 78 -1.599 -0.933 -12.428 1.00 0.00 N ATOM 0 H LYS A 78 2.280 -4.391 -12.507 1.00 0.00 H new ATOM 0 HA LYS A 78 1.841 -4.521 -15.319 1.00 0.00 H new ATOM 0 HB2 LYS A 78 1.118 -2.725 -13.067 1.00 0.00 H new ATOM 0 HB3 LYS A 78 1.038 -2.063 -14.688 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -0.359 -4.047 -15.392 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -0.335 -4.621 -13.736 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.463 -1.935 -14.657 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.417 -3.345 -14.242 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.279 -2.893 -12.016 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -0.535 -2.729 -12.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.015 -0.698 -11.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -0.661 -0.492 -12.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -2.215 -0.576 -13.186 1.00 0.00 H new ATOM 1071 N LEU A 79 4.290 -2.671 -14.255 1.00 0.00 N ATOM 1072 CA LEU A 79 5.452 -1.908 -14.680 1.00 0.00 C ATOM 1073 C LEU A 79 6.494 -2.861 -15.269 1.00 0.00 C ATOM 1074 O LEU A 79 6.602 -4.009 -14.842 1.00 0.00 O ATOM 1075 CB LEU A 79 5.982 -1.053 -13.527 1.00 0.00 C ATOM 1076 CG LEU A 79 4.939 -0.235 -12.764 1.00 0.00 C ATOM 1077 CD1 LEU A 79 5.604 0.670 -11.725 1.00 0.00 C ATOM 1078 CD2 LEU A 79 4.050 0.555 -13.727 1.00 0.00 C ATOM 0 H LEU A 79 4.247 -2.860 -13.254 1.00 0.00 H new ATOM 0 HA LEU A 79 5.180 -1.206 -15.468 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.490 -1.708 -12.819 1.00 0.00 H new ATOM 0 HB3 LEU A 79 6.732 -0.369 -13.923 1.00 0.00 H new ATOM 0 HG LEU A 79 4.293 -0.926 -12.222 1.00 0.00 H new ATOM 0 HD11 LEU A 79 4.840 1.240 -11.197 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.158 0.059 -11.012 1.00 0.00 H new ATOM 0 HD13 LEU A 79 6.288 1.356 -12.225 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.317 1.128 -13.159 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.666 1.236 -14.315 1.00 0.00 H new ATOM 0 HD23 LEU A 79 3.533 -0.135 -14.394 1.00 0.00 H new ATOM 1090 N PRO A 80 7.255 -2.335 -16.266 1.00 0.00 N ATOM 1091 CA PRO A 80 8.285 -3.126 -16.918 1.00 0.00 C ATOM 1092 C PRO A 80 9.511 -3.279 -16.016 1.00 0.00 C ATOM 1093 O PRO A 80 9.912 -2.333 -15.341 1.00 0.00 O ATOM 1094 CB PRO A 80 8.587 -2.388 -18.212 1.00 0.00 C ATOM 1095 CG PRO A 80 8.058 -0.976 -18.020 1.00 0.00 C ATOM 1096 CD PRO A 80 7.155 -0.979 -16.797 1.00 0.00 C ATOM 0 HA PRO A 80 7.965 -4.148 -17.123 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.658 -2.380 -18.416 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.105 -2.874 -19.060 1.00 0.00 H new ATOM 0 HG2 PRO A 80 8.882 -0.275 -17.885 1.00 0.00 H new ATOM 0 HG3 PRO A 80 7.505 -0.652 -18.902 1.00 0.00 H new ATOM 0 HD2 PRO A 80 7.480 -0.241 -16.063 1.00 0.00 H new ATOM 0 HD3 PRO A 80 6.127 -0.733 -17.063 1.00 0.00 H new ATOM 1104 N ALA A 81 10.073 -4.479 -16.034 1.00 0.00 N ATOM 1105 CA ALA A 81 11.245 -4.769 -15.226 1.00 0.00 C ATOM 1106 C ALA A 81 12.184 -3.561 -15.246 1.00 0.00 C ATOM 1107 O ALA A 81 12.896 -3.307 -14.275 1.00 0.00 O ATOM 1108 CB ALA A 81 11.921 -6.040 -15.744 1.00 0.00 C ATOM 0 H ALA A 81 9.738 -5.262 -16.596 1.00 0.00 H new ATOM 0 HA ALA A 81 10.961 -4.950 -14.189 1.00 0.00 H new ATOM 0 HB1 ALA A 81 12.800 -6.257 -15.138 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.222 -6.875 -15.683 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.222 -5.895 -16.781 1.00 0.00 H new ATOM 1114 N SER A 82 12.154 -2.847 -16.362 1.00 0.00 N ATOM 1115 CA SER A 82 12.994 -1.671 -16.520 1.00 0.00 C ATOM 1116 C SER A 82 12.717 -0.675 -15.392 1.00 0.00 C ATOM 1117 O SER A 82 13.634 -0.269 -14.680 1.00 0.00 O ATOM 1118 CB SER A 82 12.764 -1.010 -17.880 1.00 0.00 C ATOM 1119 OG SER A 82 11.389 -0.709 -18.103 1.00 0.00 O ATOM 0 H SER A 82 11.562 -3.060 -17.165 1.00 0.00 H new ATOM 0 HA SER A 82 14.036 -1.985 -16.470 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.350 -0.093 -17.941 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.123 -1.671 -18.669 1.00 0.00 H new ATOM 0 HG SER A 82 11.285 -0.287 -18.981 1.00 0.00 H new ATOM 1125 N THR A 83 11.450 -0.310 -15.265 1.00 0.00 N ATOM 1126 CA THR A 83 11.042 0.630 -14.236 1.00 0.00 C ATOM 1127 C THR A 83 11.434 0.110 -12.852 1.00 0.00 C ATOM 1128 O THR A 83 11.972 0.855 -12.034 1.00 0.00 O ATOM 1129 CB THR A 83 9.539 0.876 -14.389 1.00 0.00 C ATOM 1130 OG1 THR A 83 9.460 2.110 -15.098 1.00 0.00 O ATOM 1131 CG2 THR A 83 8.855 1.169 -13.053 1.00 0.00 C ATOM 0 H THR A 83 10.692 -0.649 -15.858 1.00 0.00 H new ATOM 0 HA THR A 83 11.556 1.585 -14.347 1.00 0.00 H new ATOM 0 HB THR A 83 9.074 0.005 -14.851 1.00 0.00 H new ATOM 0 HG1 THR A 83 8.520 2.345 -15.242 1.00 0.00 H new ATOM 0 HG21 THR A 83 7.791 1.336 -13.218 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.989 0.321 -12.382 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.297 2.059 -12.606 1.00 0.00 H new ATOM 1139 N ILE A 84 11.150 -1.165 -12.631 1.00 0.00 N ATOM 1140 CA ILE A 84 11.466 -1.794 -11.360 1.00 0.00 C ATOM 1141 C ILE A 84 12.981 -1.765 -11.145 1.00 0.00 C ATOM 1142 O ILE A 84 13.458 -1.250 -10.136 1.00 0.00 O ATOM 1143 CB ILE A 84 10.862 -3.197 -11.291 1.00 0.00 C ATOM 1144 CG1 ILE A 84 9.371 -3.170 -11.635 1.00 0.00 C ATOM 1145 CG2 ILE A 84 11.124 -3.841 -9.928 1.00 0.00 C ATOM 1146 CD1 ILE A 84 8.580 -2.387 -10.585 1.00 0.00 C ATOM 0 H ILE A 84 10.704 -1.780 -13.312 1.00 0.00 H new ATOM 0 HA ILE A 84 11.016 -1.238 -10.538 1.00 0.00 H new ATOM 0 HB ILE A 84 11.354 -3.817 -12.040 1.00 0.00 H new ATOM 0 HG12 ILE A 84 9.229 -2.716 -12.616 1.00 0.00 H new ATOM 0 HG13 ILE A 84 8.990 -4.189 -11.697 1.00 0.00 H new ATOM 0 HG21 ILE A 84 10.684 -4.838 -9.906 1.00 0.00 H new ATOM 0 HG22 ILE A 84 12.199 -3.915 -9.761 1.00 0.00 H new ATOM 0 HG23 ILE A 84 10.676 -3.229 -9.145 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.524 -2.383 -10.853 1.00 0.00 H new ATOM 0 HD12 ILE A 84 8.705 -2.858 -9.610 1.00 0.00 H new ATOM 0 HD13 ILE A 84 8.947 -1.362 -10.543 1.00 0.00 H new ATOM 1158 N ASP A 85 13.694 -2.325 -12.111 1.00 0.00 N ATOM 1159 CA ASP A 85 15.145 -2.371 -12.040 1.00 0.00 C ATOM 1160 C ASP A 85 15.675 -0.993 -11.637 1.00 0.00 C ATOM 1161 O ASP A 85 16.755 -0.884 -11.061 1.00 0.00 O ATOM 1162 CB ASP A 85 15.751 -2.732 -13.397 1.00 0.00 C ATOM 1163 CG ASP A 85 16.046 -4.220 -13.598 1.00 0.00 C ATOM 1164 OD1 ASP A 85 15.134 -5.060 -13.575 1.00 0.00 O ATOM 1165 OD2 ASP A 85 17.289 -4.509 -13.786 1.00 0.00 O ATOM 0 H ASP A 85 13.294 -2.751 -12.947 1.00 0.00 H new ATOM 0 HA ASP A 85 15.423 -3.129 -11.308 1.00 0.00 H new ATOM 0 HB2 ASP A 85 15.070 -2.403 -14.181 1.00 0.00 H new ATOM 0 HB3 ASP A 85 16.678 -2.173 -13.525 1.00 0.00 H new ATOM 1171 N GLU A 86 14.889 0.025 -11.957 1.00 0.00 N ATOM 1172 CA GLU A 86 15.265 1.391 -11.636 1.00 0.00 C ATOM 1173 C GLU A 86 14.989 1.684 -10.160 1.00 0.00 C ATOM 1174 O GLU A 86 15.860 2.183 -9.449 1.00 0.00 O ATOM 1175 CB GLU A 86 14.536 2.387 -12.539 1.00 0.00 C ATOM 1176 CG GLU A 86 15.381 3.643 -12.765 1.00 0.00 C ATOM 1177 CD GLU A 86 16.407 3.419 -13.878 1.00 0.00 C ATOM 1178 OE1 GLU A 86 16.074 2.835 -14.920 1.00 0.00 O ATOM 1179 OE2 GLU A 86 17.587 3.878 -13.631 1.00 0.00 O ATOM 0 H GLU A 86 13.993 -0.069 -12.435 1.00 0.00 H new ATOM 0 HA GLU A 86 16.334 1.505 -11.815 1.00 0.00 H new ATOM 0 HB2 GLU A 86 14.312 1.918 -13.497 1.00 0.00 H new ATOM 0 HB3 GLU A 86 13.583 2.662 -12.088 1.00 0.00 H new ATOM 0 HG2 GLU A 86 14.733 4.480 -13.026 1.00 0.00 H new ATOM 0 HG3 GLU A 86 15.894 3.912 -11.841 1.00 0.00 H new ATOM 1187 N LEU A 87 13.773 1.362 -9.743 1.00 0.00 N ATOM 1188 CA LEU A 87 13.371 1.585 -8.364 1.00 0.00 C ATOM 1189 C LEU A 87 14.366 0.893 -7.429 1.00 0.00 C ATOM 1190 O LEU A 87 14.446 1.224 -6.247 1.00 0.00 O ATOM 1191 CB LEU A 87 11.921 1.146 -8.151 1.00 0.00 C ATOM 1192 CG LEU A 87 10.896 1.722 -9.130 1.00 0.00 C ATOM 1193 CD1 LEU A 87 9.495 1.731 -8.515 1.00 0.00 C ATOM 1194 CD2 LEU A 87 11.319 3.111 -9.613 1.00 0.00 C ATOM 0 H LEU A 87 13.053 0.949 -10.336 1.00 0.00 H new ATOM 0 HA LEU A 87 13.396 2.649 -8.127 1.00 0.00 H new ATOM 0 HB2 LEU A 87 11.879 0.058 -8.210 1.00 0.00 H new ATOM 0 HB3 LEU A 87 11.623 1.422 -7.140 1.00 0.00 H new ATOM 0 HG LEU A 87 10.859 1.074 -10.006 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.786 2.145 -9.232 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.202 0.712 -8.262 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.498 2.342 -7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 87 10.573 3.497 -10.308 1.00 0.00 H new ATOM 0 HD22 LEU A 87 11.402 3.783 -8.759 1.00 0.00 H new ATOM 0 HD23 LEU A 87 12.283 3.043 -10.117 1.00 0.00 H new ATOM 1206 N LYS A 88 15.100 -0.054 -7.994 1.00 0.00 N ATOM 1207 CA LYS A 88 16.086 -0.795 -7.226 1.00 0.00 C ATOM 1208 C LYS A 88 17.409 -0.026 -7.227 1.00 0.00 C ATOM 1209 O LYS A 88 18.424 -0.529 -6.746 1.00 0.00 O ATOM 1210 CB LYS A 88 16.207 -2.228 -7.749 1.00 0.00 C ATOM 1211 CG LYS A 88 15.018 -3.078 -7.298 1.00 0.00 C ATOM 1212 CD LYS A 88 15.341 -4.570 -7.399 1.00 0.00 C ATOM 1213 CE LYS A 88 14.167 -5.346 -8.001 1.00 0.00 C ATOM 1214 NZ LYS A 88 14.155 -6.738 -7.499 1.00 0.00 N ATOM 0 H LYS A 88 15.032 -0.325 -8.975 1.00 0.00 H new ATOM 0 HA LYS A 88 15.770 -0.886 -6.187 1.00 0.00 H new ATOM 0 HB2 LYS A 88 16.260 -2.218 -8.838 1.00 0.00 H new ATOM 0 HB3 LYS A 88 17.134 -2.673 -7.389 1.00 0.00 H new ATOM 0 HG2 LYS A 88 14.757 -2.828 -6.270 1.00 0.00 H new ATOM 0 HG3 LYS A 88 14.148 -2.848 -7.913 1.00 0.00 H new ATOM 0 HD2 LYS A 88 16.229 -4.713 -8.014 1.00 0.00 H new ATOM 0 HD3 LYS A 88 15.572 -4.963 -6.409 1.00 0.00 H new ATOM 0 HE2 LYS A 88 13.229 -4.853 -7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 88 14.242 -5.346 -9.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 13.353 -7.251 -7.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 15.043 -7.210 -7.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 14.061 -6.733 -6.463 1.00 0.00 H new ATOM 1227 N THR A 89 17.356 1.180 -7.773 1.00 0.00 N ATOM 1228 CA THR A 89 18.537 2.023 -7.843 1.00 0.00 C ATOM 1229 C THR A 89 18.166 3.484 -7.585 1.00 0.00 C ATOM 1230 O THR A 89 18.985 4.381 -7.782 1.00 0.00 O ATOM 1231 CB THR A 89 19.200 1.795 -9.203 1.00 0.00 C ATOM 1232 OG1 THR A 89 20.560 2.169 -8.994 1.00 0.00 O ATOM 1233 CG2 THR A 89 18.704 2.776 -10.268 1.00 0.00 C ATOM 0 H THR A 89 16.513 1.594 -8.171 1.00 0.00 H new ATOM 0 HA THR A 89 19.256 1.762 -7.067 1.00 0.00 H new ATOM 0 HB THR A 89 19.009 0.774 -9.533 1.00 0.00 H new ATOM 0 HG1 THR A 89 20.595 3.004 -8.482 1.00 0.00 H new ATOM 0 HG21 THR A 89 19.206 2.571 -11.214 1.00 0.00 H new ATOM 0 HG22 THR A 89 17.628 2.661 -10.396 1.00 0.00 H new ATOM 0 HG23 THR A 89 18.925 3.796 -9.954 1.00 0.00 H new ATOM 1241 N ASN A 90 16.931 3.679 -7.148 1.00 0.00 N ATOM 1242 CA ASN A 90 16.441 5.016 -6.860 1.00 0.00 C ATOM 1243 C ASN A 90 16.059 5.108 -5.381 1.00 0.00 C ATOM 1244 O ASN A 90 15.725 4.101 -4.759 1.00 0.00 O ATOM 1245 CB ASN A 90 15.196 5.337 -7.690 1.00 0.00 C ATOM 1246 CG ASN A 90 15.263 4.663 -9.062 1.00 0.00 C ATOM 1247 OD1 ASN A 90 16.318 4.503 -9.653 1.00 0.00 O ATOM 1248 ND2 ASN A 90 14.080 4.277 -9.533 1.00 0.00 N ATOM 0 H ASN A 90 16.254 2.933 -6.986 1.00 0.00 H new ATOM 0 HA ASN A 90 17.232 5.725 -7.106 1.00 0.00 H new ATOM 0 HB2 ASN A 90 14.305 5.002 -7.160 1.00 0.00 H new ATOM 0 HB3 ASN A 90 15.106 6.416 -7.815 1.00 0.00 H new ATOM 0 HD21 ASN A 90 14.018 3.816 -10.441 1.00 0.00 H new ATOM 0 HD22 ASN A 90 13.235 4.442 -8.986 1.00 0.00 H new ATOM 1255 N SER A 91 16.123 6.325 -4.861 1.00 0.00 N ATOM 1256 CA SER A 91 15.788 6.562 -3.467 1.00 0.00 C ATOM 1257 C SER A 91 15.109 7.924 -3.316 1.00 0.00 C ATOM 1258 O SER A 91 15.135 8.519 -2.239 1.00 0.00 O ATOM 1259 CB SER A 91 17.033 6.488 -2.582 1.00 0.00 C ATOM 1260 OG SER A 91 16.701 6.366 -1.202 1.00 0.00 O ATOM 0 H SER A 91 16.402 7.158 -5.380 1.00 0.00 H new ATOM 0 HA SER A 91 15.098 5.782 -3.143 1.00 0.00 H new ATOM 0 HB2 SER A 91 17.643 5.637 -2.885 1.00 0.00 H new ATOM 0 HB3 SER A 91 17.638 7.382 -2.732 1.00 0.00 H new ATOM 0 HG SER A 91 16.021 7.032 -0.969 1.00 0.00 H new ATOM 1266 N SER A 92 14.517 8.380 -4.411 1.00 0.00 N ATOM 1267 CA SER A 92 13.832 9.661 -4.413 1.00 0.00 C ATOM 1268 C SER A 92 12.556 9.571 -5.252 1.00 0.00 C ATOM 1269 O SER A 92 11.498 10.037 -4.831 1.00 0.00 O ATOM 1270 CB SER A 92 14.741 10.770 -4.948 1.00 0.00 C ATOM 1271 OG SER A 92 15.370 11.497 -3.896 1.00 0.00 O ATOM 0 H SER A 92 14.498 7.885 -5.302 1.00 0.00 H new ATOM 0 HA SER A 92 13.567 9.909 -3.385 1.00 0.00 H new ATOM 0 HB2 SER A 92 15.503 10.334 -5.594 1.00 0.00 H new ATOM 0 HB3 SER A 92 14.156 11.454 -5.562 1.00 0.00 H new ATOM 0 HG SER A 92 15.943 12.195 -4.277 1.00 0.00 H new ATOM 1277 N LEU A 93 12.697 8.967 -6.423 1.00 0.00 N ATOM 1278 CA LEU A 93 11.568 8.810 -7.324 1.00 0.00 C ATOM 1279 C LEU A 93 10.711 7.630 -6.860 1.00 0.00 C ATOM 1280 O LEU A 93 9.498 7.622 -7.062 1.00 0.00 O ATOM 1281 CB LEU A 93 12.050 8.687 -8.771 1.00 0.00 C ATOM 1282 CG LEU A 93 11.736 7.365 -9.473 1.00 0.00 C ATOM 1283 CD1 LEU A 93 10.299 7.351 -9.998 1.00 0.00 C ATOM 1284 CD2 LEU A 93 12.753 7.077 -10.580 1.00 0.00 C ATOM 0 H LEU A 93 13.576 8.581 -6.768 1.00 0.00 H new ATOM 0 HA LEU A 93 10.934 9.696 -7.297 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.607 9.497 -9.350 1.00 0.00 H new ATOM 0 HB3 LEU A 93 13.130 8.836 -8.787 1.00 0.00 H new ATOM 0 HG LEU A 93 11.820 6.561 -8.741 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.102 6.400 -10.493 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.606 7.478 -9.166 1.00 0.00 H new ATOM 0 HD13 LEU A 93 10.164 8.165 -10.710 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.507 6.131 -11.063 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.725 7.879 -11.317 1.00 0.00 H new ATOM 0 HD23 LEU A 93 13.752 7.015 -10.149 1.00 0.00 H new ATOM 1296 N LEU A 94 11.376 6.662 -6.246 1.00 0.00 N ATOM 1297 CA LEU A 94 10.691 5.480 -5.752 1.00 0.00 C ATOM 1298 C LEU A 94 10.050 5.796 -4.399 1.00 0.00 C ATOM 1299 O LEU A 94 8.909 5.412 -4.144 1.00 0.00 O ATOM 1300 CB LEU A 94 11.644 4.284 -5.716 1.00 0.00 C ATOM 1301 CG LEU A 94 11.822 3.608 -4.355 1.00 0.00 C ATOM 1302 CD1 LEU A 94 10.925 2.375 -4.233 1.00 0.00 C ATOM 1303 CD2 LEU A 94 13.292 3.276 -4.096 1.00 0.00 C ATOM 0 H LEU A 94 12.382 6.672 -6.080 1.00 0.00 H new ATOM 0 HA LEU A 94 9.885 5.196 -6.429 1.00 0.00 H new ATOM 0 HB2 LEU A 94 11.286 3.538 -6.426 1.00 0.00 H new ATOM 0 HB3 LEU A 94 12.622 4.614 -6.066 1.00 0.00 H new ATOM 0 HG LEU A 94 11.510 4.310 -3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 94 11.071 1.914 -3.256 1.00 0.00 H new ATOM 0 HD12 LEU A 94 9.882 2.672 -4.341 1.00 0.00 H new ATOM 0 HD13 LEU A 94 11.182 1.660 -5.014 1.00 0.00 H new ATOM 0 HD21 LEU A 94 13.391 2.796 -3.122 1.00 0.00 H new ATOM 0 HD22 LEU A 94 13.655 2.601 -4.871 1.00 0.00 H new ATOM 0 HD23 LEU A 94 13.880 4.194 -4.110 1.00 0.00 H new ATOM 1315 N THR A 95 10.810 6.493 -3.568 1.00 0.00 N ATOM 1316 CA THR A 95 10.331 6.865 -2.248 1.00 0.00 C ATOM 1317 C THR A 95 8.995 7.603 -2.354 1.00 0.00 C ATOM 1318 O THR A 95 8.071 7.337 -1.587 1.00 0.00 O ATOM 1319 CB THR A 95 11.425 7.685 -1.561 1.00 0.00 C ATOM 1320 OG1 THR A 95 11.315 7.327 -0.186 1.00 0.00 O ATOM 1321 CG2 THR A 95 11.131 9.186 -1.580 1.00 0.00 C ATOM 0 H THR A 95 11.755 6.810 -3.783 1.00 0.00 H new ATOM 0 HA THR A 95 10.133 5.984 -1.637 1.00 0.00 H new ATOM 0 HB THR A 95 12.381 7.496 -2.050 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.990 7.812 0.333 1.00 0.00 H new ATOM 0 HG21 THR A 95 11.938 9.721 -1.080 1.00 0.00 H new ATOM 0 HG22 THR A 95 11.053 9.529 -2.612 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.192 9.379 -1.062 1.00 0.00 H new ATOM 1329 N SER A 96 8.935 8.516 -3.313 1.00 0.00 N ATOM 1330 CA SER A 96 7.727 9.295 -3.529 1.00 0.00 C ATOM 1331 C SER A 96 6.527 8.362 -3.702 1.00 0.00 C ATOM 1332 O SER A 96 5.439 8.645 -3.202 1.00 0.00 O ATOM 1333 CB SER A 96 7.871 10.206 -4.750 1.00 0.00 C ATOM 1334 OG SER A 96 9.194 10.718 -4.880 1.00 0.00 O ATOM 0 H SER A 96 9.703 8.734 -3.949 1.00 0.00 H new ATOM 0 HA SER A 96 7.566 9.926 -2.655 1.00 0.00 H new ATOM 0 HB2 SER A 96 7.607 9.651 -5.650 1.00 0.00 H new ATOM 0 HB3 SER A 96 7.168 11.035 -4.669 1.00 0.00 H new ATOM 0 HG SER A 96 9.793 10.004 -5.183 1.00 0.00 H new ATOM 1340 N ILE A 97 6.765 7.269 -4.412 1.00 0.00 N ATOM 1341 CA ILE A 97 5.717 6.293 -4.657 1.00 0.00 C ATOM 1342 C ILE A 97 5.304 5.650 -3.332 1.00 0.00 C ATOM 1343 O ILE A 97 4.152 5.764 -2.915 1.00 0.00 O ATOM 1344 CB ILE A 97 6.163 5.283 -5.717 1.00 0.00 C ATOM 1345 CG1 ILE A 97 5.893 5.813 -7.127 1.00 0.00 C ATOM 1346 CG2 ILE A 97 5.511 3.919 -5.483 1.00 0.00 C ATOM 1347 CD1 ILE A 97 7.078 5.534 -8.054 1.00 0.00 C ATOM 0 H ILE A 97 7.668 7.038 -4.825 1.00 0.00 H new ATOM 0 HA ILE A 97 4.831 6.780 -5.065 1.00 0.00 H new ATOM 0 HB ILE A 97 7.240 5.145 -5.626 1.00 0.00 H new ATOM 0 HG12 ILE A 97 4.994 5.346 -7.529 1.00 0.00 H new ATOM 0 HG13 ILE A 97 5.703 6.886 -7.086 1.00 0.00 H new ATOM 0 HG21 ILE A 97 5.845 3.220 -6.250 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.796 3.543 -4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.427 4.021 -5.532 1.00 0.00 H new ATOM 0 HD11 ILE A 97 6.860 5.921 -9.050 1.00 0.00 H new ATOM 0 HD12 ILE A 97 7.970 6.023 -7.662 1.00 0.00 H new ATOM 0 HD13 ILE A 97 7.249 4.459 -8.112 1.00 0.00 H new ATOM 1359 N LEU A 98 6.267 4.989 -2.706 1.00 0.00 N ATOM 1360 CA LEU A 98 6.017 4.329 -1.436 1.00 0.00 C ATOM 1361 C LEU A 98 5.216 5.264 -0.528 1.00 0.00 C ATOM 1362 O LEU A 98 4.088 4.953 -0.151 1.00 0.00 O ATOM 1363 CB LEU A 98 7.330 3.846 -0.816 1.00 0.00 C ATOM 1364 CG LEU A 98 8.494 3.638 -1.788 1.00 0.00 C ATOM 1365 CD1 LEU A 98 9.714 3.061 -1.066 1.00 0.00 C ATOM 1366 CD2 LEU A 98 8.068 2.773 -2.975 1.00 0.00 C ATOM 0 H LEU A 98 7.221 4.896 -3.055 1.00 0.00 H new ATOM 0 HA LEU A 98 5.413 3.434 -1.585 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.639 4.568 -0.060 1.00 0.00 H new ATOM 0 HB3 LEU A 98 7.141 2.905 -0.300 1.00 0.00 H new ATOM 0 HG LEU A 98 8.785 4.610 -2.186 1.00 0.00 H new ATOM 0 HD11 LEU A 98 10.527 2.923 -1.779 1.00 0.00 H new ATOM 0 HD12 LEU A 98 10.032 3.749 -0.282 1.00 0.00 H new ATOM 0 HD13 LEU A 98 9.453 2.100 -0.622 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.913 2.640 -3.650 1.00 0.00 H new ATOM 0 HD22 LEU A 98 7.735 1.800 -2.615 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.252 3.262 -3.507 1.00 0.00 H new ATOM 1378 N THR A 99 5.832 6.392 -0.203 1.00 0.00 N ATOM 1379 CA THR A 99 5.190 7.375 0.653 1.00 0.00 C ATOM 1380 C THR A 99 3.729 7.568 0.242 1.00 0.00 C ATOM 1381 O THR A 99 2.829 7.489 1.077 1.00 0.00 O ATOM 1382 CB THR A 99 6.013 8.663 0.594 1.00 0.00 C ATOM 1383 OG1 THR A 99 6.185 8.902 -0.800 1.00 0.00 O ATOM 1384 CG2 THR A 99 7.439 8.471 1.117 1.00 0.00 C ATOM 0 H THR A 99 6.768 6.647 -0.517 1.00 0.00 H new ATOM 0 HA THR A 99 5.161 7.038 1.689 1.00 0.00 H new ATOM 0 HB THR A 99 5.514 9.439 1.175 1.00 0.00 H new ATOM 0 HG1 THR A 99 7.076 8.603 -1.076 1.00 0.00 H new ATOM 0 HG21 THR A 99 7.980 9.415 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 99 7.404 8.142 2.156 1.00 0.00 H new ATOM 0 HG23 THR A 99 7.949 7.719 0.515 1.00 0.00 H new ATOM 1392 N TYR A 100 3.539 7.818 -1.045 1.00 0.00 N ATOM 1393 CA TYR A 100 2.202 8.023 -1.578 1.00 0.00 C ATOM 1394 C TYR A 100 1.304 6.821 -1.283 1.00 0.00 C ATOM 1395 O TYR A 100 0.080 6.944 -1.272 1.00 0.00 O ATOM 1396 CB TYR A 100 2.369 8.162 -3.093 1.00 0.00 C ATOM 1397 CG TYR A 100 1.101 8.615 -3.819 1.00 0.00 C ATOM 1398 CD1 TYR A 100 -0.018 8.974 -3.095 1.00 0.00 C ATOM 1399 CD2 TYR A 100 1.077 8.666 -5.198 1.00 0.00 C ATOM 1400 CE1 TYR A 100 -1.211 9.401 -3.779 1.00 0.00 C ATOM 1401 CE2 TYR A 100 -0.117 9.093 -5.882 1.00 0.00 C ATOM 1402 CZ TYR A 100 -1.202 9.440 -5.138 1.00 0.00 C ATOM 1403 OH TYR A 100 -2.329 9.843 -5.784 1.00 0.00 O ATOM 0 H TYR A 100 4.288 7.883 -1.734 1.00 0.00 H new ATOM 0 HA TYR A 100 1.739 8.900 -1.127 1.00 0.00 H new ATOM 0 HB2 TYR A 100 3.167 8.876 -3.296 1.00 0.00 H new ATOM 0 HB3 TYR A 100 2.687 7.203 -3.503 1.00 0.00 H new ATOM 0 HD1 TYR A 100 0.001 8.935 -2.016 1.00 0.00 H new ATOM 0 HD2 TYR A 100 1.953 8.386 -5.764 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -2.094 9.684 -3.225 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -0.150 9.137 -6.961 1.00 0.00 H new ATOM 0 HH TYR A 100 -2.549 10.760 -5.517 1.00 0.00 H new ATOM 1413 N HIS A 101 1.946 5.685 -1.053 1.00 0.00 N ATOM 1414 CA HIS A 101 1.220 4.461 -0.759 1.00 0.00 C ATOM 1415 C HIS A 101 1.023 4.332 0.753 1.00 0.00 C ATOM 1416 O HIS A 101 0.853 3.228 1.268 1.00 0.00 O ATOM 1417 CB HIS A 101 1.927 3.250 -1.370 1.00 0.00 C ATOM 1418 CG HIS A 101 1.604 3.021 -2.828 1.00 0.00 C ATOM 1419 ND1 HIS A 101 0.471 2.347 -3.248 1.00 0.00 N ATOM 1420 CD2 HIS A 101 2.277 3.385 -3.957 1.00 0.00 C ATOM 1421 CE1 HIS A 101 0.472 2.311 -4.572 1.00 0.00 C ATOM 1422 NE2 HIS A 101 1.592 2.955 -5.010 1.00 0.00 N ATOM 0 H HIS A 101 2.961 5.586 -1.064 1.00 0.00 H new ATOM 0 HA HIS A 101 0.232 4.501 -1.217 1.00 0.00 H new ATOM 0 HB2 HIS A 101 3.004 3.379 -1.263 1.00 0.00 H new ATOM 0 HB3 HIS A 101 1.655 2.359 -0.804 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -0.244 1.946 -2.641 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.209 3.930 -3.989 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.281 1.852 -5.195 1.00 0.00 H new ATOM 1430 N VAL A 102 1.053 5.475 1.421 1.00 0.00 N ATOM 1431 CA VAL A 102 0.879 5.504 2.863 1.00 0.00 C ATOM 1432 C VAL A 102 0.527 6.926 3.302 1.00 0.00 C ATOM 1433 O VAL A 102 1.358 7.829 3.221 1.00 0.00 O ATOM 1434 CB VAL A 102 2.132 4.959 3.552 1.00 0.00 C ATOM 1435 CG1 VAL A 102 3.398 5.392 2.809 1.00 0.00 C ATOM 1436 CG2 VAL A 102 2.183 5.390 5.019 1.00 0.00 C ATOM 0 H VAL A 102 1.195 6.389 0.990 1.00 0.00 H new ATOM 0 HA VAL A 102 0.053 4.858 3.161 1.00 0.00 H new ATOM 0 HB VAL A 102 2.083 3.870 3.525 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.274 4.992 3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.368 5.013 1.787 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.455 6.480 2.791 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.083 4.989 5.485 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.197 6.478 5.078 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.305 5.010 5.541 1.00 0.00 H new ATOM 1446 N VAL A 103 -0.707 7.082 3.759 1.00 0.00 N ATOM 1447 CA VAL A 103 -1.180 8.379 4.210 1.00 0.00 C ATOM 1448 C VAL A 103 -0.994 8.486 5.725 1.00 0.00 C ATOM 1449 O VAL A 103 -1.054 7.483 6.434 1.00 0.00 O ATOM 1450 CB VAL A 103 -2.630 8.590 3.770 1.00 0.00 C ATOM 1451 CG1 VAL A 103 -3.231 9.831 4.435 1.00 0.00 C ATOM 1452 CG2 VAL A 103 -2.733 8.681 2.246 1.00 0.00 C ATOM 0 H VAL A 103 -1.394 6.331 3.826 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.596 9.178 3.753 1.00 0.00 H new ATOM 0 HB VAL A 103 -3.207 7.724 4.094 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.262 9.957 4.105 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -3.209 9.710 5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -2.650 10.710 4.156 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -3.774 8.831 1.960 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.135 9.520 1.890 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.364 7.757 1.801 1.00 0.00 H new ATOM 1462 N ALA A 104 -0.772 9.712 6.177 1.00 0.00 N ATOM 1463 CA ALA A 104 -0.577 9.963 7.595 1.00 0.00 C ATOM 1464 C ALA A 104 -1.925 10.283 8.242 1.00 0.00 C ATOM 1465 O ALA A 104 -2.388 11.421 8.192 1.00 0.00 O ATOM 1466 CB ALA A 104 0.440 11.091 7.778 1.00 0.00 C ATOM 0 H ALA A 104 -0.723 10.542 5.586 1.00 0.00 H new ATOM 0 HA ALA A 104 -0.176 9.079 8.090 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.587 11.280 8.841 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.389 10.802 7.326 1.00 0.00 H new ATOM 0 HB3 ALA A 104 0.070 11.996 7.297 1.00 0.00 H new ATOM 1472 N GLY A 105 -2.519 9.257 8.835 1.00 0.00 N ATOM 1473 CA GLY A 105 -3.806 9.415 9.492 1.00 0.00 C ATOM 1474 C GLY A 105 -4.722 8.226 9.196 1.00 0.00 C ATOM 1475 O GLY A 105 -5.243 8.100 8.089 1.00 0.00 O ATOM 0 H GLY A 105 -2.133 8.314 8.874 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -3.660 9.507 10.568 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.280 10.337 9.154 1.00 0.00 H new ATOM 1479 N GLN A 106 -4.890 7.383 10.204 1.00 0.00 N ATOM 1480 CA GLN A 106 -5.734 6.209 10.066 1.00 0.00 C ATOM 1481 C GLN A 106 -7.187 6.625 9.828 1.00 0.00 C ATOM 1482 O GLN A 106 -7.716 7.480 10.537 1.00 0.00 O ATOM 1483 CB GLN A 106 -5.617 5.302 11.292 1.00 0.00 C ATOM 1484 CG GLN A 106 -5.198 3.886 10.889 1.00 0.00 C ATOM 1485 CD GLN A 106 -6.025 2.837 11.634 1.00 0.00 C ATOM 1486 OE1 GLN A 106 -7.284 2.742 11.215 1.00 0.00 O flip ATOM 1487 NE2 GLN A 106 -5.552 2.158 12.531 1.00 0.00 N flip ATOM 0 H GLN A 106 -4.455 7.490 11.121 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.393 5.640 9.201 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -4.887 5.717 11.987 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.572 5.267 11.816 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.324 3.758 9.814 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -4.140 3.741 11.105 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.577 2.281 12.804 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -6.132 1.467 13.008 1.00 0.00 H new ATOM 1496 N THR A 107 -7.792 6.000 8.828 1.00 0.00 N ATOM 1497 CA THR A 107 -9.174 6.295 8.488 1.00 0.00 C ATOM 1498 C THR A 107 -9.847 5.064 7.877 1.00 0.00 C ATOM 1499 O THR A 107 -9.276 4.408 7.007 1.00 0.00 O ATOM 1500 CB THR A 107 -9.184 7.514 7.564 1.00 0.00 C ATOM 1501 OG1 THR A 107 -8.832 8.600 8.418 1.00 0.00 O ATOM 1502 CG2 THR A 107 -10.589 7.866 7.074 1.00 0.00 C ATOM 0 H THR A 107 -7.351 5.291 8.243 1.00 0.00 H new ATOM 0 HA THR A 107 -9.757 6.538 9.377 1.00 0.00 H new ATOM 0 HB THR A 107 -8.538 7.325 6.707 1.00 0.00 H new ATOM 0 HG1 THR A 107 -8.777 8.283 9.344 1.00 0.00 H new ATOM 0 HG21 THR A 107 -10.539 8.738 6.422 1.00 0.00 H new ATOM 0 HG22 THR A 107 -11.003 7.023 6.521 1.00 0.00 H new ATOM 0 HG23 THR A 107 -11.227 8.088 7.929 1.00 0.00 H new ATOM 1510 N SER A 108 -11.050 4.788 8.358 1.00 0.00 N ATOM 1511 CA SER A 108 -11.807 3.648 7.870 1.00 0.00 C ATOM 1512 C SER A 108 -12.213 3.874 6.412 1.00 0.00 C ATOM 1513 O SER A 108 -12.134 4.993 5.909 1.00 0.00 O ATOM 1514 CB SER A 108 -13.045 3.398 8.733 1.00 0.00 C ATOM 1515 OG SER A 108 -13.525 4.597 9.336 1.00 0.00 O ATOM 0 H SER A 108 -11.519 5.334 9.081 1.00 0.00 H new ATOM 0 HA SER A 108 -11.171 2.765 7.931 1.00 0.00 H new ATOM 0 HB2 SER A 108 -13.832 2.960 8.120 1.00 0.00 H new ATOM 0 HB3 SER A 108 -12.805 2.672 9.510 1.00 0.00 H new ATOM 0 HG SER A 108 -14.317 4.397 9.877 1.00 0.00 H new ATOM 1521 N PRO A 109 -12.648 2.764 5.758 1.00 0.00 N ATOM 1522 CA PRO A 109 -13.067 2.830 4.368 1.00 0.00 C ATOM 1523 C PRO A 109 -14.442 3.488 4.240 1.00 0.00 C ATOM 1524 O PRO A 109 -15.333 2.950 3.584 1.00 0.00 O ATOM 1525 CB PRO A 109 -13.050 1.390 3.883 1.00 0.00 C ATOM 1526 CG PRO A 109 -13.074 0.528 5.135 1.00 0.00 C ATOM 1527 CD PRO A 109 -12.754 1.421 6.322 1.00 0.00 C ATOM 0 HA PRO A 109 -12.408 3.449 3.759 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -13.912 1.181 3.249 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -12.159 1.189 3.287 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -14.052 0.063 5.260 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -12.345 -0.279 5.057 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -13.537 1.370 7.078 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -11.824 1.120 6.805 1.00 0.00 H new ATOM 1535 N ALA A 110 -14.572 4.642 4.877 1.00 0.00 N ATOM 1536 CA ALA A 110 -15.824 5.379 4.843 1.00 0.00 C ATOM 1537 C ALA A 110 -15.538 6.849 4.530 1.00 0.00 C ATOM 1538 O ALA A 110 -16.201 7.448 3.684 1.00 0.00 O ATOM 1539 CB ALA A 110 -16.559 5.199 6.173 1.00 0.00 C ATOM 0 H ALA A 110 -13.831 5.085 5.420 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.474 4.995 4.056 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -17.498 5.752 6.147 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.765 4.141 6.335 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -15.938 5.576 6.986 1.00 0.00 H new ATOM 1545 N ASN A 111 -14.549 7.388 5.228 1.00 0.00 N ATOM 1546 CA ASN A 111 -14.166 8.776 5.034 1.00 0.00 C ATOM 1547 C ASN A 111 -12.987 8.845 4.062 1.00 0.00 C ATOM 1548 O ASN A 111 -12.820 9.836 3.352 1.00 0.00 O ATOM 1549 CB ASN A 111 -13.729 9.416 6.354 1.00 0.00 C ATOM 1550 CG ASN A 111 -14.940 9.791 7.209 1.00 0.00 C ATOM 1551 OD1 ASN A 111 -16.046 9.316 7.009 1.00 0.00 O ATOM 1552 ND2 ASN A 111 -14.671 10.668 8.172 1.00 0.00 N ATOM 0 H ASN A 111 -14.001 6.888 5.929 1.00 0.00 H new ATOM 0 HA ASN A 111 -15.030 9.312 4.641 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -13.091 8.724 6.904 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -13.133 10.306 6.151 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -15.413 10.982 8.798 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -13.723 11.027 8.285 1.00 0.00 H new ATOM 1559 N VAL A 112 -12.200 7.780 4.060 1.00 0.00 N ATOM 1560 CA VAL A 112 -11.041 7.707 3.186 1.00 0.00 C ATOM 1561 C VAL A 112 -11.441 8.154 1.778 1.00 0.00 C ATOM 1562 O VAL A 112 -10.599 8.610 1.006 1.00 0.00 O ATOM 1563 CB VAL A 112 -10.448 6.297 3.220 1.00 0.00 C ATOM 1564 CG1 VAL A 112 -11.074 5.413 2.139 1.00 0.00 C ATOM 1565 CG2 VAL A 112 -8.925 6.339 3.080 1.00 0.00 C ATOM 0 H VAL A 112 -12.342 6.960 4.650 1.00 0.00 H new ATOM 0 HA VAL A 112 -10.258 8.382 3.532 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.683 5.858 4.190 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -10.635 4.416 2.185 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -12.149 5.344 2.303 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.884 5.848 1.158 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -8.529 5.324 3.107 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -8.660 6.807 2.132 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.500 6.916 3.901 1.00 0.00 H new ATOM 1575 N VAL A 113 -12.725 8.007 1.487 1.00 0.00 N ATOM 1576 CA VAL A 113 -13.246 8.389 0.186 1.00 0.00 C ATOM 1577 C VAL A 113 -13.045 9.892 -0.017 1.00 0.00 C ATOM 1578 O VAL A 113 -13.344 10.688 0.872 1.00 0.00 O ATOM 1579 CB VAL A 113 -14.709 7.960 0.062 1.00 0.00 C ATOM 1580 CG1 VAL A 113 -15.318 8.460 -1.250 1.00 0.00 C ATOM 1581 CG2 VAL A 113 -14.847 6.441 0.186 1.00 0.00 C ATOM 0 H VAL A 113 -13.420 7.628 2.130 1.00 0.00 H new ATOM 0 HA VAL A 113 -12.703 7.878 -0.609 1.00 0.00 H new ATOM 0 HB VAL A 113 -15.262 8.415 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -16.358 8.141 -1.313 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -15.269 9.548 -1.282 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -14.761 8.047 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -15.897 6.162 0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -14.273 5.958 -0.605 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -14.470 6.119 1.157 1.00 0.00 H new ATOM 1591 N GLY A 114 -12.540 10.236 -1.193 1.00 0.00 N ATOM 1592 CA GLY A 114 -12.296 11.629 -1.524 1.00 0.00 C ATOM 1593 C GLY A 114 -10.799 11.900 -1.686 1.00 0.00 C ATOM 1594 O GLY A 114 -9.988 10.977 -1.628 1.00 0.00 O ATOM 0 H GLY A 114 -12.293 9.573 -1.928 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -12.817 11.884 -2.447 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -12.702 12.269 -0.741 1.00 0.00 H new ATOM 1598 N THR A 115 -10.478 13.170 -1.885 1.00 0.00 N ATOM 1599 CA THR A 115 -9.093 13.574 -2.056 1.00 0.00 C ATOM 1600 C THR A 115 -8.353 13.521 -0.717 1.00 0.00 C ATOM 1601 O THR A 115 -8.532 14.395 0.130 1.00 0.00 O ATOM 1602 CB THR A 115 -9.081 14.961 -2.702 1.00 0.00 C ATOM 1603 OG1 THR A 115 -9.752 14.770 -3.945 1.00 0.00 O ATOM 1604 CG2 THR A 115 -7.673 15.407 -3.104 1.00 0.00 C ATOM 0 H THR A 115 -11.154 13.933 -1.932 1.00 0.00 H new ATOM 0 HA THR A 115 -8.559 12.888 -2.714 1.00 0.00 H new ATOM 0 HB THR A 115 -9.509 15.687 -2.011 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.791 15.621 -4.430 1.00 0.00 H new ATOM 0 HG21 THR A 115 -7.721 16.397 -3.557 1.00 0.00 H new ATOM 0 HG22 THR A 115 -7.036 15.443 -2.220 1.00 0.00 H new ATOM 0 HG23 THR A 115 -7.258 14.699 -3.821 1.00 0.00 H new ATOM 1612 N ARG A 116 -7.537 12.488 -0.568 1.00 0.00 N ATOM 1613 CA ARG A 116 -6.770 12.310 0.652 1.00 0.00 C ATOM 1614 C ARG A 116 -5.301 12.663 0.412 1.00 0.00 C ATOM 1615 O ARG A 116 -4.779 12.453 -0.682 1.00 0.00 O ATOM 1616 CB ARG A 116 -6.865 10.869 1.157 1.00 0.00 C ATOM 1617 CG ARG A 116 -5.775 10.577 2.191 1.00 0.00 C ATOM 1618 CD ARG A 116 -6.129 11.187 3.548 1.00 0.00 C ATOM 1619 NE ARG A 116 -5.152 12.240 3.901 1.00 0.00 N ATOM 1620 CZ ARG A 116 -5.417 13.272 4.730 1.00 0.00 C ATOM 1621 NH1 ARG A 116 -6.634 13.398 5.300 1.00 0.00 N ATOM 1622 NH2 ARG A 116 -4.468 14.157 4.975 1.00 0.00 N ATOM 0 H ARG A 116 -7.391 11.765 -1.273 1.00 0.00 H new ATOM 0 HA ARG A 116 -7.189 12.976 1.407 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.846 10.699 1.600 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -6.770 10.179 0.319 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -5.647 9.500 2.295 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -4.823 10.979 1.845 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -7.134 11.608 3.515 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -6.133 10.412 4.314 1.00 0.00 H new ATOM 0 HE ARG A 116 -4.219 12.183 3.492 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -7.362 12.710 5.106 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -6.826 14.181 5.925 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -3.551 14.055 4.540 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -4.652 14.943 5.599 1.00 0.00 H new ATOM 1635 N GLN A 117 -4.675 13.194 1.453 1.00 0.00 N ATOM 1636 CA GLN A 117 -3.277 13.579 1.368 1.00 0.00 C ATOM 1637 C GLN A 117 -2.383 12.444 1.873 1.00 0.00 C ATOM 1638 O GLN A 117 -2.578 11.940 2.979 1.00 0.00 O ATOM 1639 CB GLN A 117 -3.015 14.870 2.146 1.00 0.00 C ATOM 1640 CG GLN A 117 -1.625 15.427 1.832 1.00 0.00 C ATOM 1641 CD GLN A 117 -1.192 16.446 2.889 1.00 0.00 C ATOM 1642 OE1 GLN A 117 -1.411 17.639 2.764 1.00 0.00 O ATOM 1643 NE2 GLN A 117 -0.566 15.909 3.932 1.00 0.00 N ATOM 0 H GLN A 117 -5.111 13.366 2.359 1.00 0.00 H new ATOM 0 HA GLN A 117 -3.036 13.769 0.322 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -3.773 15.611 1.893 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -3.101 14.678 3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.903 14.611 1.791 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -1.631 15.898 0.849 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -0.416 14.901 3.973 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -0.236 16.505 4.691 1.00 0.00 H new ATOM 1652 N THR A 118 -1.422 12.075 1.040 1.00 0.00 N ATOM 1653 CA THR A 118 -0.497 11.009 1.388 1.00 0.00 C ATOM 1654 C THR A 118 0.839 11.593 1.852 1.00 0.00 C ATOM 1655 O THR A 118 1.106 12.777 1.653 1.00 0.00 O ATOM 1656 CB THR A 118 -0.368 10.082 0.178 1.00 0.00 C ATOM 1657 OG1 THR A 118 0.505 10.782 -0.705 1.00 0.00 O ATOM 1658 CG2 THR A 118 -1.674 9.960 -0.609 1.00 0.00 C ATOM 0 H THR A 118 -1.263 12.495 0.124 1.00 0.00 H new ATOM 0 HA THR A 118 -0.868 10.421 2.228 1.00 0.00 H new ATOM 0 HB THR A 118 -0.052 9.094 0.511 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.333 10.499 -1.627 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.527 9.291 -1.457 1.00 0.00 H new ATOM 0 HG22 THR A 118 -2.453 9.559 0.039 1.00 0.00 H new ATOM 0 HG23 THR A 118 -1.974 10.943 -0.971 1.00 0.00 H new ATOM 1666 N LEU A 119 1.643 10.734 2.462 1.00 0.00 N ATOM 1667 CA LEU A 119 2.944 11.150 2.957 1.00 0.00 C ATOM 1668 C LEU A 119 3.682 11.915 1.856 1.00 0.00 C ATOM 1669 O LEU A 119 4.127 13.042 2.071 1.00 0.00 O ATOM 1670 CB LEU A 119 3.721 9.947 3.496 1.00 0.00 C ATOM 1671 CG LEU A 119 3.262 9.405 4.851 1.00 0.00 C ATOM 1672 CD1 LEU A 119 4.223 8.331 5.366 1.00 0.00 C ATOM 1673 CD2 LEU A 119 3.075 10.539 5.861 1.00 0.00 C ATOM 0 H LEU A 119 1.418 9.752 2.624 1.00 0.00 H new ATOM 0 HA LEU A 119 2.831 11.832 3.800 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.658 9.141 2.764 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.772 10.224 3.575 1.00 0.00 H new ATOM 0 HG LEU A 119 2.290 8.930 4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.874 7.962 6.331 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.262 7.506 4.655 1.00 0.00 H new ATOM 0 HD13 LEU A 119 5.219 8.759 5.480 1.00 0.00 H new ATOM 0 HD21 LEU A 119 2.749 10.126 6.815 1.00 0.00 H new ATOM 0 HD22 LEU A 119 4.020 11.064 5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.323 11.236 5.491 1.00 0.00 H new ATOM 1685 N GLN A 120 3.790 11.273 0.703 1.00 0.00 N ATOM 1686 CA GLN A 120 4.466 11.880 -0.431 1.00 0.00 C ATOM 1687 C GLN A 120 3.945 13.299 -0.663 1.00 0.00 C ATOM 1688 O GLN A 120 4.688 14.171 -1.111 1.00 0.00 O ATOM 1689 CB GLN A 120 4.303 11.024 -1.689 1.00 0.00 C ATOM 1690 CG GLN A 120 4.996 11.674 -2.888 1.00 0.00 C ATOM 1691 CD GLN A 120 6.272 12.399 -2.457 1.00 0.00 C ATOM 1692 OE1 GLN A 120 7.067 11.901 -1.677 1.00 0.00 O ATOM 1693 NE2 GLN A 120 6.424 13.600 -3.008 1.00 0.00 N ATOM 0 H GLN A 120 3.421 10.338 0.529 1.00 0.00 H new ATOM 0 HA GLN A 120 5.531 11.937 -0.205 1.00 0.00 H new ATOM 0 HB2 GLN A 120 4.722 10.033 -1.516 1.00 0.00 H new ATOM 0 HB3 GLN A 120 3.243 10.889 -1.906 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.239 10.912 -3.629 1.00 0.00 H new ATOM 0 HG3 GLN A 120 4.317 12.379 -3.367 1.00 0.00 H new ATOM 0 HE21 GLN A 120 5.720 13.958 -3.654 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.245 14.163 -2.785 1.00 0.00 H new ATOM 1702 N GLY A 121 2.673 13.487 -0.346 1.00 0.00 N ATOM 1703 CA GLY A 121 2.044 14.787 -0.514 1.00 0.00 C ATOM 1704 C GLY A 121 0.902 14.716 -1.530 1.00 0.00 C ATOM 1705 O GLY A 121 -0.152 15.316 -1.327 1.00 0.00 O ATOM 0 H GLY A 121 2.060 12.761 0.026 1.00 0.00 H new ATOM 0 HA2 GLY A 121 1.661 15.137 0.445 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.786 15.514 -0.845 1.00 0.00 H new ATOM 1709 N ALA A 122 1.151 13.978 -2.601 1.00 0.00 N ATOM 1710 CA ALA A 122 0.157 13.821 -3.649 1.00 0.00 C ATOM 1711 C ALA A 122 -1.177 13.408 -3.024 1.00 0.00 C ATOM 1712 O ALA A 122 -1.202 12.759 -1.979 1.00 0.00 O ATOM 1713 CB ALA A 122 0.656 12.806 -4.679 1.00 0.00 C ATOM 0 H ALA A 122 2.027 13.482 -2.766 1.00 0.00 H new ATOM 0 HA ALA A 122 -0.001 14.765 -4.171 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -0.090 12.689 -5.465 1.00 0.00 H new ATOM 0 HB2 ALA A 122 1.590 13.160 -5.115 1.00 0.00 H new ATOM 0 HB3 ALA A 122 0.824 11.846 -4.192 1.00 0.00 H new ATOM 1719 N SER A 123 -2.253 13.801 -3.689 1.00 0.00 N ATOM 1720 CA SER A 123 -3.587 13.480 -3.211 1.00 0.00 C ATOM 1721 C SER A 123 -4.015 12.108 -3.735 1.00 0.00 C ATOM 1722 O SER A 123 -3.474 11.623 -4.728 1.00 0.00 O ATOM 1723 CB SER A 123 -4.597 14.549 -3.636 1.00 0.00 C ATOM 1724 OG SER A 123 -4.506 14.846 -5.026 1.00 0.00 O ATOM 0 H SER A 123 -2.228 14.339 -4.555 1.00 0.00 H new ATOM 0 HA SER A 123 -3.562 13.454 -2.122 1.00 0.00 H new ATOM 0 HB2 SER A 123 -5.606 14.208 -3.403 1.00 0.00 H new ATOM 0 HB3 SER A 123 -4.427 15.458 -3.059 1.00 0.00 H new ATOM 0 HG SER A 123 -5.167 15.531 -5.258 1.00 0.00 H new ATOM 1730 N VAL A 124 -4.982 11.521 -3.045 1.00 0.00 N ATOM 1731 CA VAL A 124 -5.488 10.214 -3.429 1.00 0.00 C ATOM 1732 C VAL A 124 -7.001 10.299 -3.636 1.00 0.00 C ATOM 1733 O VAL A 124 -7.764 10.312 -2.670 1.00 0.00 O ATOM 1734 CB VAL A 124 -5.085 9.170 -2.386 1.00 0.00 C ATOM 1735 CG1 VAL A 124 -4.227 8.069 -3.015 1.00 0.00 C ATOM 1736 CG2 VAL A 124 -4.360 9.823 -1.208 1.00 0.00 C ATOM 0 H VAL A 124 -5.428 11.926 -2.222 1.00 0.00 H new ATOM 0 HA VAL A 124 -5.048 9.896 -4.374 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.996 8.709 -2.005 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -3.954 7.340 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.792 7.574 -3.805 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.323 8.508 -3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -4.085 9.059 -0.481 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.461 10.324 -1.567 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.017 10.553 -0.735 1.00 0.00 H new ATOM 1746 N THR A 125 -7.392 10.354 -4.901 1.00 0.00 N ATOM 1747 CA THR A 125 -8.800 10.437 -5.247 1.00 0.00 C ATOM 1748 C THR A 125 -9.506 9.117 -4.930 1.00 0.00 C ATOM 1749 O THR A 125 -9.847 8.358 -5.836 1.00 0.00 O ATOM 1750 CB THR A 125 -8.903 10.843 -6.718 1.00 0.00 C ATOM 1751 OG1 THR A 125 -8.449 12.194 -6.738 1.00 0.00 O ATOM 1752 CG2 THR A 125 -10.352 10.929 -7.202 1.00 0.00 C ATOM 0 H THR A 125 -6.757 10.343 -5.699 1.00 0.00 H new ATOM 0 HA THR A 125 -9.310 11.193 -4.650 1.00 0.00 H new ATOM 0 HB THR A 125 -8.358 10.126 -7.331 1.00 0.00 H new ATOM 0 HG1 THR A 125 -8.481 12.536 -7.656 1.00 0.00 H new ATOM 0 HG21 THR A 125 -10.368 11.221 -8.252 1.00 0.00 H new ATOM 0 HG22 THR A 125 -10.832 9.957 -7.088 1.00 0.00 H new ATOM 0 HG23 THR A 125 -10.890 11.671 -6.611 1.00 0.00 H new ATOM 1760 N VAL A 126 -9.704 8.883 -3.641 1.00 0.00 N ATOM 1761 CA VAL A 126 -10.363 7.668 -3.193 1.00 0.00 C ATOM 1762 C VAL A 126 -11.854 7.750 -3.526 1.00 0.00 C ATOM 1763 O VAL A 126 -12.446 8.827 -3.478 1.00 0.00 O ATOM 1764 CB VAL A 126 -10.094 7.445 -1.703 1.00 0.00 C ATOM 1765 CG1 VAL A 126 -10.391 5.999 -1.303 1.00 0.00 C ATOM 1766 CG2 VAL A 126 -8.658 7.831 -1.342 1.00 0.00 C ATOM 0 H VAL A 126 -9.419 9.515 -2.892 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.960 6.800 -3.715 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.766 8.092 -1.140 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -10.192 5.867 -0.239 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -11.438 5.773 -1.507 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -9.756 5.325 -1.877 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -8.493 7.663 -0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -7.962 7.221 -1.918 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -8.495 8.884 -1.573 1.00 0.00 H new ATOM 1776 N THR A 127 -12.418 6.597 -3.855 1.00 0.00 N ATOM 1777 CA THR A 127 -13.829 6.524 -4.195 1.00 0.00 C ATOM 1778 C THR A 127 -14.361 5.108 -3.966 1.00 0.00 C ATOM 1779 O THR A 127 -13.643 4.245 -3.464 1.00 0.00 O ATOM 1780 CB THR A 127 -13.993 7.009 -5.637 1.00 0.00 C ATOM 1781 OG1 THR A 127 -14.063 5.809 -6.401 1.00 0.00 O ATOM 1782 CG2 THR A 127 -12.742 7.714 -6.164 1.00 0.00 C ATOM 0 H THR A 127 -11.923 5.706 -3.893 1.00 0.00 H new ATOM 0 HA THR A 127 -14.425 7.169 -3.550 1.00 0.00 H new ATOM 0 HB THR A 127 -14.844 7.688 -5.697 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.171 6.031 -7.349 1.00 0.00 H new ATOM 0 HG21 THR A 127 -12.912 8.038 -7.191 1.00 0.00 H new ATOM 0 HG22 THR A 127 -12.524 8.582 -5.541 1.00 0.00 H new ATOM 0 HG23 THR A 127 -11.897 7.026 -6.136 1.00 0.00 H new ATOM 1790 N GLY A 128 -15.615 4.913 -4.347 1.00 0.00 N ATOM 1791 CA GLY A 128 -16.251 3.616 -4.189 1.00 0.00 C ATOM 1792 C GLY A 128 -17.637 3.758 -3.557 1.00 0.00 C ATOM 1793 O GLY A 128 -18.619 4.008 -4.255 1.00 0.00 O ATOM 0 H GLY A 128 -16.207 5.631 -4.764 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -16.339 3.129 -5.160 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -15.627 2.975 -3.566 1.00 0.00 H new ATOM 1846 N LEU A 133 -13.743 -0.235 -4.330 1.00 0.00 N ATOM 1847 CA LEU A 133 -13.297 1.136 -4.151 1.00 0.00 C ATOM 1848 C LEU A 133 -12.147 1.425 -5.117 1.00 0.00 C ATOM 1849 O LEU A 133 -11.605 0.509 -5.733 1.00 0.00 O ATOM 1850 CB LEU A 133 -12.949 1.399 -2.684 1.00 0.00 C ATOM 1851 CG LEU A 133 -13.922 0.826 -1.651 1.00 0.00 C ATOM 1852 CD1 LEU A 133 -13.792 1.555 -0.312 1.00 0.00 C ATOM 1853 CD2 LEU A 133 -15.358 0.849 -2.179 1.00 0.00 C ATOM 0 HA LEU A 133 -14.100 1.832 -4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -11.958 0.989 -2.487 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -12.884 2.477 -2.534 1.00 0.00 H new ATOM 0 HG LEU A 133 -13.660 -0.217 -1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -14.494 1.128 0.404 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -12.776 1.443 0.066 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -14.013 2.613 -0.451 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.029 0.436 -1.426 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -15.648 1.876 -2.400 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -15.421 0.251 -3.088 1.00 0.00 H new ATOM 1865 N LYS A 134 -11.807 2.701 -5.218 1.00 0.00 N ATOM 1866 CA LYS A 134 -10.731 3.122 -6.099 1.00 0.00 C ATOM 1867 C LYS A 134 -9.834 4.118 -5.362 1.00 0.00 C ATOM 1868 O LYS A 134 -10.280 4.794 -4.436 1.00 0.00 O ATOM 1869 CB LYS A 134 -11.295 3.660 -7.416 1.00 0.00 C ATOM 1870 CG LYS A 134 -11.319 2.570 -8.489 1.00 0.00 C ATOM 1871 CD LYS A 134 -11.674 3.155 -9.857 1.00 0.00 C ATOM 1872 CE LYS A 134 -10.626 2.775 -10.905 1.00 0.00 C ATOM 1873 NZ LYS A 134 -11.279 2.240 -12.121 1.00 0.00 N ATOM 0 H LYS A 134 -12.258 3.458 -4.704 1.00 0.00 H new ATOM 0 HA LYS A 134 -10.107 2.271 -6.371 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.304 4.039 -7.255 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -10.690 4.499 -7.759 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.345 2.083 -8.539 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.045 1.804 -8.218 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -12.653 2.792 -10.169 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.745 4.240 -9.785 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -10.026 3.648 -11.161 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.945 2.030 -10.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -10.554 1.987 -12.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -11.832 1.394 -11.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -11.911 2.962 -12.522 1.00 0.00 H new ATOM 1886 N VAL A 135 -8.584 4.176 -5.799 1.00 0.00 N ATOM 1887 CA VAL A 135 -7.620 5.078 -5.191 1.00 0.00 C ATOM 1888 C VAL A 135 -6.608 5.523 -6.249 1.00 0.00 C ATOM 1889 O VAL A 135 -5.945 4.692 -6.867 1.00 0.00 O ATOM 1890 CB VAL A 135 -6.965 4.407 -3.983 1.00 0.00 C ATOM 1891 CG1 VAL A 135 -5.510 4.854 -3.829 1.00 0.00 C ATOM 1892 CG2 VAL A 135 -7.761 4.681 -2.705 1.00 0.00 C ATOM 0 H VAL A 135 -8.217 3.613 -6.566 1.00 0.00 H new ATOM 0 HA VAL A 135 -8.117 5.974 -4.818 1.00 0.00 H new ATOM 0 HB VAL A 135 -6.968 3.331 -4.155 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -5.068 4.362 -2.963 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -4.950 4.584 -4.724 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -5.474 5.935 -3.690 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -7.274 4.193 -1.861 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -7.804 5.755 -2.527 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -8.773 4.290 -2.816 1.00 0.00 H new ATOM 1902 N GLY A 136 -6.522 6.834 -6.425 1.00 0.00 N ATOM 1903 CA GLY A 136 -5.602 7.400 -7.397 1.00 0.00 C ATOM 1904 C GLY A 136 -5.628 6.604 -8.703 1.00 0.00 C ATOM 1905 O GLY A 136 -4.579 6.289 -9.263 1.00 0.00 O ATOM 0 H GLY A 136 -7.074 7.520 -5.911 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -5.869 8.438 -7.594 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -4.592 7.403 -6.988 1.00 0.00 H new ATOM 1909 N ASN A 137 -6.838 6.302 -9.152 1.00 0.00 N ATOM 1910 CA ASN A 137 -7.013 5.549 -10.382 1.00 0.00 C ATOM 1911 C ASN A 137 -6.996 4.052 -10.066 1.00 0.00 C ATOM 1912 O ASN A 137 -7.766 3.284 -10.639 1.00 0.00 O ATOM 1913 CB ASN A 137 -5.881 5.837 -11.370 1.00 0.00 C ATOM 1914 CG ASN A 137 -6.370 5.711 -12.815 1.00 0.00 C ATOM 1915 OD1 ASN A 137 -7.054 4.772 -13.186 1.00 0.00 O ATOM 1916 ND2 ASN A 137 -5.980 6.706 -13.606 1.00 0.00 N ATOM 0 H ASN A 137 -7.706 6.565 -8.686 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.963 5.845 -10.826 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -5.492 6.841 -11.200 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -5.058 5.143 -11.199 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -6.253 6.713 -14.589 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -5.408 7.462 -13.230 1.00 0.00 H new ATOM 1923 N ALA A 138 -6.108 3.683 -9.154 1.00 0.00 N ATOM 1924 CA ALA A 138 -5.980 2.292 -8.755 1.00 0.00 C ATOM 1925 C ALA A 138 -7.356 1.749 -8.365 1.00 0.00 C ATOM 1926 O ALA A 138 -8.322 2.504 -8.273 1.00 0.00 O ATOM 1927 CB ALA A 138 -4.965 2.179 -7.616 1.00 0.00 C ATOM 0 H ALA A 138 -5.471 4.323 -8.680 1.00 0.00 H new ATOM 0 HA ALA A 138 -5.610 1.688 -9.583 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -4.869 1.135 -7.317 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -3.997 2.550 -7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -5.305 2.771 -6.766 1.00 0.00 H new ATOM 1933 N ASP A 139 -7.401 0.442 -8.147 1.00 0.00 N ATOM 1934 CA ASP A 139 -8.643 -0.211 -7.770 1.00 0.00 C ATOM 1935 C ASP A 139 -8.462 -0.896 -6.414 1.00 0.00 C ATOM 1936 O ASP A 139 -7.652 -1.811 -6.280 1.00 0.00 O ATOM 1937 CB ASP A 139 -9.036 -1.280 -8.791 1.00 0.00 C ATOM 1938 CG ASP A 139 -9.935 -0.790 -9.927 1.00 0.00 C ATOM 1939 OD1 ASP A 139 -11.103 -0.435 -9.710 1.00 0.00 O ATOM 1940 OD2 ASP A 139 -9.384 -0.781 -11.094 1.00 0.00 O ATOM 0 H ASP A 139 -6.597 -0.182 -8.224 1.00 0.00 H new ATOM 0 HA ASP A 139 -9.423 0.549 -7.726 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -8.127 -1.700 -9.222 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -9.545 -2.090 -8.269 1.00 0.00 H new ATOM 1946 N VAL A 140 -9.232 -0.426 -5.442 1.00 0.00 N ATOM 1947 CA VAL A 140 -9.166 -0.982 -4.101 1.00 0.00 C ATOM 1948 C VAL A 140 -9.478 -2.479 -4.159 1.00 0.00 C ATOM 1949 O VAL A 140 -10.598 -2.871 -4.482 1.00 0.00 O ATOM 1950 CB VAL A 140 -10.104 -0.211 -3.169 1.00 0.00 C ATOM 1951 CG1 VAL A 140 -10.160 -0.864 -1.787 1.00 0.00 C ATOM 1952 CG2 VAL A 140 -9.689 1.258 -3.066 1.00 0.00 C ATOM 0 H VAL A 140 -9.904 0.333 -5.557 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.162 -0.875 -3.691 1.00 0.00 H new ATOM 0 HB VAL A 140 -11.106 -0.246 -3.597 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -10.833 -0.297 -1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -10.525 -1.887 -1.882 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -9.162 -0.874 -1.349 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -10.372 1.783 -2.398 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -8.675 1.323 -2.672 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -9.725 1.716 -4.054 1.00 0.00 H new ATOM 1962 N VAL A 141 -8.467 -3.274 -3.840 1.00 0.00 N ATOM 1963 CA VAL A 141 -8.619 -4.719 -3.851 1.00 0.00 C ATOM 1964 C VAL A 141 -9.178 -5.179 -2.503 1.00 0.00 C ATOM 1965 O VAL A 141 -10.116 -5.972 -2.454 1.00 0.00 O ATOM 1966 CB VAL A 141 -7.287 -5.382 -4.204 1.00 0.00 C ATOM 1967 CG1 VAL A 141 -7.505 -6.798 -4.743 1.00 0.00 C ATOM 1968 CG2 VAL A 141 -6.498 -4.531 -5.201 1.00 0.00 C ATOM 0 H VAL A 141 -7.539 -2.945 -3.572 1.00 0.00 H new ATOM 0 HA VAL A 141 -9.331 -5.023 -4.618 1.00 0.00 H new ATOM 0 HB VAL A 141 -6.698 -5.459 -3.290 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -6.542 -7.247 -4.986 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -8.006 -7.402 -3.987 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -8.122 -6.755 -5.640 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -5.555 -5.025 -5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -7.080 -4.408 -6.115 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -6.296 -3.553 -4.765 1.00 0.00 H new ATOM 1978 N CYS A 142 -8.576 -4.661 -1.442 1.00 0.00 N ATOM 1979 CA CYS A 142 -9.002 -5.009 -0.097 1.00 0.00 C ATOM 1980 C CYS A 142 -8.490 -3.932 0.863 1.00 0.00 C ATOM 1981 O CYS A 142 -7.297 -3.872 1.154 1.00 0.00 O ATOM 1982 CB CYS A 142 -8.522 -6.405 0.305 1.00 0.00 C ATOM 1983 SG CYS A 142 -8.821 -6.845 2.056 1.00 0.00 S ATOM 0 H CYS A 142 -7.797 -4.004 -1.487 1.00 0.00 H new ATOM 0 HA CYS A 142 -10.091 -5.044 -0.056 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -9.017 -7.141 -0.329 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -7.453 -6.478 0.104 1.00 0.00 H new ATOM 1988 N GLY A 143 -9.418 -3.108 1.327 1.00 0.00 N ATOM 1989 CA GLY A 143 -9.076 -2.037 2.247 1.00 0.00 C ATOM 1990 C GLY A 143 -9.658 -2.302 3.637 1.00 0.00 C ATOM 1991 O GLY A 143 -10.377 -3.280 3.837 1.00 0.00 O ATOM 0 H GLY A 143 -10.407 -3.161 1.083 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -7.992 -1.943 2.314 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -9.455 -1.089 1.865 1.00 0.00 H new ATOM 1995 N GLY A 144 -9.326 -1.412 4.561 1.00 0.00 N ATOM 1996 CA GLY A 144 -9.807 -1.537 5.927 1.00 0.00 C ATOM 1997 C GLY A 144 -9.100 -2.682 6.654 1.00 0.00 C ATOM 1998 O GLY A 144 -9.599 -3.187 7.658 1.00 0.00 O ATOM 0 H GLY A 144 -8.730 -0.602 4.391 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -9.639 -0.603 6.463 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -10.883 -1.713 5.923 1.00 0.00 H new ATOM 2002 N VAL A 145 -7.947 -3.059 6.119 1.00 0.00 N ATOM 2003 CA VAL A 145 -7.166 -4.135 6.705 1.00 0.00 C ATOM 2004 C VAL A 145 -6.234 -3.560 7.773 1.00 0.00 C ATOM 2005 O VAL A 145 -5.029 -3.807 7.748 1.00 0.00 O ATOM 2006 CB VAL A 145 -6.421 -4.898 5.608 1.00 0.00 C ATOM 2007 CG1 VAL A 145 -6.168 -6.348 6.024 1.00 0.00 C ATOM 2008 CG2 VAL A 145 -7.180 -4.831 4.281 1.00 0.00 C ATOM 0 H VAL A 145 -7.535 -2.638 5.286 1.00 0.00 H new ATOM 0 HA VAL A 145 -7.818 -4.856 7.198 1.00 0.00 H new ATOM 0 HB VAL A 145 -5.453 -4.418 5.464 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -5.637 -6.868 5.227 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -5.566 -6.366 6.933 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -7.120 -6.845 6.210 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -6.629 -5.381 3.518 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -8.168 -5.273 4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -7.284 -3.790 3.974 1.00 0.00 H new ATOM 2018 N SER A 146 -6.826 -2.803 8.685 1.00 0.00 N ATOM 2019 CA SER A 146 -6.063 -2.191 9.760 1.00 0.00 C ATOM 2020 C SER A 146 -5.066 -3.199 10.334 1.00 0.00 C ATOM 2021 O SER A 146 -5.440 -4.318 10.683 1.00 0.00 O ATOM 2022 CB SER A 146 -6.986 -1.671 10.863 1.00 0.00 C ATOM 2023 OG SER A 146 -7.833 -0.623 10.400 1.00 0.00 O ATOM 0 H SER A 146 -7.825 -2.599 8.702 1.00 0.00 H new ATOM 0 HA SER A 146 -5.516 -1.342 9.351 1.00 0.00 H new ATOM 0 HB2 SER A 146 -7.597 -2.491 11.241 1.00 0.00 H new ATOM 0 HB3 SER A 146 -6.386 -1.310 11.698 1.00 0.00 H new ATOM 0 HG SER A 146 -8.408 -0.319 11.133 1.00 0.00 H new ATOM 2029 N THR A 147 -3.816 -2.767 10.413 1.00 0.00 N ATOM 2030 CA THR A 147 -2.762 -3.618 10.939 1.00 0.00 C ATOM 2031 C THR A 147 -2.513 -3.308 12.416 1.00 0.00 C ATOM 2032 O THR A 147 -3.246 -3.778 13.285 1.00 0.00 O ATOM 2033 CB THR A 147 -1.522 -3.432 10.061 1.00 0.00 C ATOM 2034 OG1 THR A 147 -1.579 -2.064 9.666 1.00 0.00 O ATOM 2035 CG2 THR A 147 -1.615 -4.204 8.744 1.00 0.00 C ATOM 0 H THR A 147 -3.509 -1.839 10.122 1.00 0.00 H new ATOM 0 HA THR A 147 -3.048 -4.669 10.904 1.00 0.00 H new ATOM 0 HB THR A 147 -0.637 -3.756 10.609 1.00 0.00 H new ATOM 0 HG1 THR A 147 -2.065 -1.548 10.343 1.00 0.00 H new ATOM 0 HG21 THR A 147 -0.710 -4.037 8.160 1.00 0.00 H new ATOM 0 HG22 THR A 147 -1.721 -5.269 8.953 1.00 0.00 H new ATOM 0 HG23 THR A 147 -2.480 -3.857 8.179 1.00 0.00 H new ATOM 2043 N ALA A 148 -1.476 -2.519 12.655 1.00 0.00 N ATOM 2044 CA ALA A 148 -1.121 -2.140 14.013 1.00 0.00 C ATOM 2045 C ALA A 148 -1.541 -0.690 14.259 1.00 0.00 C ATOM 2046 O ALA A 148 -2.512 -0.433 14.968 1.00 0.00 O ATOM 2047 CB ALA A 148 0.378 -2.358 14.228 1.00 0.00 C ATOM 0 H ALA A 148 -0.870 -2.132 11.932 1.00 0.00 H new ATOM 0 HA ALA A 148 -1.648 -2.763 14.736 1.00 0.00 H new ATOM 0 HB1 ALA A 148 0.645 -2.074 15.246 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.619 -3.409 14.070 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.940 -1.746 13.522 1.00 0.00 H new ATOM 2053 N ASN A 149 -0.787 0.221 13.660 1.00 0.00 N ATOM 2054 CA ASN A 149 -1.068 1.639 13.806 1.00 0.00 C ATOM 2055 C ASN A 149 -1.153 2.283 12.421 1.00 0.00 C ATOM 2056 O ASN A 149 -0.705 3.412 12.228 1.00 0.00 O ATOM 2057 CB ASN A 149 0.042 2.343 14.588 1.00 0.00 C ATOM 2058 CG ASN A 149 1.422 1.870 14.127 1.00 0.00 C ATOM 2059 OD1 ASN A 149 1.754 2.277 12.905 1.00 0.00 O flip ATOM 2060 ND2 ASN A 149 2.138 1.180 14.834 1.00 0.00 N flip ATOM 0 H ASN A 149 0.018 0.004 13.073 1.00 0.00 H new ATOM 0 HA ASN A 149 -2.010 1.742 14.345 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -0.041 3.421 14.453 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.077 2.145 15.653 1.00 0.00 H new ATOM 0 HD21 ASN A 149 1.822 0.902 15.763 1.00 0.00 H new ATOM 0 HD22 ASN A 149 3.053 0.881 14.496 1.00 0.00 H new ATOM 2067 N ALA A 150 -1.732 1.536 11.491 1.00 0.00 N ATOM 2068 CA ALA A 150 -1.881 2.020 10.129 1.00 0.00 C ATOM 2069 C ALA A 150 -2.822 1.089 9.362 1.00 0.00 C ATOM 2070 O ALA A 150 -2.746 -0.131 9.504 1.00 0.00 O ATOM 2071 CB ALA A 150 -0.504 2.129 9.472 1.00 0.00 C ATOM 0 H ALA A 150 -2.103 0.600 11.654 1.00 0.00 H new ATOM 0 HA ALA A 150 -2.325 3.016 10.122 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -0.616 2.492 8.450 1.00 0.00 H new ATOM 0 HB2 ALA A 150 0.115 2.824 10.038 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -0.029 1.148 9.458 1.00 0.00 H new ATOM 2077 N THR A 151 -3.687 1.699 8.565 1.00 0.00 N ATOM 2078 CA THR A 151 -4.641 0.940 7.775 1.00 0.00 C ATOM 2079 C THR A 151 -3.959 0.344 6.542 1.00 0.00 C ATOM 2080 O THR A 151 -2.790 0.624 6.280 1.00 0.00 O ATOM 2081 CB THR A 151 -5.813 1.862 7.435 1.00 0.00 C ATOM 2082 OG1 THR A 151 -6.446 2.098 8.690 1.00 0.00 O ATOM 2083 CG2 THR A 151 -6.888 1.160 6.601 1.00 0.00 C ATOM 0 H THR A 151 -3.747 2.711 8.449 1.00 0.00 H new ATOM 0 HA THR A 151 -5.030 0.089 8.335 1.00 0.00 H new ATOM 0 HB THR A 151 -5.444 2.732 6.893 1.00 0.00 H new ATOM 0 HG1 THR A 151 -7.217 2.689 8.562 1.00 0.00 H new ATOM 0 HG21 THR A 151 -7.697 1.859 6.387 1.00 0.00 H new ATOM 0 HG22 THR A 151 -6.452 0.812 5.664 1.00 0.00 H new ATOM 0 HG23 THR A 151 -7.281 0.309 7.157 1.00 0.00 H new ATOM 2091 N VAL A 152 -4.717 -0.466 5.819 1.00 0.00 N ATOM 2092 CA VAL A 152 -4.200 -1.104 4.620 1.00 0.00 C ATOM 2093 C VAL A 152 -5.274 -1.079 3.531 1.00 0.00 C ATOM 2094 O VAL A 152 -6.415 -1.473 3.769 1.00 0.00 O ATOM 2095 CB VAL A 152 -3.713 -2.517 4.947 1.00 0.00 C ATOM 2096 CG1 VAL A 152 -4.035 -3.486 3.807 1.00 0.00 C ATOM 2097 CG2 VAL A 152 -2.217 -2.522 5.265 1.00 0.00 C ATOM 0 H VAL A 152 -5.686 -0.696 6.040 1.00 0.00 H new ATOM 0 HA VAL A 152 -3.337 -0.558 4.239 1.00 0.00 H new ATOM 0 HB VAL A 152 -4.245 -2.857 5.836 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -3.678 -4.483 4.065 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -5.113 -3.516 3.649 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.543 -3.150 2.894 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -1.897 -3.539 5.494 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -1.661 -2.152 4.404 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -2.026 -1.879 6.124 1.00 0.00 H new ATOM 2107 N TYR A 153 -4.871 -0.611 2.358 1.00 0.00 N ATOM 2108 CA TYR A 153 -5.785 -0.530 1.231 1.00 0.00 C ATOM 2109 C TYR A 153 -5.105 -0.988 -0.060 1.00 0.00 C ATOM 2110 O TYR A 153 -4.516 -0.180 -0.777 1.00 0.00 O ATOM 2111 CB TYR A 153 -6.161 0.947 1.099 1.00 0.00 C ATOM 2112 CG TYR A 153 -7.067 1.462 2.219 1.00 0.00 C ATOM 2113 CD1 TYR A 153 -8.429 1.245 2.159 1.00 0.00 C ATOM 2114 CD2 TYR A 153 -6.524 2.142 3.290 1.00 0.00 C ATOM 2115 CE1 TYR A 153 -9.282 1.729 3.213 1.00 0.00 C ATOM 2116 CE2 TYR A 153 -7.377 2.626 4.344 1.00 0.00 C ATOM 2117 CZ TYR A 153 -8.714 2.396 4.253 1.00 0.00 C ATOM 2118 OH TYR A 153 -9.520 2.853 5.249 1.00 0.00 O ATOM 0 H TYR A 153 -3.924 -0.284 2.164 1.00 0.00 H new ATOM 0 HA TYR A 153 -6.653 -1.170 1.393 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -5.249 1.543 1.081 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -6.661 1.100 0.142 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -8.855 0.712 1.322 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -5.458 2.311 3.338 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -10.349 1.566 3.178 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -6.964 3.159 5.188 1.00 0.00 H new ATOM 0 HH TYR A 153 -9.014 3.464 5.825 1.00 0.00 H new ATOM 2128 N MET A 154 -5.208 -2.284 -0.318 1.00 0.00 N ATOM 2129 CA MET A 154 -4.611 -2.860 -1.511 1.00 0.00 C ATOM 2130 C MET A 154 -5.217 -2.251 -2.776 1.00 0.00 C ATOM 2131 O MET A 154 -6.416 -1.984 -2.828 1.00 0.00 O ATOM 2132 CB MET A 154 -4.835 -4.373 -1.514 1.00 0.00 C ATOM 2133 CG MET A 154 -3.991 -5.055 -0.436 1.00 0.00 C ATOM 2134 SD MET A 154 -5.053 -5.827 0.774 1.00 0.00 S ATOM 2135 CE MET A 154 -4.855 -7.540 0.311 1.00 0.00 C ATOM 0 H MET A 154 -5.696 -2.951 0.279 1.00 0.00 H new ATOM 0 HA MET A 154 -3.543 -2.642 -1.502 1.00 0.00 H new ATOM 0 HB2 MET A 154 -5.890 -4.588 -1.345 1.00 0.00 H new ATOM 0 HB3 MET A 154 -4.579 -4.780 -2.492 1.00 0.00 H new ATOM 0 HG2 MET A 154 -3.341 -5.802 -0.890 1.00 0.00 H new ATOM 0 HG3 MET A 154 -3.345 -4.323 0.049 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.441 -8.168 0.982 1.00 0.00 H new ATOM 0 HE2 MET A 154 -5.200 -7.682 -0.713 1.00 0.00 H new ATOM 0 HE3 MET A 154 -3.803 -7.817 0.382 1.00 0.00 H new ATOM 2145 N ILE A 155 -4.360 -2.049 -3.766 1.00 0.00 N ATOM 2146 CA ILE A 155 -4.796 -1.476 -5.029 1.00 0.00 C ATOM 2147 C ILE A 155 -4.195 -2.280 -6.183 1.00 0.00 C ATOM 2148 O ILE A 155 -3.483 -3.258 -5.959 1.00 0.00 O ATOM 2149 CB ILE A 155 -4.465 0.017 -5.082 1.00 0.00 C ATOM 2150 CG1 ILE A 155 -2.988 0.263 -4.770 1.00 0.00 C ATOM 2151 CG2 ILE A 155 -5.387 0.816 -4.159 1.00 0.00 C ATOM 2152 CD1 ILE A 155 -2.798 1.586 -4.024 1.00 0.00 C ATOM 0 H ILE A 155 -3.366 -2.272 -3.719 1.00 0.00 H new ATOM 0 HA ILE A 155 -5.880 -1.543 -5.124 1.00 0.00 H new ATOM 0 HB ILE A 155 -4.642 0.370 -6.098 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -2.598 -0.558 -4.168 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -2.414 0.278 -5.697 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -5.131 1.874 -4.216 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -6.422 0.677 -4.470 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -5.266 0.468 -3.133 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -1.739 1.737 -3.814 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -3.166 2.407 -4.639 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -3.353 1.558 -3.086 1.00 0.00 H new ATOM 2164 N ASP A 156 -4.504 -1.839 -7.394 1.00 0.00 N ATOM 2165 CA ASP A 156 -4.004 -2.506 -8.584 1.00 0.00 C ATOM 2166 C ASP A 156 -3.133 -1.532 -9.380 1.00 0.00 C ATOM 2167 O ASP A 156 -3.180 -1.514 -10.609 1.00 0.00 O ATOM 2168 CB ASP A 156 -5.154 -2.958 -9.486 1.00 0.00 C ATOM 2169 CG ASP A 156 -5.709 -1.878 -10.417 1.00 0.00 C ATOM 2170 OD1 ASP A 156 -6.009 -0.755 -9.985 1.00 0.00 O ATOM 2171 OD2 ASP A 156 -5.831 -2.232 -11.651 1.00 0.00 O ATOM 0 H ASP A 156 -5.095 -1.028 -7.576 1.00 0.00 H new ATOM 0 HA ASP A 156 -3.431 -3.377 -8.267 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -4.812 -3.798 -10.091 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -5.965 -3.327 -8.858 1.00 0.00 H new ATOM 2177 N SER A 157 -2.357 -0.747 -8.647 1.00 0.00 N ATOM 2178 CA SER A 157 -1.476 0.226 -9.270 1.00 0.00 C ATOM 2179 C SER A 157 -0.548 0.840 -8.219 1.00 0.00 C ATOM 2180 O SER A 157 -0.987 1.182 -7.122 1.00 0.00 O ATOM 2181 CB SER A 157 -2.277 1.322 -9.975 1.00 0.00 C ATOM 2182 OG SER A 157 -3.530 0.842 -10.456 1.00 0.00 O ATOM 0 H SER A 157 -2.320 -0.765 -7.628 1.00 0.00 H new ATOM 0 HA SER A 157 -0.875 -0.288 -10.021 1.00 0.00 H new ATOM 0 HB2 SER A 157 -2.446 2.148 -9.285 1.00 0.00 H new ATOM 0 HB3 SER A 157 -1.696 1.717 -10.808 1.00 0.00 H new ATOM 0 HG SER A 157 -3.379 0.103 -11.082 1.00 0.00 H new ATOM 2188 N VAL A 158 0.718 0.960 -8.592 1.00 0.00 N ATOM 2189 CA VAL A 158 1.711 1.527 -7.696 1.00 0.00 C ATOM 2190 C VAL A 158 1.583 3.051 -7.697 1.00 0.00 C ATOM 2191 O VAL A 158 2.439 3.749 -8.237 1.00 0.00 O ATOM 2192 CB VAL A 158 3.108 1.044 -8.091 1.00 0.00 C ATOM 2193 CG1 VAL A 158 3.077 -0.419 -8.537 1.00 0.00 C ATOM 2194 CG2 VAL A 158 3.709 1.936 -9.179 1.00 0.00 C ATOM 0 H VAL A 158 1.078 0.674 -9.502 1.00 0.00 H new ATOM 0 HA VAL A 158 1.541 1.188 -6.674 1.00 0.00 H new ATOM 0 HB VAL A 158 3.747 1.112 -7.211 1.00 0.00 H new ATOM 0 HG11 VAL A 158 4.083 -0.737 -8.812 1.00 0.00 H new ATOM 0 HG12 VAL A 158 2.711 -1.041 -7.720 1.00 0.00 H new ATOM 0 HG13 VAL A 158 2.415 -0.523 -9.397 1.00 0.00 H new ATOM 0 HG21 VAL A 158 4.702 1.571 -9.441 1.00 0.00 H new ATOM 0 HG22 VAL A 158 3.069 1.915 -10.061 1.00 0.00 H new ATOM 0 HG23 VAL A 158 3.784 2.959 -8.810 1.00 0.00 H new ATOM 2204 N LEU A 159 0.506 3.523 -7.085 1.00 0.00 N ATOM 2205 CA LEU A 159 0.255 4.952 -7.009 1.00 0.00 C ATOM 2206 C LEU A 159 1.573 5.707 -7.183 1.00 0.00 C ATOM 2207 O LEU A 159 2.588 5.336 -6.594 1.00 0.00 O ATOM 2208 CB LEU A 159 -0.486 5.297 -5.715 1.00 0.00 C ATOM 2209 CG LEU A 159 -1.953 5.703 -5.870 1.00 0.00 C ATOM 2210 CD1 LEU A 159 -2.666 4.805 -6.882 1.00 0.00 C ATOM 2211 CD2 LEU A 159 -2.664 5.716 -4.515 1.00 0.00 C ATOM 0 H LEU A 159 -0.202 2.941 -6.638 1.00 0.00 H new ATOM 0 HA LEU A 159 -0.402 5.267 -7.820 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -0.437 4.434 -5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 159 0.045 6.111 -5.221 1.00 0.00 H new ATOM 0 HG LEU A 159 -1.987 6.720 -6.262 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -3.707 5.115 -6.973 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -2.176 4.889 -7.852 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -2.624 3.770 -6.543 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -3.705 6.008 -4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -2.622 4.721 -4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.172 6.429 -3.853 1.00 0.00 H new ATOM 2223 N MET A 160 1.517 6.754 -7.994 1.00 0.00 N ATOM 2224 CA MET A 160 2.694 7.564 -8.253 1.00 0.00 C ATOM 2225 C MET A 160 2.407 9.045 -7.997 1.00 0.00 C ATOM 2226 O MET A 160 1.328 9.538 -8.324 1.00 0.00 O ATOM 2227 CB MET A 160 3.136 7.373 -9.705 1.00 0.00 C ATOM 2228 CG MET A 160 2.541 6.093 -10.296 1.00 0.00 C ATOM 2229 SD MET A 160 2.987 5.951 -12.018 1.00 0.00 S ATOM 2230 CE MET A 160 1.561 5.073 -12.636 1.00 0.00 C ATOM 0 H MET A 160 0.674 7.059 -8.480 1.00 0.00 H new ATOM 0 HA MET A 160 3.488 7.245 -7.578 1.00 0.00 H new ATOM 0 HB2 MET A 160 2.824 8.232 -10.300 1.00 0.00 H new ATOM 0 HB3 MET A 160 4.224 7.329 -9.755 1.00 0.00 H new ATOM 0 HG2 MET A 160 2.904 5.225 -9.745 1.00 0.00 H new ATOM 0 HG3 MET A 160 1.456 6.105 -10.193 1.00 0.00 H new ATOM 0 HE1 MET A 160 1.676 4.900 -13.706 1.00 0.00 H new ATOM 0 HE2 MET A 160 1.472 4.116 -12.121 1.00 0.00 H new ATOM 0 HE3 MET A 160 0.664 5.666 -12.458 1.00 0.00 H new ATOM 2240 N PRO A 161 3.418 9.732 -7.400 1.00 0.00 N ATOM 2241 CA PRO A 161 3.284 11.147 -7.097 1.00 0.00 C ATOM 2242 C PRO A 161 3.412 11.994 -8.365 1.00 0.00 C ATOM 2243 O PRO A 161 4.429 11.935 -9.055 1.00 0.00 O ATOM 2244 CB PRO A 161 4.375 11.435 -6.078 1.00 0.00 C ATOM 2245 CG PRO A 161 5.368 10.291 -6.195 1.00 0.00 C ATOM 2246 CD PRO A 161 4.709 9.182 -6.999 1.00 0.00 C ATOM 0 HA PRO A 161 2.303 11.400 -6.694 1.00 0.00 H new ATOM 0 HB2 PRO A 161 4.856 12.392 -6.281 1.00 0.00 H new ATOM 0 HB3 PRO A 161 3.963 11.493 -5.071 1.00 0.00 H new ATOM 0 HG2 PRO A 161 6.281 10.627 -6.686 1.00 0.00 H new ATOM 0 HG3 PRO A 161 5.652 9.929 -5.207 1.00 0.00 H new ATOM 0 HD2 PRO A 161 5.311 8.911 -7.867 1.00 0.00 H new ATOM 0 HD3 PRO A 161 4.586 8.279 -6.401 1.00 0.00 H new ATOM 2254 N PRO A 162 2.338 12.781 -8.640 1.00 0.00 N ATOM 2255 CA PRO A 162 2.320 13.639 -9.813 1.00 0.00 C ATOM 2256 C PRO A 162 3.211 14.866 -9.608 1.00 0.00 C ATOM 2257 O PRO A 162 2.722 15.994 -9.574 1.00 0.00 O ATOM 2258 CB PRO A 162 0.857 13.995 -10.017 1.00 0.00 C ATOM 2259 CG PRO A 162 0.169 13.709 -8.692 1.00 0.00 C ATOM 2260 CD PRO A 162 1.117 12.876 -7.845 1.00 0.00 C ATOM 0 HA PRO A 162 2.724 13.149 -10.699 1.00 0.00 H new ATOM 0 HB2 PRO A 162 0.745 15.043 -10.297 1.00 0.00 H new ATOM 0 HB3 PRO A 162 0.419 13.402 -10.820 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -0.080 14.640 -8.183 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -0.767 13.175 -8.855 1.00 0.00 H new ATOM 0 HD2 PRO A 162 1.307 13.350 -6.882 1.00 0.00 H new ATOM 0 HD3 PRO A 162 0.701 11.890 -7.639 1.00 0.00 H new