USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 944 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 114 THR OG1 : rot 180:sc=-0.00157 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.154 X(o=0.15,f=0.54) USER MOD Set 2.1: A 34 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 85 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 76 THR OG1 : rot 144:sc= 1.18 USER MOD Set 3.2: A 79 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 33 GLN : amide:sc= -1.09 X(o=-1.3,f=-1.8) USER MOD Set 4.2: A 35 SER OG : rot -150:sc= 0.039 USER MOD Set 4.3: A 118 MET CE :methyl 177:sc= -0.297 (180deg=-0.216) USER MOD Set 5.1: A 23 TYR OH : rot -142:sc= 1.48 USER MOD Set 5.2: A 122 MET CE :methyl 139:sc= -0.591 (180deg=-2.04) USER MOD Set 6.1: A 9 LYS NZ :NH3+ -176:sc= 1.15 (180deg=-0.0976) USER MOD Set 6.2: A 22 THR OG1 : rot 141:sc= 1.01 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 154:sc= 1.47 (180deg=1.18) USER MOD Single : A 11 SER OG : rot 180:sc= -0.475 USER MOD Single : A 13 ASN : amide:sc= -2.03! K(o=-2!,f=-0.76) USER MOD Single : A 15 ASN : amide:sc= -0.247 K(o=-0.25,f=-1.1) USER MOD Single : A 17 THR OG1 : rot 17:sc= 1.11 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 139:sc= -0.79 (180deg=-2.12!) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0178) USER MOD Single : A 32 LYS NZ :NH3+ -145:sc= 1.15 (180deg=0.737) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 173:sc= 0.0915 (180deg=0.0732) USER MOD Single : A 40 GLN : amide:sc= 0.481 K(o=0.48,f=-2.5!) USER MOD Single : A 43 SER OG : rot -170:sc= 0.629 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -169:sc= 0.0485 USER MOD Single : A 49 LYS NZ :NH3+ -176:sc= 0.995 (180deg=0.864) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 80:sc= 0.282 USER MOD Single : A 60 SER OG : rot -61:sc= 0.653 USER MOD Single : A 62 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0397) USER MOD Single : A 63 TYR OH : rot 30:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0111) USER MOD Single : A 65 ASN : amide:sc= -1.55! K(o=-1.6!,f=-0.28) USER MOD Single : A 72 LYS NZ :NH3+ 138:sc= -0.178 (180deg=-0.828) USER MOD Single : A 74 THR OG1 : rot 45:sc= -2.1! USER MOD Single : A 75 TYR OH : rot -111:sc= -3.03! USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.023 USER MOD Single : A 81 GLN : amide:sc= -1.57! K(o=-1.6!,f=-1) USER MOD Single : A 83 ASN : amide:sc= 0.832 K(o=0.83,f=-0.1) USER MOD Single : A 88 MET CE :methyl 168:sc= 0 (180deg=-0.0382) USER MOD Single : A 90 LYS NZ :NH3+ 134:sc= -0.185 (180deg=-0.954) USER MOD Single : A 94 LYS NZ :NH3+ 166:sc= -0.0286 (180deg=-0.239) USER MOD Single : A 97 GLN : amide:sc= -1.19 K(o=-1.2,f=-0.017) USER MOD Single : A 110 LYS NZ :NH3+ -178:sc= 0.0179 (180deg=0.0171) USER MOD Single : A 111 LYS NZ :NH3+ 160:sc= 0.909 (180deg=0.56) USER MOD Single : A 115 MET CE :methyl -137:sc= -0.718 (180deg=-5.15!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 143:sc= -1.59 (180deg=-4.03!) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 12.531 0.867 13.766 1.00 0.00 N ATOM 62 CA GLU A 5 12.525 0.153 12.501 1.00 0.00 C ATOM 63 C GLU A 5 12.477 1.173 11.369 1.00 0.00 C ATOM 64 O GLU A 5 12.422 2.380 11.619 1.00 0.00 O ATOM 65 CB GLU A 5 11.332 -0.805 12.448 1.00 0.00 C ATOM 66 CG GLU A 5 11.324 -1.805 13.598 1.00 0.00 C ATOM 67 CD GLU A 5 10.159 -2.772 13.544 1.00 0.00 C ATOM 68 OE1 GLU A 5 9.003 -2.324 13.692 1.00 0.00 O ATOM 69 OE2 GLU A 5 10.400 -3.988 13.390 1.00 0.00 O ATOM 0 HA GLU A 5 13.429 -0.447 12.396 1.00 0.00 H new ATOM 0 HB2 GLU A 5 10.408 -0.228 12.468 1.00 0.00 H new ATOM 0 HB3 GLU A 5 11.349 -1.347 11.502 1.00 0.00 H new ATOM 0 HG2 GLU A 5 12.256 -2.369 13.586 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.293 -1.262 14.542 1.00 0.00 H new ATOM 76 N GLU A 6 12.491 0.708 10.136 1.00 0.00 N ATOM 77 CA GLU A 6 12.636 1.602 8.999 1.00 0.00 C ATOM 78 C GLU A 6 11.294 1.815 8.321 1.00 0.00 C ATOM 79 O GLU A 6 10.582 0.860 8.037 1.00 0.00 O ATOM 80 CB GLU A 6 13.652 1.039 7.999 1.00 0.00 C ATOM 81 CG GLU A 6 15.109 1.122 8.446 1.00 0.00 C ATOM 82 CD GLU A 6 15.422 0.296 9.681 1.00 0.00 C ATOM 83 OE1 GLU A 6 15.616 -0.933 9.557 1.00 0.00 O ATOM 84 OE2 GLU A 6 15.492 0.876 10.783 1.00 0.00 O ATOM 0 H GLU A 6 12.404 -0.279 9.894 1.00 0.00 H new ATOM 0 HA GLU A 6 13.002 2.563 9.360 1.00 0.00 H new ATOM 0 HB2 GLU A 6 13.406 -0.005 7.803 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.546 1.574 7.055 1.00 0.00 H new ATOM 0 HG2 GLU A 6 15.749 0.791 7.628 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.359 2.164 8.645 1.00 0.00 H new ATOM 91 N SER A 7 10.948 3.067 8.072 1.00 0.00 N ATOM 92 CA SER A 7 9.668 3.391 7.464 1.00 0.00 C ATOM 93 C SER A 7 9.861 4.157 6.156 1.00 0.00 C ATOM 94 O SER A 7 10.412 5.257 6.141 1.00 0.00 O ATOM 95 CB SER A 7 8.826 4.206 8.443 1.00 0.00 C ATOM 96 OG SER A 7 8.709 3.530 9.684 1.00 0.00 O ATOM 0 H SER A 7 11.535 3.875 8.281 1.00 0.00 H new ATOM 0 HA SER A 7 9.147 2.462 7.231 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.282 5.184 8.597 1.00 0.00 H new ATOM 0 HB3 SER A 7 7.835 4.379 8.022 1.00 0.00 H new ATOM 0 HG SER A 7 8.168 4.067 10.299 1.00 0.00 H new ATOM 102 N LYS A 8 9.420 3.552 5.065 1.00 0.00 N ATOM 103 CA LYS A 8 9.528 4.155 3.744 1.00 0.00 C ATOM 104 C LYS A 8 8.151 4.466 3.170 1.00 0.00 C ATOM 105 O LYS A 8 7.458 3.577 2.690 1.00 0.00 O ATOM 106 CB LYS A 8 10.283 3.216 2.802 1.00 0.00 C ATOM 107 CG LYS A 8 11.790 3.235 2.985 1.00 0.00 C ATOM 108 CD LYS A 8 12.378 4.606 2.702 1.00 0.00 C ATOM 109 CE LYS A 8 13.828 4.513 2.246 1.00 0.00 C ATOM 110 NZ LYS A 8 13.932 4.070 0.826 1.00 0.00 N ATOM 0 H LYS A 8 8.978 2.633 5.068 1.00 0.00 H new ATOM 0 HA LYS A 8 10.078 5.091 3.841 1.00 0.00 H new ATOM 0 HB2 LYS A 8 9.922 2.199 2.954 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.049 3.487 1.772 1.00 0.00 H new ATOM 0 HG2 LYS A 8 12.036 2.938 4.005 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.246 2.501 2.321 1.00 0.00 H new ATOM 0 HD2 LYS A 8 11.786 5.105 1.934 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.318 5.221 3.600 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.308 5.485 2.360 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.367 3.814 2.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.820 4.423 0.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.920 3.031 0.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.128 4.447 0.285 1.00 0.00 H new ATOM 124 N LYS A 9 7.754 5.727 3.236 1.00 0.00 N ATOM 125 CA LYS A 9 6.465 6.146 2.698 1.00 0.00 C ATOM 126 C LYS A 9 6.637 6.771 1.322 1.00 0.00 C ATOM 127 O LYS A 9 7.244 7.829 1.187 1.00 0.00 O ATOM 128 CB LYS A 9 5.787 7.153 3.637 1.00 0.00 C ATOM 129 CG LYS A 9 4.419 7.616 3.149 1.00 0.00 C ATOM 130 CD LYS A 9 3.872 8.765 3.984 1.00 0.00 C ATOM 131 CE LYS A 9 3.553 8.339 5.411 1.00 0.00 C ATOM 132 NZ LYS A 9 2.428 7.367 5.476 1.00 0.00 N ATOM 0 H LYS A 9 8.302 6.478 3.655 1.00 0.00 H new ATOM 0 HA LYS A 9 5.835 5.261 2.612 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.678 6.701 4.623 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.435 8.022 3.754 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.493 7.929 2.107 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.721 6.780 3.182 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.600 9.576 4.003 1.00 0.00 H new ATOM 0 HD3 LYS A 9 2.970 9.157 3.513 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.440 7.894 5.861 1.00 0.00 H new ATOM 0 HE3 LYS A 9 3.303 9.220 6.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.205 7.160 6.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.591 7.773 5.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.701 6.488 4.992 1.00 0.00 H new ATOM 146 N PHE A 10 6.122 6.111 0.303 1.00 0.00 N ATOM 147 CA PHE A 10 6.093 6.689 -1.029 1.00 0.00 C ATOM 148 C PHE A 10 4.643 6.949 -1.404 1.00 0.00 C ATOM 149 O PHE A 10 3.741 6.375 -0.795 1.00 0.00 O ATOM 150 CB PHE A 10 6.754 5.755 -2.057 1.00 0.00 C ATOM 151 CG PHE A 10 5.830 4.716 -2.634 1.00 0.00 C ATOM 152 CD1 PHE A 10 5.672 3.488 -2.022 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.116 4.977 -3.796 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.821 2.540 -2.554 1.00 0.00 C ATOM 155 CE2 PHE A 10 4.264 4.032 -4.330 1.00 0.00 C ATOM 156 CZ PHE A 10 4.117 2.812 -3.709 1.00 0.00 C ATOM 0 H PHE A 10 5.719 5.177 0.370 1.00 0.00 H new ATOM 0 HA PHE A 10 6.657 7.622 -1.031 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.158 6.357 -2.871 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.597 5.252 -1.584 1.00 0.00 H new ATOM 0 HD1 PHE A 10 6.220 3.267 -1.118 1.00 0.00 H new ATOM 0 HD2 PHE A 10 5.229 5.932 -4.288 1.00 0.00 H new ATOM 0 HE1 PHE A 10 4.706 1.584 -2.065 1.00 0.00 H new ATOM 0 HE2 PHE A 10 3.713 4.249 -5.233 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.452 2.070 -4.125 1.00 0.00 H new ATOM 166 N SER A 11 4.410 7.802 -2.387 1.00 0.00 N ATOM 167 CA SER A 11 3.057 8.043 -2.859 1.00 0.00 C ATOM 168 C SER A 11 3.078 8.543 -4.294 1.00 0.00 C ATOM 169 O SER A 11 3.754 9.520 -4.616 1.00 0.00 O ATOM 170 CB SER A 11 2.326 9.040 -1.949 1.00 0.00 C ATOM 171 OG SER A 11 0.972 9.204 -2.343 1.00 0.00 O ATOM 0 H SER A 11 5.133 8.335 -2.870 1.00 0.00 H new ATOM 0 HA SER A 11 2.513 7.099 -2.828 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.367 8.691 -0.917 1.00 0.00 H new ATOM 0 HB3 SER A 11 2.835 10.004 -1.980 1.00 0.00 H new ATOM 0 HG SER A 11 0.532 9.843 -1.744 1.00 0.00 H new ATOM 177 N ALA A 12 2.355 7.847 -5.155 1.00 0.00 N ATOM 178 CA ALA A 12 2.240 8.233 -6.551 1.00 0.00 C ATOM 179 C ALA A 12 0.775 8.385 -6.927 1.00 0.00 C ATOM 180 O ALA A 12 -0.073 7.614 -6.470 1.00 0.00 O ATOM 181 CB ALA A 12 2.918 7.202 -7.444 1.00 0.00 C ATOM 0 H ALA A 12 1.835 7.005 -4.909 1.00 0.00 H new ATOM 0 HA ALA A 12 2.740 9.191 -6.696 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.823 7.505 -8.487 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.973 7.131 -7.181 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.443 6.231 -7.304 1.00 0.00 H new ATOM 187 N ASN A 13 0.477 9.378 -7.747 1.00 0.00 N ATOM 188 CA ASN A 13 -0.893 9.632 -8.161 1.00 0.00 C ATOM 189 C ASN A 13 -1.128 9.025 -9.534 1.00 0.00 C ATOM 190 O ASN A 13 -0.763 9.610 -10.557 1.00 0.00 O ATOM 191 CB ASN A 13 -1.183 11.138 -8.198 1.00 0.00 C ATOM 192 CG ASN A 13 -2.665 11.440 -8.299 1.00 0.00 C ATOM 193 OD1 ASN A 13 -3.239 11.480 -9.389 1.00 0.00 O ATOM 194 ND2 ASN A 13 -3.289 11.691 -7.161 1.00 0.00 N ATOM 0 H ASN A 13 1.164 10.021 -8.139 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.567 9.173 -7.437 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.781 11.605 -7.299 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.666 11.584 -9.047 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.281 11.928 -7.165 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.778 11.648 -6.279 1.00 0.00 H new ATOM 201 N LEU A 14 -1.718 7.842 -9.559 1.00 0.00 N ATOM 202 CA LEU A 14 -1.921 7.124 -10.806 1.00 0.00 C ATOM 203 C LEU A 14 -3.339 6.584 -10.885 1.00 0.00 C ATOM 204 O LEU A 14 -3.914 6.197 -9.870 1.00 0.00 O ATOM 205 CB LEU A 14 -0.882 6.000 -10.958 1.00 0.00 C ATOM 206 CG LEU A 14 -0.683 5.085 -9.740 1.00 0.00 C ATOM 207 CD1 LEU A 14 -1.741 3.993 -9.684 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.710 4.475 -9.760 1.00 0.00 C ATOM 0 H LEU A 14 -2.065 7.358 -8.731 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.783 7.818 -11.635 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.170 5.381 -11.807 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.078 6.453 -11.205 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.789 5.695 -8.843 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.569 3.365 -8.810 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -2.729 4.447 -9.616 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.683 3.384 -10.586 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.837 3.829 -8.891 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.837 3.888 -10.670 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.456 5.270 -9.733 1.00 0.00 H new ATOM 220 N ASN A 15 -3.914 6.618 -12.086 1.00 0.00 N ATOM 221 CA ASN A 15 -5.278 6.134 -12.326 1.00 0.00 C ATOM 222 C ASN A 15 -6.282 6.983 -11.543 1.00 0.00 C ATOM 223 O ASN A 15 -7.437 6.604 -11.354 1.00 0.00 O ATOM 224 CB ASN A 15 -5.401 4.650 -11.938 1.00 0.00 C ATOM 225 CG ASN A 15 -6.688 4.010 -12.431 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.224 4.385 -13.474 1.00 0.00 O ATOM 227 ND2 ASN A 15 -7.192 3.044 -11.680 1.00 0.00 N ATOM 0 H ASN A 15 -3.451 6.980 -12.920 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.500 6.225 -13.389 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.551 4.103 -12.345 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.349 4.559 -10.853 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -8.057 2.580 -11.959 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -6.716 2.763 -10.823 1.00 0.00 H new ATOM 234 N GLY A 16 -5.830 8.154 -11.107 1.00 0.00 N ATOM 235 CA GLY A 16 -6.667 9.032 -10.317 1.00 0.00 C ATOM 236 C GLY A 16 -6.664 8.660 -8.848 1.00 0.00 C ATOM 237 O GLY A 16 -7.403 9.238 -8.056 1.00 0.00 O ATOM 0 H GLY A 16 -4.892 8.511 -11.289 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.321 10.059 -10.430 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.688 8.996 -10.697 1.00 0.00 H new ATOM 241 N THR A 17 -5.844 7.686 -8.484 1.00 0.00 N ATOM 242 CA THR A 17 -5.758 7.244 -7.104 1.00 0.00 C ATOM 243 C THR A 17 -4.391 7.554 -6.508 1.00 0.00 C ATOM 244 O THR A 17 -3.361 7.386 -7.169 1.00 0.00 O ATOM 245 CB THR A 17 -6.045 5.734 -6.979 1.00 0.00 C ATOM 246 OG1 THR A 17 -5.321 4.996 -7.976 1.00 0.00 O ATOM 247 CG2 THR A 17 -7.531 5.450 -7.120 1.00 0.00 C ATOM 0 H THR A 17 -5.229 7.187 -9.127 1.00 0.00 H new ATOM 0 HA THR A 17 -6.517 7.793 -6.547 1.00 0.00 H new ATOM 0 HB THR A 17 -5.717 5.417 -5.989 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.602 5.554 -8.338 1.00 0.00 H new ATOM 0 HG21 THR A 17 -7.707 4.378 -7.028 1.00 0.00 H new ATOM 0 HG22 THR A 17 -8.078 5.976 -6.337 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.876 5.792 -8.096 1.00 0.00 H new ATOM 255 N GLU A 18 -4.384 8.018 -5.264 1.00 0.00 N ATOM 256 CA GLU A 18 -3.142 8.310 -4.569 1.00 0.00 C ATOM 257 C GLU A 18 -2.714 7.101 -3.757 1.00 0.00 C ATOM 258 O GLU A 18 -3.212 6.878 -2.654 1.00 0.00 O ATOM 259 CB GLU A 18 -3.297 9.506 -3.626 1.00 0.00 C ATOM 260 CG GLU A 18 -4.227 10.589 -4.138 1.00 0.00 C ATOM 261 CD GLU A 18 -4.163 11.843 -3.291 1.00 0.00 C ATOM 262 OE1 GLU A 18 -3.056 12.204 -2.836 1.00 0.00 O ATOM 263 OE2 GLU A 18 -5.215 12.477 -3.074 1.00 0.00 O ATOM 0 H GLU A 18 -5.226 8.199 -4.718 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.389 8.551 -5.320 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.668 9.150 -2.665 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.314 9.942 -3.447 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.965 10.834 -5.167 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.250 10.212 -4.150 1.00 0.00 H new ATOM 270 N ILE A 19 -1.817 6.307 -4.303 1.00 0.00 N ATOM 271 CA ILE A 19 -1.347 5.133 -3.599 1.00 0.00 C ATOM 272 C ILE A 19 -0.086 5.458 -2.817 1.00 0.00 C ATOM 273 O ILE A 19 0.988 5.659 -3.392 1.00 0.00 O ATOM 274 CB ILE A 19 -1.100 3.943 -4.551 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.402 3.595 -5.282 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.574 2.738 -3.778 1.00 0.00 C ATOM 277 CD1 ILE A 19 -2.331 2.326 -6.107 1.00 0.00 C ATOM 0 H ILE A 19 -1.402 6.451 -5.224 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.132 4.833 -2.905 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.345 4.223 -5.286 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.202 3.494 -4.548 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.672 4.425 -5.935 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.406 1.909 -4.466 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.365 3.000 -3.290 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.304 2.442 -3.025 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.292 2.152 -6.591 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.556 2.429 -6.866 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -2.094 1.483 -5.458 1.00 0.00 H new ATOM 289 N ALA A 20 -0.238 5.551 -1.507 1.00 0.00 N ATOM 290 CA ALA A 20 0.877 5.819 -0.622 1.00 0.00 C ATOM 291 C ALA A 20 1.125 4.621 0.279 1.00 0.00 C ATOM 292 O ALA A 20 0.316 4.300 1.147 1.00 0.00 O ATOM 293 CB ALA A 20 0.625 7.073 0.201 1.00 0.00 C ATOM 0 H ALA A 20 -1.134 5.443 -1.031 1.00 0.00 H new ATOM 0 HA ALA A 20 1.768 5.991 -1.226 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.476 7.254 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.493 7.925 -0.466 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.275 6.940 0.801 1.00 0.00 H new ATOM 299 N ILE A 21 2.236 3.949 0.052 1.00 0.00 N ATOM 300 CA ILE A 21 2.571 2.764 0.815 1.00 0.00 C ATOM 301 C ILE A 21 3.725 3.058 1.759 1.00 0.00 C ATOM 302 O ILE A 21 4.778 3.541 1.340 1.00 0.00 O ATOM 303 CB ILE A 21 2.936 1.580 -0.105 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.774 1.264 -1.057 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.301 0.353 0.719 1.00 0.00 C ATOM 306 CD1 ILE A 21 2.068 0.137 -2.026 1.00 0.00 C ATOM 0 H ILE A 21 2.924 4.205 -0.657 1.00 0.00 H new ATOM 0 HA ILE A 21 1.690 2.483 1.393 1.00 0.00 H new ATOM 0 HB ILE A 21 3.804 1.862 -0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.894 1.004 -0.468 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.525 2.162 -1.623 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.555 -0.471 0.052 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.156 0.583 1.354 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.453 0.067 1.342 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.201 -0.028 -2.666 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.928 0.401 -2.641 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.287 -0.774 -1.469 1.00 0.00 H new ATOM 318 N THR A 22 3.505 2.793 3.033 1.00 0.00 N ATOM 319 CA THR A 22 4.522 2.974 4.045 1.00 0.00 C ATOM 320 C THR A 22 5.144 1.625 4.403 1.00 0.00 C ATOM 321 O THR A 22 4.546 0.820 5.118 1.00 0.00 O ATOM 322 CB THR A 22 3.926 3.625 5.308 1.00 0.00 C ATOM 323 OG1 THR A 22 3.100 4.742 4.935 1.00 0.00 O ATOM 324 CG2 THR A 22 5.028 4.098 6.245 1.00 0.00 C ATOM 0 H THR A 22 2.616 2.446 3.393 1.00 0.00 H new ATOM 0 HA THR A 22 5.292 3.634 3.646 1.00 0.00 H new ATOM 0 HB THR A 22 3.324 2.879 5.828 1.00 0.00 H new ATOM 0 HG1 THR A 22 2.303 4.765 5.505 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.583 4.554 7.129 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.641 3.248 6.545 1.00 0.00 H new ATOM 0 HG23 THR A 22 5.651 4.832 5.733 1.00 0.00 H new ATOM 332 N TYR A 23 6.326 1.372 3.866 1.00 0.00 N ATOM 333 CA TYR A 23 7.033 0.130 4.123 1.00 0.00 C ATOM 334 C TYR A 23 7.780 0.199 5.446 1.00 0.00 C ATOM 335 O TYR A 23 8.760 0.932 5.574 1.00 0.00 O ATOM 336 CB TYR A 23 8.039 -0.167 3.007 1.00 0.00 C ATOM 337 CG TYR A 23 7.438 -0.254 1.624 1.00 0.00 C ATOM 338 CD1 TYR A 23 6.841 -1.424 1.176 1.00 0.00 C ATOM 339 CD2 TYR A 23 7.477 0.834 0.764 1.00 0.00 C ATOM 340 CE1 TYR A 23 6.300 -1.507 -0.091 1.00 0.00 C ATOM 341 CE2 TYR A 23 6.938 0.761 -0.504 1.00 0.00 C ATOM 342 CZ TYR A 23 6.350 -0.414 -0.928 1.00 0.00 C ATOM 343 OH TYR A 23 5.809 -0.493 -2.187 1.00 0.00 O ATOM 0 H TYR A 23 6.818 2.015 3.246 1.00 0.00 H new ATOM 0 HA TYR A 23 6.289 -0.665 4.163 1.00 0.00 H new ATOM 0 HB2 TYR A 23 8.803 0.610 3.008 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.542 -1.108 3.230 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.799 -2.283 1.829 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.937 1.754 1.093 1.00 0.00 H new ATOM 0 HE1 TYR A 23 5.839 -2.425 -0.425 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.976 1.618 -1.161 1.00 0.00 H new ATOM 0 HH TYR A 23 6.375 -0.000 -2.818 1.00 0.00 H new ATOM 353 N VAL A 24 7.308 -0.544 6.428 1.00 0.00 N ATOM 354 CA VAL A 24 8.041 -0.702 7.668 1.00 0.00 C ATOM 355 C VAL A 24 8.894 -1.954 7.580 1.00 0.00 C ATOM 356 O VAL A 24 8.391 -3.080 7.646 1.00 0.00 O ATOM 357 CB VAL A 24 7.112 -0.773 8.899 1.00 0.00 C ATOM 358 CG1 VAL A 24 7.879 -1.213 10.140 1.00 0.00 C ATOM 359 CG2 VAL A 24 6.473 0.582 9.140 1.00 0.00 C ATOM 0 H VAL A 24 6.421 -1.047 6.391 1.00 0.00 H new ATOM 0 HA VAL A 24 8.671 0.178 7.802 1.00 0.00 H new ATOM 0 HB VAL A 24 6.335 -1.511 8.699 1.00 0.00 H new ATOM 0 HG11 VAL A 24 7.200 -1.254 10.992 1.00 0.00 H new ATOM 0 HG12 VAL A 24 8.309 -2.200 9.971 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.677 -0.500 10.346 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.818 0.526 10.010 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.251 1.325 9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.890 0.870 8.265 1.00 0.00 H new ATOM 369 N TYR A 25 10.181 -1.753 7.389 1.00 0.00 N ATOM 370 CA TYR A 25 11.092 -2.858 7.212 1.00 0.00 C ATOM 371 C TYR A 25 12.216 -2.788 8.231 1.00 0.00 C ATOM 372 O TYR A 25 12.422 -1.765 8.882 1.00 0.00 O ATOM 373 CB TYR A 25 11.650 -2.880 5.777 1.00 0.00 C ATOM 374 CG TYR A 25 12.644 -1.783 5.442 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.225 -0.533 4.994 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.012 -2.010 5.554 1.00 0.00 C ATOM 377 CE1 TYR A 25 13.142 0.448 4.674 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.931 -1.030 5.232 1.00 0.00 C ATOM 379 CZ TYR A 25 14.490 0.197 4.793 1.00 0.00 C ATOM 380 OH TYR A 25 15.396 1.183 4.472 1.00 0.00 O ATOM 0 H TYR A 25 10.618 -0.832 7.353 1.00 0.00 H new ATOM 0 HA TYR A 25 10.544 -3.786 7.373 1.00 0.00 H new ATOM 0 HB2 TYR A 25 12.130 -3.844 5.608 1.00 0.00 H new ATOM 0 HB3 TYR A 25 10.814 -2.813 5.080 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.169 -0.328 4.896 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.362 -2.971 5.900 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.801 1.413 4.330 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.989 -1.226 5.324 1.00 0.00 H new ATOM 0 HH TYR A 25 16.307 0.848 4.611 1.00 0.00 H new ATOM 390 N LYS A 26 12.911 -3.892 8.378 1.00 0.00 N ATOM 391 CA LYS A 26 14.072 -3.967 9.244 1.00 0.00 C ATOM 392 C LYS A 26 15.173 -4.733 8.522 1.00 0.00 C ATOM 393 O LYS A 26 15.009 -5.914 8.203 1.00 0.00 O ATOM 394 CB LYS A 26 13.710 -4.654 10.559 1.00 0.00 C ATOM 395 CG LYS A 26 13.955 -3.776 11.770 1.00 0.00 C ATOM 396 CD LYS A 26 15.432 -3.677 12.107 1.00 0.00 C ATOM 397 CE LYS A 26 15.684 -2.569 13.109 1.00 0.00 C ATOM 398 NZ LYS A 26 15.841 -1.247 12.446 1.00 0.00 N ATOM 0 H LYS A 26 12.690 -4.766 7.901 1.00 0.00 H new ATOM 0 HA LYS A 26 14.423 -2.962 9.478 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.660 -4.945 10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.292 -5.570 10.657 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.558 -2.779 11.582 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.413 -4.178 12.626 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.781 -4.626 12.513 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.005 -3.489 11.199 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.856 -2.524 13.817 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.582 -2.796 13.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.345 -0.520 13.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.851 -1.007 12.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 15.436 -1.288 11.489 1.00 0.00 H new ATOM 412 N GLY A 27 16.278 -4.061 8.234 1.00 0.00 N ATOM 413 CA GLY A 27 17.301 -4.671 7.410 1.00 0.00 C ATOM 414 C GLY A 27 16.858 -4.725 5.962 1.00 0.00 C ATOM 415 O GLY A 27 16.667 -3.687 5.331 1.00 0.00 O ATOM 0 H GLY A 27 16.484 -3.114 8.552 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.228 -4.103 7.491 1.00 0.00 H new ATOM 0 HA3 GLY A 27 17.512 -5.678 7.769 1.00 0.00 H new ATOM 419 N ASP A 28 16.695 -5.927 5.429 1.00 0.00 N ATOM 420 CA ASP A 28 16.126 -6.082 4.092 1.00 0.00 C ATOM 421 C ASP A 28 14.772 -6.777 4.196 1.00 0.00 C ATOM 422 O ASP A 28 14.152 -7.128 3.196 1.00 0.00 O ATOM 423 CB ASP A 28 17.066 -6.877 3.173 1.00 0.00 C ATOM 424 CG ASP A 28 16.745 -6.687 1.695 1.00 0.00 C ATOM 425 OD1 ASP A 28 17.229 -5.695 1.105 1.00 0.00 O ATOM 426 OD2 ASP A 28 16.020 -7.523 1.115 1.00 0.00 O ATOM 0 H ASP A 28 16.944 -6.801 5.892 1.00 0.00 H new ATOM 0 HA ASP A 28 15.996 -5.093 3.653 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.095 -6.569 3.359 1.00 0.00 H new ATOM 0 HB3 ASP A 28 17.000 -7.936 3.421 1.00 0.00 H new ATOM 431 N LYS A 29 14.305 -6.959 5.422 1.00 0.00 N ATOM 432 CA LYS A 29 13.045 -7.647 5.652 1.00 0.00 C ATOM 433 C LYS A 29 11.927 -6.643 5.859 1.00 0.00 C ATOM 434 O LYS A 29 11.876 -5.975 6.891 1.00 0.00 O ATOM 435 CB LYS A 29 13.140 -8.550 6.881 1.00 0.00 C ATOM 436 CG LYS A 29 12.353 -9.845 6.748 1.00 0.00 C ATOM 437 CD LYS A 29 12.389 -10.662 8.033 1.00 0.00 C ATOM 438 CE LYS A 29 13.810 -10.881 8.529 1.00 0.00 C ATOM 439 NZ LYS A 29 14.654 -11.591 7.533 1.00 0.00 N ATOM 0 H LYS A 29 14.777 -6.642 6.269 1.00 0.00 H new ATOM 0 HA LYS A 29 12.830 -8.257 4.775 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.187 -8.789 7.066 1.00 0.00 H new ATOM 0 HB3 LYS A 29 12.779 -8.003 7.752 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.319 -9.617 6.491 1.00 0.00 H new ATOM 0 HG3 LYS A 29 12.762 -10.437 5.929 1.00 0.00 H new ATOM 0 HD2 LYS A 29 11.811 -10.152 8.803 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.912 -11.627 7.863 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.263 -9.918 8.764 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.784 -11.455 9.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 15.586 -11.792 7.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 14.195 -12.485 7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 14.772 -10.994 6.690 1.00 0.00 H new ATOM 453 N VAL A 30 11.046 -6.516 4.881 1.00 0.00 N ATOM 454 CA VAL A 30 9.875 -5.674 5.045 1.00 0.00 C ATOM 455 C VAL A 30 8.859 -6.406 5.905 1.00 0.00 C ATOM 456 O VAL A 30 8.325 -7.435 5.503 1.00 0.00 O ATOM 457 CB VAL A 30 9.228 -5.281 3.704 1.00 0.00 C ATOM 458 CG1 VAL A 30 8.152 -4.235 3.936 1.00 0.00 C ATOM 459 CG2 VAL A 30 10.274 -4.769 2.726 1.00 0.00 C ATOM 0 H VAL A 30 11.118 -6.980 3.975 1.00 0.00 H new ATOM 0 HA VAL A 30 10.198 -4.750 5.524 1.00 0.00 H new ATOM 0 HB VAL A 30 8.769 -6.167 3.266 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.699 -3.962 2.983 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.387 -4.640 4.599 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.597 -3.351 4.393 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.792 -4.498 1.787 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.767 -3.893 3.147 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.013 -5.549 2.543 1.00 0.00 H new ATOM 469 N LEU A 31 8.610 -5.883 7.092 1.00 0.00 N ATOM 470 CA LEU A 31 7.784 -6.574 8.065 1.00 0.00 C ATOM 471 C LEU A 31 6.326 -6.142 7.961 1.00 0.00 C ATOM 472 O LEU A 31 5.419 -6.964 8.071 1.00 0.00 O ATOM 473 CB LEU A 31 8.336 -6.339 9.472 1.00 0.00 C ATOM 474 CG LEU A 31 9.789 -6.788 9.657 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.286 -6.469 11.056 1.00 0.00 C ATOM 476 CD2 LEU A 31 9.923 -8.275 9.376 1.00 0.00 C ATOM 0 H LEU A 31 8.968 -4.981 7.406 1.00 0.00 H new ATOM 0 HA LEU A 31 7.815 -7.643 7.853 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.262 -5.277 9.707 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.709 -6.868 10.190 1.00 0.00 H new ATOM 0 HG LEU A 31 10.405 -6.238 8.945 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.320 -6.799 11.159 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.229 -5.394 11.226 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.666 -6.985 11.789 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.961 -8.579 9.512 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.288 -8.834 10.064 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.616 -8.481 8.351 1.00 0.00 H new ATOM 488 N LYS A 32 6.098 -4.858 7.734 1.00 0.00 N ATOM 489 CA LYS A 32 4.745 -4.354 7.553 1.00 0.00 C ATOM 490 C LYS A 32 4.663 -3.456 6.331 1.00 0.00 C ATOM 491 O LYS A 32 5.384 -2.468 6.222 1.00 0.00 O ATOM 492 CB LYS A 32 4.267 -3.589 8.789 1.00 0.00 C ATOM 493 CG LYS A 32 4.066 -4.467 10.013 1.00 0.00 C ATOM 494 CD LYS A 32 3.419 -3.696 11.152 1.00 0.00 C ATOM 495 CE LYS A 32 3.217 -4.569 12.382 1.00 0.00 C ATOM 496 NZ LYS A 32 2.352 -5.748 12.105 1.00 0.00 N ATOM 0 H LYS A 32 6.828 -4.149 7.671 1.00 0.00 H new ATOM 0 HA LYS A 32 4.093 -5.215 7.406 1.00 0.00 H new ATOM 0 HB2 LYS A 32 4.993 -2.811 9.026 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.328 -3.088 8.554 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.442 -5.322 9.750 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.028 -4.863 10.340 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.042 -2.840 11.412 1.00 0.00 H new ATOM 0 HD3 LYS A 32 2.457 -3.302 10.824 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.186 -4.910 12.745 1.00 0.00 H new ATOM 0 HE3 LYS A 32 2.770 -3.973 13.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 1.773 -5.958 12.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 1.730 -5.540 11.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.948 -6.570 11.881 1.00 0.00 H new ATOM 510 N GLN A 33 3.784 -3.811 5.413 1.00 0.00 N ATOM 511 CA GLN A 33 3.547 -3.009 4.230 1.00 0.00 C ATOM 512 C GLN A 33 2.194 -2.321 4.346 1.00 0.00 C ATOM 513 O GLN A 33 1.154 -2.916 4.062 1.00 0.00 O ATOM 514 CB GLN A 33 3.586 -3.882 2.972 1.00 0.00 C ATOM 515 CG GLN A 33 3.471 -3.094 1.679 1.00 0.00 C ATOM 516 CD GLN A 33 3.336 -3.987 0.461 1.00 0.00 C ATOM 517 OE1 GLN A 33 4.329 -4.399 -0.132 1.00 0.00 O ATOM 518 NE2 GLN A 33 2.104 -4.268 0.068 1.00 0.00 N ATOM 0 H GLN A 33 3.218 -4.658 5.466 1.00 0.00 H new ATOM 0 HA GLN A 33 4.331 -2.256 4.150 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.518 -4.447 2.961 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.774 -4.608 3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.607 -2.432 1.737 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.351 -2.461 1.565 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.307 -3.905 0.590 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.952 -4.848 -0.757 1.00 0.00 H new ATOM 527 N SER A 34 2.206 -1.082 4.801 1.00 0.00 N ATOM 528 CA SER A 34 0.979 -0.322 4.928 1.00 0.00 C ATOM 529 C SER A 34 0.646 0.351 3.600 1.00 0.00 C ATOM 530 O SER A 34 1.175 1.406 3.276 1.00 0.00 O ATOM 531 CB SER A 34 1.108 0.716 6.044 1.00 0.00 C ATOM 532 OG SER A 34 1.407 0.088 7.284 1.00 0.00 O ATOM 0 H SER A 34 3.048 -0.583 5.087 1.00 0.00 H new ATOM 0 HA SER A 34 0.167 -1.000 5.188 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.893 1.430 5.794 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.180 1.280 6.131 1.00 0.00 H new ATOM 0 HG SER A 34 1.487 0.769 7.984 1.00 0.00 H new ATOM 538 N SER A 35 -0.231 -0.278 2.841 1.00 0.00 N ATOM 539 CA SER A 35 -0.591 0.214 1.527 1.00 0.00 C ATOM 540 C SER A 35 -1.883 1.017 1.606 1.00 0.00 C ATOM 541 O SER A 35 -2.972 0.458 1.684 1.00 0.00 O ATOM 542 CB SER A 35 -0.753 -0.965 0.564 1.00 0.00 C ATOM 543 OG SER A 35 0.394 -1.803 0.586 1.00 0.00 O ATOM 0 H SER A 35 -0.709 -1.136 3.115 1.00 0.00 H new ATOM 0 HA SER A 35 0.200 0.867 1.157 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.635 -1.544 0.837 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.916 -0.593 -0.447 1.00 0.00 H new ATOM 0 HG SER A 35 0.507 -2.225 -0.291 1.00 0.00 H new ATOM 549 N GLU A 36 -1.751 2.332 1.622 1.00 0.00 N ATOM 550 CA GLU A 36 -2.899 3.210 1.732 1.00 0.00 C ATOM 551 C GLU A 36 -3.300 3.732 0.357 1.00 0.00 C ATOM 552 O GLU A 36 -2.600 4.549 -0.245 1.00 0.00 O ATOM 553 CB GLU A 36 -2.580 4.367 2.672 1.00 0.00 C ATOM 554 CG GLU A 36 -2.150 3.922 4.062 1.00 0.00 C ATOM 555 CD GLU A 36 -1.770 5.087 4.950 1.00 0.00 C ATOM 556 OE1 GLU A 36 -2.680 5.700 5.549 1.00 0.00 O ATOM 557 OE2 GLU A 36 -0.564 5.402 5.047 1.00 0.00 O ATOM 0 H GLU A 36 -0.855 2.815 1.560 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.737 2.647 2.142 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.788 4.973 2.233 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.459 5.006 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.961 3.363 4.528 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.302 3.242 3.977 1.00 0.00 H new ATOM 564 N THR A 37 -4.423 3.244 -0.137 1.00 0.00 N ATOM 565 CA THR A 37 -4.906 3.617 -1.458 1.00 0.00 C ATOM 566 C THR A 37 -5.987 4.693 -1.352 1.00 0.00 C ATOM 567 O THR A 37 -7.118 4.412 -0.964 1.00 0.00 O ATOM 568 CB THR A 37 -5.474 2.387 -2.197 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.524 1.315 -2.159 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.809 2.716 -3.643 1.00 0.00 C ATOM 0 H THR A 37 -5.022 2.584 0.359 1.00 0.00 H new ATOM 0 HA THR A 37 -4.063 4.014 -2.023 1.00 0.00 H new ATOM 0 HB THR A 37 -6.392 2.087 -1.692 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.890 0.536 -2.628 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.207 1.829 -4.135 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.554 3.511 -3.672 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.907 3.044 -4.160 1.00 0.00 H new ATOM 578 N LYS A 38 -5.635 5.932 -1.674 1.00 0.00 N ATOM 579 CA LYS A 38 -6.586 7.030 -1.600 1.00 0.00 C ATOM 580 C LYS A 38 -7.360 7.139 -2.905 1.00 0.00 C ATOM 581 O LYS A 38 -6.822 7.579 -3.923 1.00 0.00 O ATOM 582 CB LYS A 38 -5.874 8.347 -1.300 1.00 0.00 C ATOM 583 CG LYS A 38 -6.812 9.458 -0.860 1.00 0.00 C ATOM 584 CD LYS A 38 -6.080 10.778 -0.684 1.00 0.00 C ATOM 585 CE LYS A 38 -4.900 10.651 0.264 1.00 0.00 C ATOM 586 NZ LYS A 38 -4.047 11.870 0.250 1.00 0.00 N ATOM 0 H LYS A 38 -4.702 6.199 -1.987 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.283 6.826 -0.788 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.131 8.180 -0.520 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.334 8.670 -2.190 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.605 9.578 -1.598 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.290 9.179 0.079 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -5.730 11.131 -1.654 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.772 11.529 -0.303 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -5.264 10.474 1.276 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -4.301 9.785 -0.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.323 11.795 0.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -3.585 11.960 -0.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.637 12.708 0.425 1.00 0.00 H new ATOM 600 N ILE A 39 -8.612 6.722 -2.869 1.00 0.00 N ATOM 601 CA ILE A 39 -9.449 6.702 -4.054 1.00 0.00 C ATOM 602 C ILE A 39 -10.455 7.848 -4.032 1.00 0.00 C ATOM 603 O ILE A 39 -11.371 7.871 -3.207 1.00 0.00 O ATOM 604 CB ILE A 39 -10.217 5.364 -4.170 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.247 4.181 -4.086 1.00 0.00 C ATOM 606 CG2 ILE A 39 -11.009 5.316 -5.472 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.931 2.830 -4.074 1.00 0.00 C ATOM 0 H ILE A 39 -9.075 6.390 -2.023 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.790 6.815 -4.915 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.918 5.294 -3.338 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.562 4.224 -4.933 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.644 4.281 -3.183 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.543 4.368 -5.538 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.724 6.138 -5.493 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.326 5.407 -6.317 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.180 2.042 -4.013 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.595 2.766 -3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.511 2.708 -4.988 1.00 0.00 H new ATOM 619 N GLN A 40 -10.263 8.813 -4.920 1.00 0.00 N ATOM 620 CA GLN A 40 -11.238 9.878 -5.107 1.00 0.00 C ATOM 621 C GLN A 40 -12.524 9.309 -5.700 1.00 0.00 C ATOM 622 O GLN A 40 -12.496 8.306 -6.419 1.00 0.00 O ATOM 623 CB GLN A 40 -10.685 10.974 -6.028 1.00 0.00 C ATOM 624 CG GLN A 40 -9.763 11.979 -5.344 1.00 0.00 C ATOM 625 CD GLN A 40 -8.467 11.376 -4.834 1.00 0.00 C ATOM 626 OE1 GLN A 40 -7.961 10.395 -5.377 1.00 0.00 O ATOM 627 NE2 GLN A 40 -7.913 11.980 -3.796 1.00 0.00 N ATOM 0 H GLN A 40 -9.442 8.880 -5.522 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.450 10.320 -4.133 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.141 10.501 -6.846 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.522 11.513 -6.471 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -9.529 12.779 -6.046 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -10.294 12.434 -4.508 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.367 12.791 -3.376 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -7.032 11.635 -3.416 1.00 0.00 H new ATOM 636 N PHE A 41 -13.648 9.953 -5.412 1.00 0.00 N ATOM 637 CA PHE A 41 -14.942 9.483 -5.894 1.00 0.00 C ATOM 638 C PHE A 41 -15.032 9.593 -7.408 1.00 0.00 C ATOM 639 O PHE A 41 -15.709 8.795 -8.059 1.00 0.00 O ATOM 640 CB PHE A 41 -16.077 10.265 -5.237 1.00 0.00 C ATOM 641 CG PHE A 41 -16.443 9.756 -3.871 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.480 9.223 -3.026 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.752 9.809 -3.435 1.00 0.00 C ATOM 644 CE1 PHE A 41 -15.821 8.752 -1.774 1.00 0.00 C ATOM 645 CE2 PHE A 41 -18.098 9.340 -2.184 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.131 8.810 -1.353 1.00 0.00 C ATOM 0 H PHE A 41 -13.691 10.802 -4.848 1.00 0.00 H new ATOM 0 HA PHE A 41 -15.040 8.432 -5.622 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.789 11.313 -5.160 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.956 10.223 -5.880 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.451 9.176 -3.352 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.513 10.222 -4.080 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.062 8.339 -1.126 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -19.126 9.388 -1.855 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.401 8.442 -0.374 1.00 0.00 H new ATOM 656 N ALA A 42 -14.327 10.569 -7.967 1.00 0.00 N ATOM 657 CA ALA A 42 -14.284 10.744 -9.415 1.00 0.00 C ATOM 658 C ALA A 42 -13.453 9.644 -10.073 1.00 0.00 C ATOM 659 O ALA A 42 -13.588 9.377 -11.265 1.00 0.00 O ATOM 660 CB ALA A 42 -13.721 12.114 -9.767 1.00 0.00 C ATOM 0 H ALA A 42 -13.778 11.250 -7.442 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.303 10.675 -9.796 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.695 12.229 -10.851 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.353 12.889 -9.334 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.711 12.206 -9.368 1.00 0.00 H new ATOM 666 N SER A 43 -12.603 9.001 -9.284 1.00 0.00 N ATOM 667 CA SER A 43 -11.716 7.966 -9.791 1.00 0.00 C ATOM 668 C SER A 43 -12.386 6.595 -9.741 1.00 0.00 C ATOM 669 O SER A 43 -12.150 5.746 -10.602 1.00 0.00 O ATOM 670 CB SER A 43 -10.432 7.957 -8.968 1.00 0.00 C ATOM 671 OG SER A 43 -9.951 9.279 -8.794 1.00 0.00 O ATOM 0 H SER A 43 -12.510 9.180 -8.284 1.00 0.00 H new ATOM 0 HA SER A 43 -11.482 8.183 -10.833 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.618 7.499 -7.996 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.676 7.350 -9.467 1.00 0.00 H new ATOM 0 HG SER A 43 -9.054 9.252 -8.399 1.00 0.00 H new ATOM 677 N ILE A 44 -13.217 6.383 -8.727 1.00 0.00 N ATOM 678 CA ILE A 44 -13.948 5.129 -8.588 1.00 0.00 C ATOM 679 C ILE A 44 -15.234 5.154 -9.411 1.00 0.00 C ATOM 680 O ILE A 44 -15.673 4.128 -9.935 1.00 0.00 O ATOM 681 CB ILE A 44 -14.286 4.821 -7.104 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.243 3.624 -7.004 1.00 0.00 C ATOM 683 CG2 ILE A 44 -14.874 6.044 -6.416 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.761 3.360 -5.605 1.00 0.00 C ATOM 0 H ILE A 44 -13.401 7.063 -7.989 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.297 4.339 -8.962 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.360 4.561 -6.591 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.091 3.794 -7.667 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -14.731 2.732 -7.364 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.102 5.803 -5.378 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.154 6.861 -6.449 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -15.788 6.345 -6.928 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.430 2.499 -5.621 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -14.923 3.156 -4.939 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.304 4.235 -5.247 1.00 0.00 H new ATOM 696 N GLY A 45 -15.814 6.337 -9.542 1.00 0.00 N ATOM 697 CA GLY A 45 -17.100 6.460 -10.194 1.00 0.00 C ATOM 698 C GLY A 45 -18.231 6.267 -9.208 1.00 0.00 C ATOM 699 O GLY A 45 -19.253 5.656 -9.526 1.00 0.00 O ATOM 0 H GLY A 45 -15.416 7.215 -9.208 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.183 7.442 -10.659 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.179 5.721 -10.992 1.00 0.00 H new ATOM 703 N ALA A 46 -18.035 6.780 -8.000 1.00 0.00 N ATOM 704 CA ALA A 46 -19.016 6.638 -6.932 1.00 0.00 C ATOM 705 C ALA A 46 -19.915 7.864 -6.843 1.00 0.00 C ATOM 706 O ALA A 46 -19.575 8.933 -7.353 1.00 0.00 O ATOM 707 CB ALA A 46 -18.321 6.403 -5.601 1.00 0.00 C ATOM 0 H ALA A 46 -17.200 7.302 -7.734 1.00 0.00 H new ATOM 0 HA ALA A 46 -19.640 5.775 -7.164 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.068 6.299 -4.814 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -17.725 5.492 -5.658 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.671 7.249 -5.375 1.00 0.00 H new ATOM 713 N THR A 47 -21.063 7.700 -6.203 1.00 0.00 N ATOM 714 CA THR A 47 -22.001 8.796 -6.025 1.00 0.00 C ATOM 715 C THR A 47 -21.826 9.435 -4.647 1.00 0.00 C ATOM 716 O THR A 47 -21.406 10.587 -4.535 1.00 0.00 O ATOM 717 CB THR A 47 -23.454 8.311 -6.186 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.565 7.495 -7.362 1.00 0.00 O ATOM 719 CG2 THR A 47 -24.412 9.488 -6.291 1.00 0.00 C ATOM 0 H THR A 47 -21.367 6.815 -5.797 1.00 0.00 H new ATOM 0 HA THR A 47 -21.791 9.539 -6.795 1.00 0.00 H new ATOM 0 HB THR A 47 -23.720 7.726 -5.305 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.490 7.187 -7.460 1.00 0.00 H new ATOM 0 HG21 THR A 47 -25.431 9.119 -6.404 1.00 0.00 H new ATOM 0 HG22 THR A 47 -24.344 10.094 -5.388 1.00 0.00 H new ATOM 0 HG23 THR A 47 -24.148 10.096 -7.157 1.00 0.00 H new ATOM 727 N THR A 48 -22.155 8.679 -3.606 1.00 0.00 N ATOM 728 CA THR A 48 -21.980 9.130 -2.233 1.00 0.00 C ATOM 729 C THR A 48 -21.068 8.166 -1.475 1.00 0.00 C ATOM 730 O THR A 48 -20.586 7.185 -2.048 1.00 0.00 O ATOM 731 CB THR A 48 -23.335 9.248 -1.508 1.00 0.00 C ATOM 732 OG1 THR A 48 -24.078 8.027 -1.634 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.152 10.405 -2.063 1.00 0.00 C ATOM 0 H THR A 48 -22.548 7.742 -3.690 1.00 0.00 H new ATOM 0 HA THR A 48 -21.520 10.118 -2.260 1.00 0.00 H new ATOM 0 HB THR A 48 -23.134 9.439 -0.454 1.00 0.00 H new ATOM 0 HG1 THR A 48 -24.997 8.170 -1.324 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.103 10.466 -1.534 1.00 0.00 H new ATOM 0 HG22 THR A 48 -23.602 11.336 -1.929 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.337 10.243 -3.125 1.00 0.00 H new ATOM 741 N LYS A 49 -20.839 8.428 -0.190 1.00 0.00 N ATOM 742 CA LYS A 49 -19.900 7.627 0.589 1.00 0.00 C ATOM 743 C LYS A 49 -20.442 6.217 0.828 1.00 0.00 C ATOM 744 O LYS A 49 -19.676 5.257 0.898 1.00 0.00 O ATOM 745 CB LYS A 49 -19.553 8.315 1.918 1.00 0.00 C ATOM 746 CG LYS A 49 -20.743 8.552 2.836 1.00 0.00 C ATOM 747 CD LYS A 49 -20.331 9.269 4.116 1.00 0.00 C ATOM 748 CE LYS A 49 -19.801 10.669 3.831 1.00 0.00 C ATOM 749 NZ LYS A 49 -20.864 11.585 3.336 1.00 0.00 N ATOM 0 H LYS A 49 -21.287 9.183 0.330 1.00 0.00 H new ATOM 0 HA LYS A 49 -18.982 7.538 0.009 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -18.818 7.707 2.446 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -19.079 9.273 1.704 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -21.494 9.143 2.313 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -21.206 7.597 3.086 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -21.186 9.333 4.789 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.565 8.687 4.629 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -19.363 11.081 4.740 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -19.002 10.609 3.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.444 12.504 3.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -21.311 11.174 2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -21.581 11.718 4.078 1.00 0.00 H new ATOM 763 N GLU A 50 -21.762 6.096 0.939 1.00 0.00 N ATOM 764 CA GLU A 50 -22.400 4.789 1.082 1.00 0.00 C ATOM 765 C GLU A 50 -22.238 4.008 -0.215 1.00 0.00 C ATOM 766 O GLU A 50 -21.914 2.819 -0.213 1.00 0.00 O ATOM 767 CB GLU A 50 -23.897 4.918 1.402 1.00 0.00 C ATOM 768 CG GLU A 50 -24.265 6.127 2.249 1.00 0.00 C ATOM 769 CD GLU A 50 -24.404 7.388 1.420 1.00 0.00 C ATOM 770 OE1 GLU A 50 -25.482 7.603 0.832 1.00 0.00 O ATOM 771 OE2 GLU A 50 -23.429 8.159 1.333 1.00 0.00 O ATOM 0 H GLU A 50 -22.410 6.884 0.933 1.00 0.00 H new ATOM 0 HA GLU A 50 -21.918 4.269 1.910 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.452 4.966 0.465 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -24.223 4.016 1.920 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -25.203 5.932 2.769 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -23.502 6.279 3.013 1.00 0.00 H new ATOM 778 N ASP A 51 -22.466 4.707 -1.324 1.00 0.00 N ATOM 779 CA ASP A 51 -22.330 4.133 -2.659 1.00 0.00 C ATOM 780 C ASP A 51 -20.912 3.617 -2.881 1.00 0.00 C ATOM 781 O ASP A 51 -20.713 2.538 -3.438 1.00 0.00 O ATOM 782 CB ASP A 51 -22.676 5.191 -3.710 1.00 0.00 C ATOM 783 CG ASP A 51 -22.511 4.701 -5.135 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.434 4.040 -5.653 1.00 0.00 O ATOM 785 OD2 ASP A 51 -21.469 5.002 -5.753 1.00 0.00 O ATOM 0 H ASP A 51 -22.750 5.687 -1.322 1.00 0.00 H new ATOM 0 HA ASP A 51 -23.018 3.293 -2.752 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -23.706 5.516 -3.562 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -22.042 6.064 -3.558 1.00 0.00 H new ATOM 790 N ALA A 52 -19.938 4.393 -2.425 1.00 0.00 N ATOM 791 CA ALA A 52 -18.536 4.026 -2.554 1.00 0.00 C ATOM 792 C ALA A 52 -18.211 2.784 -1.731 1.00 0.00 C ATOM 793 O ALA A 52 -17.532 1.878 -2.213 1.00 0.00 O ATOM 794 CB ALA A 52 -17.645 5.184 -2.135 1.00 0.00 C ATOM 0 H ALA A 52 -20.096 5.287 -1.959 1.00 0.00 H new ATOM 0 HA ALA A 52 -18.346 3.795 -3.602 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.599 4.894 -2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -17.846 6.046 -2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -17.850 5.443 -1.096 1.00 0.00 H new ATOM 800 N ALA A 53 -18.707 2.735 -0.498 1.00 0.00 N ATOM 801 CA ALA A 53 -18.422 1.612 0.387 1.00 0.00 C ATOM 802 C ALA A 53 -18.949 0.309 -0.188 1.00 0.00 C ATOM 803 O ALA A 53 -18.243 -0.689 -0.214 1.00 0.00 O ATOM 804 CB ALA A 53 -18.995 1.838 1.774 1.00 0.00 C ATOM 0 H ALA A 53 -19.304 3.455 -0.092 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.338 1.540 0.472 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.764 0.981 2.407 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.557 2.738 2.206 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.076 1.958 1.706 1.00 0.00 H new ATOM 810 N LYS A 54 -20.176 0.329 -0.681 1.00 0.00 N ATOM 811 CA LYS A 54 -20.794 -0.871 -1.234 1.00 0.00 C ATOM 812 C LYS A 54 -20.029 -1.382 -2.456 1.00 0.00 C ATOM 813 O LYS A 54 -20.258 -2.500 -2.922 1.00 0.00 O ATOM 814 CB LYS A 54 -22.259 -0.597 -1.575 1.00 0.00 C ATOM 815 CG LYS A 54 -23.125 -0.405 -0.340 1.00 0.00 C ATOM 816 CD LYS A 54 -24.547 0.000 -0.691 1.00 0.00 C ATOM 817 CE LYS A 54 -24.603 1.399 -1.283 1.00 0.00 C ATOM 818 NZ LYS A 54 -26.001 1.878 -1.438 1.00 0.00 N ATOM 0 H LYS A 54 -20.766 1.161 -0.711 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.754 -1.656 -0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.322 0.294 -2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.652 -1.426 -2.163 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -23.145 -1.331 0.235 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.679 0.358 0.299 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.963 -0.713 -1.402 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -25.169 -0.042 0.203 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -24.052 2.087 -0.642 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.108 1.403 -2.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.997 2.835 -1.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -26.520 1.236 -2.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -26.466 1.899 -0.508 1.00 0.00 H new ATOM 832 N THR A 55 -19.124 -0.561 -2.967 1.00 0.00 N ATOM 833 CA THR A 55 -18.259 -0.956 -4.061 1.00 0.00 C ATOM 834 C THR A 55 -16.872 -1.382 -3.552 1.00 0.00 C ATOM 835 O THR A 55 -16.348 -2.422 -3.951 1.00 0.00 O ATOM 836 CB THR A 55 -18.114 0.195 -5.079 1.00 0.00 C ATOM 837 OG1 THR A 55 -19.415 0.635 -5.495 1.00 0.00 O ATOM 838 CG2 THR A 55 -17.311 -0.242 -6.299 1.00 0.00 C ATOM 0 H THR A 55 -18.971 0.391 -2.635 1.00 0.00 H new ATOM 0 HA THR A 55 -18.720 -1.812 -4.553 1.00 0.00 H new ATOM 0 HB THR A 55 -17.580 1.012 -4.594 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.791 1.233 -4.816 1.00 0.00 H new ATOM 0 HG21 THR A 55 -17.227 0.591 -6.997 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.315 -0.555 -5.986 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.816 -1.075 -6.788 1.00 0.00 H new ATOM 846 N LEU A 56 -16.293 -0.593 -2.645 1.00 0.00 N ATOM 847 CA LEU A 56 -14.910 -0.811 -2.215 1.00 0.00 C ATOM 848 C LEU A 56 -14.792 -1.821 -1.073 1.00 0.00 C ATOM 849 O LEU A 56 -13.726 -2.393 -0.867 1.00 0.00 O ATOM 850 CB LEU A 56 -14.254 0.504 -1.794 1.00 0.00 C ATOM 851 CG LEU A 56 -14.222 1.594 -2.865 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.611 2.869 -2.304 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.444 1.121 -4.083 1.00 0.00 C ATOM 0 H LEU A 56 -16.756 0.197 -2.196 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.390 -1.224 -3.079 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.782 0.891 -0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.231 0.296 -1.481 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.246 1.807 -3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.595 3.636 -3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.207 3.217 -1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.593 2.668 -1.971 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.431 1.910 -4.835 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.421 0.882 -3.791 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.921 0.232 -4.497 1.00 0.00 H new ATOM 865 N GLU A 57 -15.865 -2.044 -0.324 1.00 0.00 N ATOM 866 CA GLU A 57 -15.825 -3.038 0.745 1.00 0.00 C ATOM 867 C GLU A 57 -15.516 -4.430 0.169 1.00 0.00 C ATOM 868 O GLU A 57 -14.591 -5.098 0.632 1.00 0.00 O ATOM 869 CB GLU A 57 -17.118 -3.055 1.571 1.00 0.00 C ATOM 870 CG GLU A 57 -17.318 -1.798 2.395 1.00 0.00 C ATOM 871 CD GLU A 57 -18.391 -1.958 3.452 1.00 0.00 C ATOM 872 OE1 GLU A 57 -19.583 -1.763 3.132 1.00 0.00 O ATOM 873 OE2 GLU A 57 -18.047 -2.282 4.607 1.00 0.00 O ATOM 0 H GLU A 57 -16.757 -1.562 -0.432 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.023 -2.756 1.426 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -17.968 -3.181 0.900 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.105 -3.919 2.236 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.377 -1.530 2.876 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -17.585 -0.973 1.734 1.00 0.00 H new ATOM 880 N PRO A 58 -16.284 -4.890 -0.851 1.00 0.00 N ATOM 881 CA PRO A 58 -15.944 -6.100 -1.616 1.00 0.00 C ATOM 882 C PRO A 58 -14.504 -6.082 -2.137 1.00 0.00 C ATOM 883 O PRO A 58 -13.855 -7.125 -2.235 1.00 0.00 O ATOM 884 CB PRO A 58 -16.911 -6.068 -2.799 1.00 0.00 C ATOM 885 CG PRO A 58 -18.075 -5.259 -2.344 1.00 0.00 C ATOM 886 CD PRO A 58 -17.567 -4.308 -1.291 1.00 0.00 C ATOM 0 HA PRO A 58 -16.024 -6.993 -0.996 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.442 -5.622 -3.676 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.220 -7.075 -3.080 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -18.514 -4.712 -3.178 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.856 -5.902 -1.938 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.429 -3.305 -1.696 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.269 -4.223 -0.462 1.00 0.00 H new ATOM 894 N LEU A 59 -14.020 -4.890 -2.470 1.00 0.00 N ATOM 895 CA LEU A 59 -12.672 -4.712 -2.999 1.00 0.00 C ATOM 896 C LEU A 59 -11.620 -5.083 -1.958 1.00 0.00 C ATOM 897 O LEU A 59 -10.840 -6.015 -2.158 1.00 0.00 O ATOM 898 CB LEU A 59 -12.472 -3.260 -3.449 1.00 0.00 C ATOM 899 CG LEU A 59 -11.063 -2.909 -3.926 1.00 0.00 C ATOM 900 CD1 LEU A 59 -10.778 -3.570 -5.257 1.00 0.00 C ATOM 901 CD2 LEU A 59 -10.893 -1.402 -4.028 1.00 0.00 C ATOM 0 H LEU A 59 -14.549 -4.022 -2.381 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.553 -5.375 -3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.174 -3.048 -4.256 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -12.731 -2.602 -2.620 1.00 0.00 H new ATOM 0 HG LEU A 59 -10.347 -3.283 -3.195 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -9.771 -3.311 -5.584 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -10.858 -4.652 -5.150 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.500 -3.224 -5.997 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -9.884 -1.172 -4.369 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.616 -1.002 -4.738 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -11.057 -0.950 -3.050 1.00 0.00 H new ATOM 913 N SER A 60 -11.615 -4.364 -0.843 1.00 0.00 N ATOM 914 CA SER A 60 -10.630 -4.587 0.208 1.00 0.00 C ATOM 915 C SER A 60 -10.782 -5.980 0.821 1.00 0.00 C ATOM 916 O SER A 60 -9.843 -6.520 1.405 1.00 0.00 O ATOM 917 CB SER A 60 -10.781 -3.519 1.287 1.00 0.00 C ATOM 918 OG SER A 60 -10.962 -2.236 0.710 1.00 0.00 O ATOM 0 H SER A 60 -12.283 -3.620 -0.643 1.00 0.00 H new ATOM 0 HA SER A 60 -9.635 -4.521 -0.232 1.00 0.00 H new ATOM 0 HB2 SER A 60 -11.632 -3.759 1.924 1.00 0.00 H new ATOM 0 HB3 SER A 60 -9.897 -3.514 1.925 1.00 0.00 H new ATOM 0 HG SER A 60 -10.175 -2.004 0.174 1.00 0.00 H new ATOM 924 N ALA A 61 -11.966 -6.569 0.655 1.00 0.00 N ATOM 925 CA ALA A 61 -12.259 -7.892 1.200 1.00 0.00 C ATOM 926 C ALA A 61 -11.459 -8.993 0.501 1.00 0.00 C ATOM 927 O ALA A 61 -11.577 -10.166 0.855 1.00 0.00 O ATOM 928 CB ALA A 61 -13.749 -8.188 1.096 1.00 0.00 C ATOM 0 H ALA A 61 -12.741 -6.147 0.144 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.961 -7.882 2.249 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -13.953 -9.177 1.506 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.309 -7.440 1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.054 -8.159 0.050 1.00 0.00 H new ATOM 934 N LYS A 62 -10.662 -8.616 -0.500 1.00 0.00 N ATOM 935 CA LYS A 62 -9.782 -9.562 -1.181 1.00 0.00 C ATOM 936 C LYS A 62 -8.807 -10.200 -0.196 1.00 0.00 C ATOM 937 O LYS A 62 -8.591 -11.409 -0.223 1.00 0.00 O ATOM 938 CB LYS A 62 -9.002 -8.867 -2.302 1.00 0.00 C ATOM 939 CG LYS A 62 -9.825 -8.594 -3.551 1.00 0.00 C ATOM 940 CD LYS A 62 -10.256 -9.889 -4.221 1.00 0.00 C ATOM 941 CE LYS A 62 -11.001 -9.639 -5.524 1.00 0.00 C ATOM 942 NZ LYS A 62 -12.279 -8.910 -5.310 1.00 0.00 N ATOM 0 H LYS A 62 -10.609 -7.662 -0.856 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.406 -10.343 -1.616 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.608 -7.923 -1.925 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.145 -9.485 -2.572 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.705 -8.007 -3.288 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.241 -7.997 -4.251 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.378 -10.504 -4.418 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -10.895 -10.453 -3.541 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -10.366 -9.065 -6.199 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -11.206 -10.592 -6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.800 -8.851 -6.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.855 -9.418 -4.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -12.077 -7.950 -4.963 1.00 0.00 H new ATOM 956 N TYR A 63 -8.233 -9.377 0.677 1.00 0.00 N ATOM 957 CA TYR A 63 -7.277 -9.855 1.670 1.00 0.00 C ATOM 958 C TYR A 63 -7.955 -10.810 2.635 1.00 0.00 C ATOM 959 O TYR A 63 -7.473 -11.916 2.878 1.00 0.00 O ATOM 960 CB TYR A 63 -6.682 -8.679 2.439 1.00 0.00 C ATOM 961 CG TYR A 63 -5.870 -7.755 1.573 1.00 0.00 C ATOM 962 CD1 TYR A 63 -6.455 -6.672 0.929 1.00 0.00 C ATOM 963 CD2 TYR A 63 -4.515 -7.970 1.395 1.00 0.00 C ATOM 964 CE1 TYR A 63 -5.708 -5.834 0.128 1.00 0.00 C ATOM 965 CE2 TYR A 63 -3.761 -7.139 0.600 1.00 0.00 C ATOM 966 CZ TYR A 63 -4.360 -6.070 -0.033 1.00 0.00 C ATOM 967 OH TYR A 63 -3.610 -5.236 -0.831 1.00 0.00 O ATOM 0 H TYR A 63 -8.414 -8.374 0.717 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.476 -10.383 1.153 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.488 -8.114 2.906 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.052 -9.060 3.243 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.511 -6.483 1.058 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -4.041 -8.805 1.889 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.177 -4.998 -0.370 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -2.704 -7.323 0.472 1.00 0.00 H new ATOM 0 HH TYR A 63 -3.994 -4.335 -0.814 1.00 0.00 H new ATOM 977 N LYS A 64 -9.067 -10.351 3.186 1.00 0.00 N ATOM 978 CA LYS A 64 -9.931 -11.170 4.030 1.00 0.00 C ATOM 979 C LYS A 64 -9.282 -11.469 5.372 1.00 0.00 C ATOM 980 O LYS A 64 -9.572 -10.821 6.377 1.00 0.00 O ATOM 981 CB LYS A 64 -10.300 -12.476 3.312 1.00 0.00 C ATOM 982 CG LYS A 64 -11.358 -13.305 4.020 1.00 0.00 C ATOM 983 CD LYS A 64 -11.335 -14.747 3.539 1.00 0.00 C ATOM 984 CE LYS A 64 -12.555 -15.520 4.009 1.00 0.00 C ATOM 985 NZ LYS A 64 -13.767 -15.174 3.221 1.00 0.00 N ATOM 0 H LYS A 64 -9.400 -9.395 3.061 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.841 -10.602 4.221 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -10.654 -12.237 2.309 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -9.400 -13.080 3.197 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.188 -13.275 5.096 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -12.343 -12.874 3.840 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.291 -14.766 2.450 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -10.432 -15.237 3.903 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.361 -16.589 3.926 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -12.735 -15.309 5.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.562 -15.771 3.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -14.006 -14.174 3.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -13.582 -15.335 2.210 1.00 0.00 H new ATOM 999 N ASN A 65 -8.400 -12.444 5.377 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.741 -12.873 6.591 1.00 0.00 C ATOM 1001 C ASN A 65 -6.442 -13.562 6.224 1.00 0.00 C ATOM 1002 O ASN A 65 -6.109 -14.620 6.754 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.653 -13.815 7.394 1.00 0.00 C ATOM 1004 CG ASN A 65 -8.128 -14.106 8.795 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -8.355 -15.186 9.340 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -7.443 -13.140 9.393 1.00 0.00 N ATOM 0 H ASN A 65 -8.120 -12.960 4.543 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.526 -12.008 7.219 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -9.646 -13.372 7.469 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.763 -14.754 6.852 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -7.084 -13.279 10.338 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.275 -12.258 8.908 1.00 0.00 H new ATOM 1013 N ILE A 66 -5.713 -12.955 5.290 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.417 -13.502 4.869 1.00 0.00 C ATOM 1015 C ILE A 66 -3.489 -13.661 6.072 1.00 0.00 C ATOM 1016 O ILE A 66 -2.791 -14.665 6.219 1.00 0.00 O ATOM 1017 CB ILE A 66 -3.697 -12.608 3.837 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -4.553 -12.354 2.605 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -2.387 -13.250 3.418 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -3.859 -11.487 1.578 1.00 0.00 C ATOM 0 H ILE A 66 -5.989 -12.096 4.814 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.634 -14.465 4.408 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.506 -11.648 4.317 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.818 -13.308 2.149 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.485 -11.876 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.886 -12.612 2.690 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.747 -13.375 4.292 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.586 -14.224 2.971 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.517 -11.340 0.722 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.618 -10.521 2.021 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.941 -11.975 1.250 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.506 -12.650 6.927 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.629 -12.580 8.085 1.00 0.00 C ATOM 1034 C ALA A 67 -3.117 -11.477 9.002 1.00 0.00 C ATOM 1035 O ALA A 67 -4.318 -11.207 9.062 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.208 -12.289 7.635 1.00 0.00 C ATOM 0 H ALA A 67 -4.133 -11.850 6.836 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.641 -13.531 8.617 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.554 -12.237 8.506 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.867 -13.083 6.971 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.182 -11.337 7.105 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.190 -10.829 9.697 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.528 -9.633 10.439 1.00 0.00 C ATOM 1044 C GLY A 68 -2.714 -8.454 9.502 1.00 0.00 C ATOM 1045 O GLY A 68 -2.078 -7.412 9.657 1.00 0.00 O ATOM 0 H GLY A 68 -1.212 -11.111 9.759 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.442 -9.799 11.008 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.740 -9.411 11.159 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.573 -8.642 8.508 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.825 -7.636 7.496 1.00 0.00 C ATOM 1051 C VAL A 69 -5.092 -6.863 7.837 1.00 0.00 C ATOM 1052 O VAL A 69 -6.163 -7.447 8.035 1.00 0.00 O ATOM 1053 CB VAL A 69 -3.925 -8.264 6.075 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.578 -8.823 5.648 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.982 -9.356 6.009 1.00 0.00 C ATOM 0 H VAL A 69 -4.113 -9.499 8.385 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.981 -6.946 7.485 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.223 -7.470 5.390 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.664 -9.259 4.653 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -1.840 -8.021 5.631 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.262 -9.591 6.354 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.018 -9.767 5.000 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.731 -10.148 6.715 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.955 -8.937 6.265 1.00 0.00 H new ATOM 1065 N GLU A 70 -4.959 -5.553 7.962 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.097 -4.712 8.275 1.00 0.00 C ATOM 1067 C GLU A 70 -6.373 -3.740 7.136 1.00 0.00 C ATOM 1068 O GLU A 70 -5.534 -2.904 6.788 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.893 -3.962 9.602 1.00 0.00 C ATOM 1070 CG GLU A 70 -4.720 -2.992 9.616 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.641 -2.191 10.900 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -5.573 -1.404 11.182 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -3.644 -2.338 11.638 1.00 0.00 O ATOM 0 H GLU A 70 -4.077 -5.053 7.852 1.00 0.00 H new ATOM 0 HA GLU A 70 -6.968 -5.357 8.395 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -6.804 -3.411 9.835 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -5.751 -4.693 10.398 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.792 -3.548 9.481 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.808 -2.309 8.771 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.534 -3.894 6.529 1.00 0.00 N ATOM 1081 CA GLU A 71 -7.986 -2.977 5.502 1.00 0.00 C ATOM 1082 C GLU A 71 -8.970 -1.994 6.115 1.00 0.00 C ATOM 1083 O GLU A 71 -10.140 -2.325 6.326 1.00 0.00 O ATOM 1084 CB GLU A 71 -8.655 -3.721 4.339 1.00 0.00 C ATOM 1085 CG GLU A 71 -7.759 -4.720 3.618 1.00 0.00 C ATOM 1086 CD GLU A 71 -7.503 -5.979 4.422 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -8.453 -6.774 4.602 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -6.360 -6.176 4.881 1.00 0.00 O ATOM 0 H GLU A 71 -8.185 -4.652 6.732 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.120 -2.448 5.105 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.530 -4.248 4.719 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.013 -2.988 3.616 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -8.218 -4.991 2.667 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.806 -4.244 3.387 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.488 -0.807 6.441 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.318 0.202 7.078 1.00 0.00 C ATOM 1097 C LYS A 72 -9.767 1.247 6.067 1.00 0.00 C ATOM 1098 O LYS A 72 -8.978 2.078 5.622 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.563 0.869 8.229 1.00 0.00 C ATOM 1100 CG LYS A 72 -9.415 1.847 9.012 1.00 0.00 C ATOM 1101 CD LYS A 72 -8.677 2.396 10.217 1.00 0.00 C ATOM 1102 CE LYS A 72 -9.608 3.204 11.104 1.00 0.00 C ATOM 1103 NZ LYS A 72 -10.784 2.402 11.539 1.00 0.00 N ATOM 0 H LYS A 72 -7.524 -0.518 6.275 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.203 -0.291 7.481 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -8.190 0.100 8.905 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.694 1.392 7.830 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.714 2.670 8.363 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.329 1.352 9.340 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -8.246 1.574 10.789 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.849 3.023 9.886 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -9.063 3.556 11.980 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -9.949 4.088 10.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -10.979 2.588 12.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -11.614 2.666 10.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.582 1.390 11.407 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.035 1.192 5.707 1.00 0.00 N ATOM 1118 CA LEU A 73 -11.604 2.117 4.742 1.00 0.00 C ATOM 1119 C LEU A 73 -12.091 3.389 5.427 1.00 0.00 C ATOM 1120 O LEU A 73 -13.019 3.354 6.238 1.00 0.00 O ATOM 1121 CB LEU A 73 -12.758 1.441 4.001 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.342 0.290 3.084 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -13.551 -0.503 2.617 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -11.579 0.826 1.890 1.00 0.00 C ATOM 0 H LEU A 73 -11.698 0.509 6.072 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.829 2.395 4.028 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.471 1.064 4.734 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.279 2.191 3.406 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.696 -0.379 3.652 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.225 -1.315 1.967 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.071 -0.917 3.481 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.226 0.153 2.068 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.287 -0.002 1.243 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.213 1.516 1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -10.687 1.350 2.234 1.00 0.00 H new ATOM 1136 N THR A 74 -11.452 4.503 5.114 1.00 0.00 N ATOM 1137 CA THR A 74 -11.838 5.783 5.676 1.00 0.00 C ATOM 1138 C THR A 74 -12.655 6.585 4.674 1.00 0.00 C ATOM 1139 O THR A 74 -12.181 6.904 3.579 1.00 0.00 O ATOM 1140 CB THR A 74 -10.605 6.597 6.123 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.692 6.750 5.033 1.00 0.00 O ATOM 1142 CG2 THR A 74 -9.894 5.923 7.285 1.00 0.00 C ATOM 0 H THR A 74 -10.661 4.545 4.471 1.00 0.00 H new ATOM 0 HA THR A 74 -12.451 5.583 6.555 1.00 0.00 H new ATOM 0 HB THR A 74 -10.954 7.577 6.449 1.00 0.00 H new ATOM 0 HG1 THR A 74 -10.187 6.992 4.223 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.030 6.519 7.578 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.578 5.836 8.129 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.564 4.929 6.982 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.886 6.891 5.038 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.772 7.637 4.165 1.00 0.00 C ATOM 1152 C TYR A 75 -15.025 9.024 4.721 1.00 0.00 C ATOM 1153 O TYR A 75 -15.802 9.190 5.663 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.102 6.901 3.976 1.00 0.00 C ATOM 1155 CG TYR A 75 -15.962 5.552 3.310 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -15.751 4.403 4.059 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.033 5.432 1.928 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -15.612 3.172 3.451 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -15.897 4.204 1.313 1.00 0.00 C ATOM 1160 CZ TYR A 75 -15.685 3.078 2.078 1.00 0.00 C ATOM 1161 OH TYR A 75 -15.546 1.856 1.467 1.00 0.00 O ATOM 0 H TYR A 75 -14.296 6.633 5.936 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.285 7.728 3.194 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.575 6.768 4.949 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.769 7.523 3.380 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.695 4.473 5.135 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.197 6.313 1.325 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.447 2.287 4.048 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -15.956 4.126 0.237 1.00 0.00 H new ATOM 0 HH TYR A 75 -14.701 1.832 0.971 1.00 0.00 H new ATOM 1171 N THR A 76 -14.355 10.015 4.159 1.00 0.00 N ATOM 1172 CA THR A 76 -14.590 11.389 4.547 1.00 0.00 C ATOM 1173 C THR A 76 -15.876 11.882 3.909 1.00 0.00 C ATOM 1174 O THR A 76 -16.872 12.116 4.593 1.00 0.00 O ATOM 1175 CB THR A 76 -13.416 12.296 4.133 1.00 0.00 C ATOM 1176 OG1 THR A 76 -12.182 11.730 4.588 1.00 0.00 O ATOM 1177 CG2 THR A 76 -13.573 13.697 4.706 1.00 0.00 C ATOM 0 H THR A 76 -13.647 9.892 3.435 1.00 0.00 H new ATOM 0 HA THR A 76 -14.678 11.430 5.633 1.00 0.00 H new ATOM 0 HB THR A 76 -13.412 12.368 3.045 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.479 11.906 3.928 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.729 14.313 4.396 1.00 0.00 H new ATOM 0 HG22 THR A 76 -14.499 14.139 4.338 1.00 0.00 H new ATOM 0 HG23 THR A 76 -13.603 13.644 5.794 1.00 0.00 H new ATOM 1185 N ASP A 77 -15.840 11.986 2.588 1.00 0.00 N ATOM 1186 CA ASP A 77 -17.001 12.384 1.791 1.00 0.00 C ATOM 1187 C ASP A 77 -16.622 12.480 0.321 1.00 0.00 C ATOM 1188 O ASP A 77 -17.279 11.906 -0.540 1.00 0.00 O ATOM 1189 CB ASP A 77 -17.569 13.729 2.254 1.00 0.00 C ATOM 1190 CG ASP A 77 -18.858 14.083 1.538 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -19.898 13.458 1.837 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -18.844 14.990 0.684 1.00 0.00 O ATOM 0 H ASP A 77 -15.005 11.797 2.034 1.00 0.00 H new ATOM 0 HA ASP A 77 -17.767 11.621 1.927 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -17.750 13.695 3.328 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.831 14.512 2.080 1.00 0.00 H new ATOM 1197 N THR A 78 -15.543 13.201 0.046 1.00 0.00 N ATOM 1198 CA THR A 78 -15.100 13.432 -1.322 1.00 0.00 C ATOM 1199 C THR A 78 -14.126 12.356 -1.800 1.00 0.00 C ATOM 1200 O THR A 78 -13.863 12.232 -2.999 1.00 0.00 O ATOM 1201 CB THR A 78 -14.431 14.810 -1.434 1.00 0.00 C ATOM 1202 OG1 THR A 78 -13.499 14.978 -0.356 1.00 0.00 O ATOM 1203 CG2 THR A 78 -15.468 15.922 -1.401 1.00 0.00 C ATOM 0 H THR A 78 -14.956 13.638 0.757 1.00 0.00 H new ATOM 0 HA THR A 78 -15.984 13.392 -1.958 1.00 0.00 H new ATOM 0 HB THR A 78 -13.904 14.865 -2.387 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.071 15.856 -0.428 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.969 16.888 -1.482 1.00 0.00 H new ATOM 0 HG22 THR A 78 -16.159 15.800 -2.235 1.00 0.00 H new ATOM 0 HG23 THR A 78 -16.020 15.877 -0.462 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.588 11.584 -0.863 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.639 10.532 -1.195 1.00 0.00 C ATOM 1213 C TYR A 79 -12.732 9.400 -0.180 1.00 0.00 C ATOM 1214 O TYR A 79 -13.214 9.596 0.940 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.204 11.088 -1.238 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.614 11.387 0.125 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -10.997 12.511 0.845 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -9.672 10.536 0.693 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -10.463 12.776 2.092 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -9.134 10.795 1.936 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.532 11.913 2.633 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.001 12.168 3.877 1.00 0.00 O ATOM 0 H TYR A 79 -13.794 11.668 0.132 1.00 0.00 H new ATOM 0 HA TYR A 79 -12.888 10.144 -2.182 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.563 10.370 -1.750 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.198 12.001 -1.833 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -11.724 13.189 0.424 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -9.356 9.657 0.151 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -10.773 13.654 2.640 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -8.403 10.123 2.361 1.00 0.00 H new ATOM 0 HH TYR A 79 -8.362 11.463 4.111 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.283 8.223 -0.585 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.242 7.062 0.289 1.00 0.00 C ATOM 1234 C ALA A 80 -10.841 6.470 0.284 1.00 0.00 C ATOM 1235 O ALA A 80 -10.278 6.212 -0.778 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.260 6.029 -0.160 1.00 0.00 C ATOM 0 H ALA A 80 -11.937 8.046 -1.528 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.493 7.368 1.305 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.218 5.165 0.503 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.259 6.464 -0.127 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.035 5.715 -1.179 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.271 6.270 1.457 1.00 0.00 N ATOM 1243 CA GLN A 81 -8.896 5.807 1.551 1.00 0.00 C ATOM 1244 C GLN A 81 -8.823 4.405 2.138 1.00 0.00 C ATOM 1245 O GLN A 81 -9.343 4.150 3.227 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.077 6.779 2.404 1.00 0.00 C ATOM 1247 CG GLN A 81 -6.582 6.505 2.393 1.00 0.00 C ATOM 1248 CD GLN A 81 -5.800 7.537 3.184 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -6.209 8.693 3.290 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -4.670 7.132 3.740 1.00 0.00 N ATOM 0 H GLN A 81 -10.733 6.419 2.354 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.480 5.770 0.544 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.252 7.794 2.048 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -8.436 6.735 3.432 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -6.394 5.514 2.807 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -6.225 6.493 1.363 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -4.365 6.165 3.629 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -4.104 7.787 4.280 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.193 3.497 1.406 1.00 0.00 N ATOM 1260 CA GLU A 82 -7.934 2.160 1.909 1.00 0.00 C ATOM 1261 C GLU A 82 -6.663 2.165 2.741 1.00 0.00 C ATOM 1262 O GLU A 82 -5.569 2.036 2.199 1.00 0.00 O ATOM 1263 CB GLU A 82 -7.763 1.146 0.770 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.898 1.100 -0.236 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.712 -0.018 -1.246 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -9.088 -1.174 -0.940 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -8.167 0.248 -2.340 1.00 0.00 O ATOM 0 H GLU A 82 -7.852 3.665 0.460 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.793 1.866 2.513 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.839 1.374 0.239 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.645 0.153 1.205 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -9.843 0.962 0.289 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -8.960 2.055 -0.758 1.00 0.00 H new ATOM 1274 N ASN A 83 -6.795 2.353 4.041 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.646 2.263 4.930 1.00 0.00 C ATOM 1276 C ASN A 83 -5.363 0.796 5.216 1.00 0.00 C ATOM 1277 O ASN A 83 -5.932 0.204 6.132 1.00 0.00 O ATOM 1278 CB ASN A 83 -5.889 3.043 6.233 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.777 2.866 7.262 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -4.839 1.982 8.117 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -3.756 3.708 7.196 1.00 0.00 N ATOM 0 H ASN A 83 -7.678 2.567 4.504 1.00 0.00 H new ATOM 0 HA ASN A 83 -4.779 2.713 4.447 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.992 4.103 5.999 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.833 2.720 6.671 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -2.991 3.635 7.866 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.736 4.429 6.475 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.532 0.195 4.385 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.260 -1.232 4.491 1.00 0.00 C ATOM 1290 C VAL A 84 -2.906 -1.462 5.146 1.00 0.00 C ATOM 1291 O VAL A 84 -1.961 -0.727 4.895 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.290 -1.919 3.104 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.142 -3.428 3.237 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.569 -1.572 2.353 1.00 0.00 C ATOM 0 H VAL A 84 -4.034 0.668 3.631 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.043 -1.673 5.108 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.443 -1.544 2.530 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -4.167 -3.885 2.248 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.193 -3.659 3.720 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.961 -3.822 3.839 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.566 -2.067 1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.431 -1.908 2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.626 -0.493 2.210 1.00 0.00 H new ATOM 1304 N THR A 85 -2.819 -2.458 6.009 1.00 0.00 N ATOM 1305 CA THR A 85 -1.552 -2.819 6.619 1.00 0.00 C ATOM 1306 C THR A 85 -1.319 -4.316 6.490 1.00 0.00 C ATOM 1307 O THR A 85 -1.961 -5.117 7.169 1.00 0.00 O ATOM 1308 CB THR A 85 -1.492 -2.399 8.101 1.00 0.00 C ATOM 1309 OG1 THR A 85 -1.733 -0.988 8.212 1.00 0.00 O ATOM 1310 CG2 THR A 85 -0.136 -2.735 8.708 1.00 0.00 C ATOM 0 H THR A 85 -3.610 -3.031 6.303 1.00 0.00 H new ATOM 0 HA THR A 85 -0.764 -2.282 6.091 1.00 0.00 H new ATOM 0 HB THR A 85 -2.259 -2.949 8.646 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.696 -0.723 9.155 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.120 -2.429 9.754 1.00 0.00 H new ATOM 0 HG22 THR A 85 0.036 -3.809 8.642 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.647 -2.208 8.163 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.422 -4.682 5.589 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.114 -6.077 5.330 1.00 0.00 C ATOM 1320 C ILE A 86 1.101 -6.508 6.141 1.00 0.00 C ATOM 1321 O ILE A 86 2.213 -6.042 5.897 1.00 0.00 O ATOM 1322 CB ILE A 86 0.173 -6.311 3.831 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.976 -5.766 2.979 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.384 -7.794 3.553 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.705 -5.814 1.491 1.00 0.00 C ATOM 0 H ILE A 86 0.110 -4.024 5.020 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.981 -6.669 5.622 1.00 0.00 H new ATOM 0 HB ILE A 86 1.086 -5.778 3.566 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.879 -6.338 3.194 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.175 -4.735 3.270 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.585 -7.940 2.492 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.231 -8.157 4.136 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.512 -8.348 3.832 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.563 -5.412 0.952 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.179 -5.218 1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.536 -6.846 1.185 1.00 0.00 H new ATOM 1337 N ASP A 87 0.888 -7.377 7.117 1.00 0.00 N ATOM 1338 CA ASP A 87 1.992 -7.894 7.916 1.00 0.00 C ATOM 1339 C ASP A 87 2.667 -9.041 7.180 1.00 0.00 C ATOM 1340 O ASP A 87 2.049 -10.075 6.923 1.00 0.00 O ATOM 1341 CB ASP A 87 1.513 -8.364 9.287 1.00 0.00 C ATOM 1342 CG ASP A 87 2.672 -8.749 10.183 1.00 0.00 C ATOM 1343 OD1 ASP A 87 3.219 -7.857 10.864 1.00 0.00 O ATOM 1344 OD2 ASP A 87 3.042 -9.936 10.209 1.00 0.00 O ATOM 0 H ASP A 87 -0.031 -7.738 7.375 1.00 0.00 H new ATOM 0 HA ASP A 87 2.708 -7.087 8.069 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.934 -7.572 9.761 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.847 -9.218 9.167 1.00 0.00 H new ATOM 1349 N MET A 88 3.936 -8.855 6.855 1.00 0.00 N ATOM 1350 CA MET A 88 4.666 -9.807 6.028 1.00 0.00 C ATOM 1351 C MET A 88 5.295 -10.914 6.864 1.00 0.00 C ATOM 1352 O MET A 88 5.898 -11.839 6.320 1.00 0.00 O ATOM 1353 CB MET A 88 5.752 -9.092 5.222 1.00 0.00 C ATOM 1354 CG MET A 88 5.217 -8.097 4.203 1.00 0.00 C ATOM 1355 SD MET A 88 4.222 -8.879 2.917 1.00 0.00 S ATOM 1356 CE MET A 88 3.873 -7.479 1.855 1.00 0.00 C ATOM 0 H MET A 88 4.486 -8.049 7.152 1.00 0.00 H new ATOM 0 HA MET A 88 3.947 -10.262 5.347 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.415 -8.569 5.911 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.355 -9.838 4.704 1.00 0.00 H new ATOM 0 HG2 MET A 88 4.615 -7.347 4.716 1.00 0.00 H new ATOM 0 HG3 MET A 88 6.053 -7.573 3.740 1.00 0.00 H new ATOM 0 HE1 MET A 88 3.453 -7.832 0.913 1.00 0.00 H new ATOM 0 HE2 MET A 88 3.158 -6.819 2.346 1.00 0.00 H new ATOM 0 HE3 MET A 88 4.795 -6.933 1.658 1.00 0.00 H new ATOM 1366 N GLU A 89 5.152 -10.832 8.181 1.00 0.00 N ATOM 1367 CA GLU A 89 5.697 -11.861 9.057 1.00 0.00 C ATOM 1368 C GLU A 89 4.730 -13.026 9.144 1.00 0.00 C ATOM 1369 O GLU A 89 5.099 -14.133 9.538 1.00 0.00 O ATOM 1370 CB GLU A 89 5.954 -11.321 10.465 1.00 0.00 C ATOM 1371 CG GLU A 89 7.018 -10.241 10.544 1.00 0.00 C ATOM 1372 CD GLU A 89 7.329 -9.860 11.977 1.00 0.00 C ATOM 1373 OE1 GLU A 89 6.639 -8.979 12.528 1.00 0.00 O ATOM 1374 OE2 GLU A 89 8.252 -10.456 12.570 1.00 0.00 O ATOM 0 H GLU A 89 4.669 -10.073 8.662 1.00 0.00 H new ATOM 0 HA GLU A 89 6.646 -12.188 8.633 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.021 -10.923 10.863 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.248 -12.150 11.110 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.928 -10.591 10.055 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.682 -9.359 9.998 1.00 0.00 H new ATOM 1381 N LYS A 90 3.483 -12.767 8.788 1.00 0.00 N ATOM 1382 CA LYS A 90 2.445 -13.772 8.912 1.00 0.00 C ATOM 1383 C LYS A 90 1.692 -13.953 7.600 1.00 0.00 C ATOM 1384 O LYS A 90 0.787 -14.783 7.515 1.00 0.00 O ATOM 1385 CB LYS A 90 1.458 -13.369 10.013 1.00 0.00 C ATOM 1386 CG LYS A 90 2.120 -12.720 11.219 1.00 0.00 C ATOM 1387 CD LYS A 90 1.142 -12.521 12.365 1.00 0.00 C ATOM 1388 CE LYS A 90 0.914 -13.818 13.119 1.00 0.00 C ATOM 1389 NZ LYS A 90 2.187 -14.378 13.644 1.00 0.00 N ATOM 0 H LYS A 90 3.167 -11.873 8.412 1.00 0.00 H new ATOM 0 HA LYS A 90 2.922 -14.718 9.170 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.725 -12.678 9.597 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.912 -14.254 10.341 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.951 -13.341 11.555 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.539 -11.757 10.928 1.00 0.00 H new ATOM 0 HD2 LYS A 90 1.526 -11.763 13.047 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.193 -12.150 11.977 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.225 -13.643 13.945 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.441 -14.545 12.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.056 -14.670 14.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.465 -15.202 13.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.932 -13.654 13.593 1.00 0.00 H new ATOM 1403 N VAL A 91 2.056 -13.177 6.581 1.00 0.00 N ATOM 1404 CA VAL A 91 1.303 -13.175 5.333 1.00 0.00 C ATOM 1405 C VAL A 91 1.525 -14.462 4.547 1.00 0.00 C ATOM 1406 O VAL A 91 2.646 -14.956 4.416 1.00 0.00 O ATOM 1407 CB VAL A 91 1.629 -11.946 4.442 1.00 0.00 C ATOM 1408 CG1 VAL A 91 3.014 -12.040 3.844 1.00 0.00 C ATOM 1409 CG2 VAL A 91 0.604 -11.790 3.335 1.00 0.00 C ATOM 0 H VAL A 91 2.859 -12.549 6.596 1.00 0.00 H new ATOM 0 HA VAL A 91 0.252 -13.110 5.614 1.00 0.00 H new ATOM 0 HB VAL A 91 1.593 -11.068 5.087 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.204 -11.162 3.227 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.753 -12.089 4.644 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.085 -12.937 3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.856 -10.922 2.726 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.604 -12.684 2.711 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.385 -11.652 3.772 1.00 0.00 H new ATOM 1419 N ASP A 92 0.430 -15.012 4.060 1.00 0.00 N ATOM 1420 CA ASP A 92 0.467 -16.195 3.225 1.00 0.00 C ATOM 1421 C ASP A 92 0.552 -15.802 1.755 1.00 0.00 C ATOM 1422 O ASP A 92 -0.343 -15.140 1.224 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.771 -17.055 3.478 1.00 0.00 C ATOM 1424 CG ASP A 92 -0.909 -18.174 2.474 1.00 0.00 C ATOM 1425 OD1 ASP A 92 0.021 -19.000 2.367 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -1.944 -18.218 1.776 1.00 0.00 O ATOM 0 H ASP A 92 -0.509 -14.652 4.232 1.00 0.00 H new ATOM 0 HA ASP A 92 1.353 -16.777 3.478 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.719 -17.476 4.482 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.661 -16.426 3.442 1.00 0.00 H new ATOM 1431 N PHE A 93 1.629 -16.216 1.103 1.00 0.00 N ATOM 1432 CA PHE A 93 1.863 -15.867 -0.291 1.00 0.00 C ATOM 1433 C PHE A 93 1.088 -16.795 -1.220 1.00 0.00 C ATOM 1434 O PHE A 93 1.060 -16.593 -2.434 1.00 0.00 O ATOM 1435 CB PHE A 93 3.356 -15.920 -0.623 1.00 0.00 C ATOM 1436 CG PHE A 93 4.187 -14.896 0.098 1.00 0.00 C ATOM 1437 CD1 PHE A 93 4.701 -15.159 1.357 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.458 -13.670 -0.489 1.00 0.00 C ATOM 1439 CE1 PHE A 93 5.472 -14.220 2.017 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.227 -12.727 0.165 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.732 -13.000 1.421 1.00 0.00 C ATOM 0 H PHE A 93 2.357 -16.796 1.519 1.00 0.00 H new ATOM 0 HA PHE A 93 1.509 -14.847 -0.443 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.735 -16.913 -0.382 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.483 -15.783 -1.697 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.497 -16.109 1.829 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.063 -13.449 -1.470 1.00 0.00 H new ATOM 0 HE1 PHE A 93 5.870 -14.439 2.997 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.433 -11.777 -0.306 1.00 0.00 H new ATOM 0 HZ PHE A 93 6.329 -12.262 1.937 1.00 0.00 H new ATOM 1451 N LYS A 94 0.461 -17.815 -0.646 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.399 -18.705 -1.413 1.00 0.00 C ATOM 1453 C LYS A 94 -1.661 -17.953 -1.822 1.00 0.00 C ATOM 1454 O LYS A 94 -2.142 -18.081 -2.949 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.751 -19.947 -0.588 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.619 -20.954 -1.324 1.00 0.00 C ATOM 1457 CD LYS A 94 -1.970 -22.132 -0.431 1.00 0.00 C ATOM 1458 CE LYS A 94 -2.793 -23.172 -1.174 1.00 0.00 C ATOM 1459 NZ LYS A 94 -2.037 -23.771 -2.303 1.00 0.00 N ATOM 0 H LYS A 94 0.532 -18.045 0.345 1.00 0.00 H new ATOM 0 HA LYS A 94 0.126 -19.035 -2.309 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.172 -20.437 -0.277 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.267 -19.633 0.320 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.533 -20.469 -1.667 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.095 -21.310 -2.211 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.055 -22.591 -0.057 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.527 -21.778 0.437 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.096 -23.958 -0.482 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -3.706 -22.711 -1.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.527 -24.627 -2.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.975 -23.085 -3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.079 -24.021 -1.985 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.188 -17.157 -0.897 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.300 -16.264 -1.198 1.00 0.00 C ATOM 1475 C ALA A 95 -2.836 -15.142 -2.123 1.00 0.00 C ATOM 1476 O ALA A 95 -3.584 -14.672 -2.983 1.00 0.00 O ATOM 1477 CB ALA A 95 -3.885 -15.688 0.086 1.00 0.00 C ATOM 0 H ALA A 95 -1.862 -17.113 0.068 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.079 -16.835 -1.703 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.714 -15.024 -0.158 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.244 -16.500 0.718 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.115 -15.128 0.617 1.00 0.00 H new ATOM 1483 N LEU A 96 -1.577 -14.742 -1.957 1.00 0.00 N ATOM 1484 CA LEU A 96 -0.984 -13.687 -2.776 1.00 0.00 C ATOM 1485 C LEU A 96 -0.697 -14.182 -4.195 1.00 0.00 C ATOM 1486 O LEU A 96 -0.163 -13.451 -5.032 1.00 0.00 O ATOM 1487 CB LEU A 96 0.293 -13.143 -2.129 1.00 0.00 C ATOM 1488 CG LEU A 96 0.087 -12.404 -0.804 1.00 0.00 C ATOM 1489 CD1 LEU A 96 1.396 -11.796 -0.322 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -0.976 -11.327 -0.949 1.00 0.00 C ATOM 0 H LEU A 96 -0.945 -15.135 -1.259 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.708 -12.875 -2.841 1.00 0.00 H new ATOM 0 HB2 LEU A 96 0.979 -13.974 -1.961 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.778 -12.467 -2.833 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.254 -13.125 -0.061 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.230 -11.275 0.621 1.00 0.00 H new ATOM 0 HD12 LEU A 96 2.132 -12.586 -0.175 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.765 -11.090 -1.066 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.107 -10.814 0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.665 -10.609 -1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -1.919 -11.785 -1.247 1.00 0.00 H new ATOM 1502 N GLN A 97 -1.036 -15.437 -4.462 1.00 0.00 N ATOM 1503 CA GLN A 97 -0.975 -15.962 -5.813 1.00 0.00 C ATOM 1504 C GLN A 97 -2.021 -15.270 -6.687 1.00 0.00 C ATOM 1505 O GLN A 97 -1.845 -15.140 -7.897 1.00 0.00 O ATOM 1506 CB GLN A 97 -1.199 -17.476 -5.816 1.00 0.00 C ATOM 1507 CG GLN A 97 -1.122 -18.104 -7.200 1.00 0.00 C ATOM 1508 CD GLN A 97 -1.419 -19.589 -7.195 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -0.908 -20.337 -8.027 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -2.247 -20.030 -6.258 1.00 0.00 N ATOM 0 H GLN A 97 -1.355 -16.106 -3.761 1.00 0.00 H new ATOM 0 HA GLN A 97 0.017 -15.764 -6.219 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -0.455 -17.945 -5.172 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -2.176 -17.690 -5.383 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -1.828 -17.600 -7.861 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -0.126 -17.940 -7.612 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.650 -19.378 -5.586 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -2.481 -21.022 -6.209 1.00 0.00 H new ATOM 1519 N GLY A 98 -3.101 -14.811 -6.059 1.00 0.00 N ATOM 1520 CA GLY A 98 -4.148 -14.122 -6.791 1.00 0.00 C ATOM 1521 C GLY A 98 -4.297 -12.672 -6.370 1.00 0.00 C ATOM 1522 O GLY A 98 -5.027 -11.905 -7.002 1.00 0.00 O ATOM 0 H GLY A 98 -3.269 -14.904 -5.057 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -3.930 -14.166 -7.858 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -5.095 -14.640 -6.638 1.00 0.00 H new ATOM 1526 N ILE A 99 -3.605 -12.294 -5.301 1.00 0.00 N ATOM 1527 CA ILE A 99 -3.677 -10.936 -4.770 1.00 0.00 C ATOM 1528 C ILE A 99 -2.272 -10.363 -4.648 1.00 0.00 C ATOM 1529 O ILE A 99 -1.339 -11.086 -4.318 1.00 0.00 O ATOM 1530 CB ILE A 99 -4.340 -10.911 -3.373 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -5.567 -11.822 -3.350 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -4.731 -9.486 -2.995 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -6.127 -12.047 -1.965 1.00 0.00 C ATOM 0 H ILE A 99 -2.983 -12.913 -4.781 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.279 -10.341 -5.456 1.00 0.00 H new ATOM 0 HB ILE A 99 -3.620 -11.279 -2.642 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.343 -11.388 -3.981 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.303 -12.785 -3.787 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.196 -9.486 -2.009 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -3.841 -8.857 -2.976 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -5.436 -9.095 -3.729 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.996 -12.703 -2.026 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -5.367 -12.510 -1.336 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -6.423 -11.091 -1.533 1.00 0.00 H new ATOM 1648 N ASP A 108 7.017 -11.056 -8.803 1.00 0.00 N ATOM 1649 CA ASP A 108 7.871 -10.577 -7.726 1.00 0.00 C ATOM 1650 C ASP A 108 7.234 -10.860 -6.372 1.00 0.00 C ATOM 1651 O ASP A 108 7.927 -11.075 -5.381 1.00 0.00 O ATOM 1652 CB ASP A 108 8.159 -9.080 -7.900 1.00 0.00 C ATOM 1653 CG ASP A 108 9.454 -8.826 -8.655 1.00 0.00 C ATOM 1654 OD1 ASP A 108 9.462 -8.962 -9.893 1.00 0.00 O ATOM 1655 OD2 ASP A 108 10.479 -8.511 -8.013 1.00 0.00 O ATOM 0 HA ASP A 108 8.820 -11.112 -7.768 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.332 -8.613 -8.434 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.213 -8.606 -6.920 1.00 0.00 H new ATOM 1660 N ALA A 109 5.909 -10.905 -6.349 1.00 0.00 N ATOM 1661 CA ALA A 109 5.179 -11.204 -5.126 1.00 0.00 C ATOM 1662 C ALA A 109 5.020 -12.711 -4.931 1.00 0.00 C ATOM 1663 O ALA A 109 4.498 -13.160 -3.916 1.00 0.00 O ATOM 1664 CB ALA A 109 3.817 -10.532 -5.141 1.00 0.00 C ATOM 0 H ALA A 109 5.318 -10.738 -7.164 1.00 0.00 H new ATOM 0 HA ALA A 109 5.757 -10.812 -4.289 1.00 0.00 H new ATOM 0 HB1 ALA A 109 3.285 -10.767 -4.219 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.945 -9.453 -5.222 1.00 0.00 H new ATOM 0 HB3 ALA A 109 3.242 -10.894 -5.993 1.00 0.00 H new ATOM 1670 N LYS A 110 5.471 -13.485 -5.910 1.00 0.00 N ATOM 1671 CA LYS A 110 5.359 -14.939 -5.850 1.00 0.00 C ATOM 1672 C LYS A 110 6.625 -15.547 -5.253 1.00 0.00 C ATOM 1673 O LYS A 110 6.565 -16.471 -4.444 1.00 0.00 O ATOM 1674 CB LYS A 110 5.122 -15.510 -7.251 1.00 0.00 C ATOM 1675 CG LYS A 110 3.900 -14.934 -7.952 1.00 0.00 C ATOM 1676 CD LYS A 110 2.609 -15.331 -7.256 1.00 0.00 C ATOM 1677 CE LYS A 110 1.395 -14.720 -7.940 1.00 0.00 C ATOM 1678 NZ LYS A 110 1.324 -13.247 -7.749 1.00 0.00 N ATOM 0 H LYS A 110 5.918 -13.131 -6.756 1.00 0.00 H new ATOM 0 HA LYS A 110 4.512 -15.193 -5.213 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.003 -15.321 -7.864 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.011 -16.592 -7.178 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.977 -13.847 -7.982 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.877 -15.280 -8.985 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.517 -16.417 -7.251 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.642 -15.009 -6.215 1.00 0.00 H new ATOM 0 HE2 LYS A 110 1.429 -14.945 -9.006 1.00 0.00 H new ATOM 0 HE3 LYS A 110 0.489 -15.180 -7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 0.464 -12.879 -8.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 1.299 -13.030 -6.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 2.160 -12.801 -8.178 1.00 0.00 H new ATOM 1692 N LYS A 111 7.769 -15.016 -5.664 1.00 0.00 N ATOM 1693 CA LYS A 111 9.059 -15.499 -5.183 1.00 0.00 C ATOM 1694 C LYS A 111 9.278 -15.106 -3.723 1.00 0.00 C ATOM 1695 O LYS A 111 9.897 -15.845 -2.956 1.00 0.00 O ATOM 1696 CB LYS A 111 10.186 -14.932 -6.054 1.00 0.00 C ATOM 1697 CG LYS A 111 10.193 -13.413 -6.098 1.00 0.00 C ATOM 1698 CD LYS A 111 11.262 -12.860 -7.024 1.00 0.00 C ATOM 1699 CE LYS A 111 11.178 -11.346 -7.079 1.00 0.00 C ATOM 1700 NZ LYS A 111 12.127 -10.755 -8.058 1.00 0.00 N ATOM 0 H LYS A 111 7.831 -14.248 -6.332 1.00 0.00 H new ATOM 0 HA LYS A 111 9.065 -16.587 -5.249 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.145 -15.284 -5.673 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.085 -15.319 -7.068 1.00 0.00 H new ATOM 0 HG2 LYS A 111 9.216 -13.058 -6.425 1.00 0.00 H new ATOM 0 HG3 LYS A 111 10.353 -13.025 -5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.249 -13.164 -6.674 1.00 0.00 H new ATOM 0 HD3 LYS A 111 11.137 -13.275 -8.024 1.00 0.00 H new ATOM 0 HE2 LYS A 111 10.162 -11.052 -7.341 1.00 0.00 H new ATOM 0 HE3 LYS A 111 11.383 -10.938 -6.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.814 -9.795 -8.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 13.077 -10.710 -7.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 12.155 -11.345 -8.914 1.00 0.00 H new ATOM 1714 N GLY A 112 8.764 -13.940 -3.352 1.00 0.00 N ATOM 1715 CA GLY A 112 8.947 -13.436 -2.008 1.00 0.00 C ATOM 1716 C GLY A 112 9.285 -11.962 -2.010 1.00 0.00 C ATOM 1717 O GLY A 112 10.029 -11.488 -2.872 1.00 0.00 O ATOM 0 H GLY A 112 8.220 -13.332 -3.964 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.038 -13.601 -1.429 1.00 0.00 H new ATOM 0 HA3 GLY A 112 9.744 -13.992 -1.515 1.00 0.00 H new ATOM 1721 N ILE A 113 8.740 -11.228 -1.056 1.00 0.00 N ATOM 1722 CA ILE A 113 8.943 -9.789 -1.003 1.00 0.00 C ATOM 1723 C ILE A 113 9.944 -9.405 0.081 1.00 0.00 C ATOM 1724 O ILE A 113 9.748 -9.696 1.260 1.00 0.00 O ATOM 1725 CB ILE A 113 7.613 -9.040 -0.764 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.682 -9.196 -1.978 1.00 0.00 C ATOM 1727 CG2 ILE A 113 7.867 -7.567 -0.457 1.00 0.00 C ATOM 1728 CD1 ILE A 113 7.275 -8.700 -3.286 1.00 0.00 C ATOM 0 H ILE A 113 8.155 -11.602 -0.309 1.00 0.00 H new ATOM 0 HA ILE A 113 9.345 -9.493 -1.972 1.00 0.00 H new ATOM 0 HB ILE A 113 7.121 -9.482 0.102 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.419 -10.248 -2.087 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.756 -8.655 -1.784 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.916 -7.060 -0.292 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.483 -7.483 0.439 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.384 -7.104 -1.298 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.555 -8.846 -4.091 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.512 -7.640 -3.199 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.185 -9.258 -3.508 1.00 0.00 H new ATOM 1740 N THR A 114 11.022 -8.766 -0.341 1.00 0.00 N ATOM 1741 CA THR A 114 11.996 -8.210 0.580 1.00 0.00 C ATOM 1742 C THR A 114 12.230 -6.750 0.211 1.00 0.00 C ATOM 1743 O THR A 114 11.597 -6.236 -0.717 1.00 0.00 O ATOM 1744 CB THR A 114 13.336 -8.977 0.552 1.00 0.00 C ATOM 1745 OG1 THR A 114 13.914 -8.929 -0.757 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.145 -10.429 0.968 1.00 0.00 C ATOM 0 H THR A 114 11.245 -8.619 -1.325 1.00 0.00 H new ATOM 0 HA THR A 114 11.600 -8.298 1.592 1.00 0.00 H new ATOM 0 HB THR A 114 14.008 -8.494 1.262 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.763 -9.418 -0.758 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.105 -10.945 0.939 1.00 0.00 H new ATOM 0 HG22 THR A 114 12.743 -10.468 1.980 1.00 0.00 H new ATOM 0 HG23 THR A 114 12.451 -10.915 0.283 1.00 0.00 H new ATOM 1754 N MET A 115 13.131 -6.082 0.912 1.00 0.00 N ATOM 1755 CA MET A 115 13.382 -4.678 0.640 1.00 0.00 C ATOM 1756 C MET A 115 14.243 -4.531 -0.608 1.00 0.00 C ATOM 1757 O MET A 115 14.246 -3.480 -1.245 1.00 0.00 O ATOM 1758 CB MET A 115 14.044 -3.989 1.834 1.00 0.00 C ATOM 1759 CG MET A 115 13.999 -2.473 1.740 1.00 0.00 C ATOM 1760 SD MET A 115 12.311 -1.848 1.596 1.00 0.00 S ATOM 1761 CE MET A 115 12.604 -0.099 1.342 1.00 0.00 C ATOM 0 H MET A 115 13.693 -6.482 1.663 1.00 0.00 H new ATOM 0 HA MET A 115 12.423 -4.190 0.467 1.00 0.00 H new ATOM 0 HB2 MET A 115 13.548 -4.306 2.751 1.00 0.00 H new ATOM 0 HB3 MET A 115 15.082 -4.313 1.905 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.470 -2.042 2.623 1.00 0.00 H new ATOM 0 HG3 MET A 115 14.580 -2.147 0.877 1.00 0.00 H new ATOM 0 HE1 MET A 115 11.902 0.479 1.943 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.624 0.146 1.639 1.00 0.00 H new ATOM 0 HE3 MET A 115 12.465 0.144 0.289 1.00 0.00 H new ATOM 1771 N ALA A 116 14.975 -5.585 -0.952 1.00 0.00 N ATOM 1772 CA ALA A 116 15.743 -5.609 -2.189 1.00 0.00 C ATOM 1773 C ALA A 116 14.825 -5.371 -3.384 1.00 0.00 C ATOM 1774 O ALA A 116 15.071 -4.472 -4.198 1.00 0.00 O ATOM 1775 CB ALA A 116 16.477 -6.934 -2.334 1.00 0.00 C ATOM 0 H ALA A 116 15.052 -6.433 -0.391 1.00 0.00 H new ATOM 0 HA ALA A 116 16.483 -4.810 -2.156 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.046 -6.935 -3.264 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.157 -7.067 -1.492 1.00 0.00 H new ATOM 0 HB3 ALA A 116 15.755 -7.750 -2.350 1.00 0.00 H new ATOM 1781 N GLN A 117 13.762 -6.175 -3.468 1.00 0.00 N ATOM 1782 CA GLN A 117 12.734 -5.989 -4.484 1.00 0.00 C ATOM 1783 C GLN A 117 12.176 -4.584 -4.396 1.00 0.00 C ATOM 1784 O GLN A 117 12.393 -3.789 -5.286 1.00 0.00 O ATOM 1785 CB GLN A 117 11.598 -7.012 -4.333 1.00 0.00 C ATOM 1786 CG GLN A 117 11.935 -8.400 -4.864 1.00 0.00 C ATOM 1787 CD GLN A 117 12.928 -9.146 -3.995 1.00 0.00 C ATOM 1788 OE1 GLN A 117 14.138 -9.022 -4.170 1.00 0.00 O ATOM 1789 NE2 GLN A 117 12.423 -9.952 -3.076 1.00 0.00 N ATOM 0 H GLN A 117 13.594 -6.962 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 117 13.194 -6.142 -5.460 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.334 -7.093 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.716 -6.639 -4.855 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.018 -8.985 -4.942 1.00 0.00 H new ATOM 0 HG3 GLN A 117 12.341 -8.308 -5.872 1.00 0.00 H new ATOM 0 HE21 GLN A 117 11.412 -10.026 -2.963 1.00 0.00 H new ATOM 0 HE22 GLN A 117 13.045 -10.499 -2.481 1.00 0.00 H new ATOM 1798 N MET A 118 11.499 -4.288 -3.300 1.00 0.00 N ATOM 1799 CA MET A 118 10.841 -2.997 -3.098 1.00 0.00 C ATOM 1800 C MET A 118 11.706 -1.797 -3.500 1.00 0.00 C ATOM 1801 O MET A 118 11.253 -0.966 -4.273 1.00 0.00 O ATOM 1802 CB MET A 118 10.369 -2.874 -1.650 1.00 0.00 C ATOM 1803 CG MET A 118 8.927 -3.306 -1.474 1.00 0.00 C ATOM 1804 SD MET A 118 8.559 -4.833 -2.355 1.00 0.00 S ATOM 1805 CE MET A 118 6.785 -4.911 -2.161 1.00 0.00 C ATOM 0 H MET A 118 11.386 -4.935 -2.519 1.00 0.00 H new ATOM 0 HA MET A 118 9.980 -2.974 -3.766 1.00 0.00 H new ATOM 0 HB2 MET A 118 11.008 -3.482 -1.009 1.00 0.00 H new ATOM 0 HB3 MET A 118 10.479 -1.840 -1.321 1.00 0.00 H new ATOM 0 HG2 MET A 118 8.718 -3.442 -0.413 1.00 0.00 H new ATOM 0 HG3 MET A 118 8.267 -2.515 -1.831 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.398 -5.776 -2.699 1.00 0.00 H new ATOM 0 HE2 MET A 118 6.538 -5.002 -1.103 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.335 -4.003 -2.562 1.00 0.00 H new ATOM 1815 N GLU A 119 12.937 -1.710 -3.011 1.00 0.00 N ATOM 1816 CA GLU A 119 13.810 -0.580 -3.353 1.00 0.00 C ATOM 1817 C GLU A 119 14.000 -0.447 -4.867 1.00 0.00 C ATOM 1818 O GLU A 119 13.719 0.605 -5.449 1.00 0.00 O ATOM 1819 CB GLU A 119 15.173 -0.728 -2.674 1.00 0.00 C ATOM 1820 CG GLU A 119 15.174 -0.357 -1.200 1.00 0.00 C ATOM 1821 CD GLU A 119 15.167 1.143 -0.971 1.00 0.00 C ATOM 1822 OE1 GLU A 119 16.261 1.739 -0.893 1.00 0.00 O ATOM 1823 OE2 GLU A 119 14.076 1.735 -0.848 1.00 0.00 O ATOM 0 H GLU A 119 13.355 -2.397 -2.383 1.00 0.00 H new ATOM 0 HA GLU A 119 13.322 0.325 -2.991 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.509 -1.760 -2.778 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.897 -0.102 -3.196 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.301 -0.797 -0.719 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.053 -0.789 -0.722 1.00 0.00 H new ATOM 1830 N LEU A 120 14.446 -1.525 -5.504 1.00 0.00 N ATOM 1831 CA LEU A 120 14.752 -1.502 -6.935 1.00 0.00 C ATOM 1832 C LEU A 120 13.465 -1.361 -7.756 1.00 0.00 C ATOM 1833 O LEU A 120 13.438 -0.711 -8.803 1.00 0.00 O ATOM 1834 CB LEU A 120 15.509 -2.793 -7.304 1.00 0.00 C ATOM 1835 CG LEU A 120 16.246 -2.805 -8.652 1.00 0.00 C ATOM 1836 CD1 LEU A 120 15.283 -3.004 -9.813 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.045 -1.523 -8.831 1.00 0.00 C ATOM 0 H LEU A 120 14.604 -2.427 -5.054 1.00 0.00 H new ATOM 0 HA LEU A 120 15.382 -0.642 -7.164 1.00 0.00 H new ATOM 0 HB2 LEU A 120 16.236 -2.996 -6.518 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.796 -3.617 -7.300 1.00 0.00 H new ATOM 0 HG LEU A 120 16.935 -3.649 -8.648 1.00 0.00 H new ATOM 0 HD11 LEU A 120 15.839 -3.007 -10.750 1.00 0.00 H new ATOM 0 HD12 LEU A 120 14.764 -3.955 -9.696 1.00 0.00 H new ATOM 0 HD13 LEU A 120 14.555 -2.192 -9.825 1.00 0.00 H new ATOM 0 HD21 LEU A 120 17.561 -1.547 -9.791 1.00 0.00 H new ATOM 0 HD22 LEU A 120 16.371 -0.667 -8.803 1.00 0.00 H new ATOM 0 HD23 LEU A 120 17.776 -1.435 -8.028 1.00 0.00 H new ATOM 1849 N VAL A 121 12.404 -1.946 -7.235 1.00 0.00 N ATOM 1850 CA VAL A 121 11.117 -2.033 -7.908 1.00 0.00 C ATOM 1851 C VAL A 121 10.355 -0.704 -7.847 1.00 0.00 C ATOM 1852 O VAL A 121 9.722 -0.302 -8.826 1.00 0.00 O ATOM 1853 CB VAL A 121 10.295 -3.193 -7.286 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.814 -3.067 -7.550 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.799 -4.529 -7.812 1.00 0.00 C ATOM 0 H VAL A 121 12.410 -2.384 -6.314 1.00 0.00 H new ATOM 0 HA VAL A 121 11.283 -2.243 -8.965 1.00 0.00 H new ATOM 0 HB VAL A 121 10.436 -3.138 -6.207 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.290 -3.906 -7.092 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.447 -2.133 -7.124 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.634 -3.071 -8.625 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.216 -5.337 -7.370 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.693 -4.556 -8.897 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.849 -4.652 -7.547 1.00 0.00 H new ATOM 1865 N MET A 122 10.438 -0.010 -6.713 1.00 0.00 N ATOM 1866 CA MET A 122 9.846 1.323 -6.587 1.00 0.00 C ATOM 1867 C MET A 122 10.536 2.272 -7.558 1.00 0.00 C ATOM 1868 O MET A 122 9.892 3.086 -8.223 1.00 0.00 O ATOM 1869 CB MET A 122 9.984 1.875 -5.161 1.00 0.00 C ATOM 1870 CG MET A 122 9.224 1.102 -4.086 1.00 0.00 C ATOM 1871 SD MET A 122 7.439 1.055 -4.349 1.00 0.00 S ATOM 1872 CE MET A 122 7.256 -0.443 -5.317 1.00 0.00 C ATOM 0 H MET A 122 10.907 -0.346 -5.872 1.00 0.00 H new ATOM 0 HA MET A 122 8.784 1.242 -6.817 1.00 0.00 H new ATOM 0 HB2 MET A 122 11.041 1.890 -4.896 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.639 2.909 -5.154 1.00 0.00 H new ATOM 0 HG2 MET A 122 9.604 0.081 -4.049 1.00 0.00 H new ATOM 0 HG3 MET A 122 9.427 1.553 -3.115 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.378 -0.992 -4.976 1.00 0.00 H new ATOM 0 HE2 MET A 122 7.136 -0.184 -6.369 1.00 0.00 H new ATOM 0 HE3 MET A 122 8.143 -1.065 -5.195 1.00 0.00 H new ATOM 1882 N LYS A 123 11.855 2.142 -7.629 1.00 0.00 N ATOM 1883 CA LYS A 123 12.674 2.920 -8.548 1.00 0.00 C ATOM 1884 C LYS A 123 12.305 2.609 -9.998 1.00 0.00 C ATOM 1885 O LYS A 123 12.176 3.512 -10.825 1.00 0.00 O ATOM 1886 CB LYS A 123 14.148 2.602 -8.292 1.00 0.00 C ATOM 1887 CG LYS A 123 15.119 3.310 -9.218 1.00 0.00 C ATOM 1888 CD LYS A 123 16.548 2.897 -8.912 1.00 0.00 C ATOM 1889 CE LYS A 123 17.543 3.551 -9.854 1.00 0.00 C ATOM 1890 NZ LYS A 123 18.935 3.128 -9.556 1.00 0.00 N ATOM 0 H LYS A 123 12.387 1.493 -7.050 1.00 0.00 H new ATOM 0 HA LYS A 123 12.495 3.982 -8.379 1.00 0.00 H new ATOM 0 HB2 LYS A 123 14.389 2.867 -7.263 1.00 0.00 H new ATOM 0 HB3 LYS A 123 14.295 1.526 -8.387 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.880 3.072 -10.255 1.00 0.00 H new ATOM 0 HG3 LYS A 123 15.015 4.389 -9.106 1.00 0.00 H new ATOM 0 HD2 LYS A 123 16.791 3.166 -7.884 1.00 0.00 H new ATOM 0 HD3 LYS A 123 16.636 1.813 -8.987 1.00 0.00 H new ATOM 0 HE2 LYS A 123 17.295 3.292 -10.883 1.00 0.00 H new ATOM 0 HE3 LYS A 123 17.466 4.635 -9.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 19.588 3.593 -10.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 19.179 3.398 -8.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 19.014 2.096 -9.660 1.00 0.00 H new ATOM 1904 N ALA A 124 12.127 1.325 -10.290 1.00 0.00 N ATOM 1905 CA ALA A 124 11.771 0.873 -11.632 1.00 0.00 C ATOM 1906 C ALA A 124 10.429 1.444 -12.073 1.00 0.00 C ATOM 1907 O ALA A 124 10.300 1.966 -13.184 1.00 0.00 O ATOM 1908 CB ALA A 124 11.739 -0.648 -11.680 1.00 0.00 C ATOM 0 H ALA A 124 12.224 0.572 -9.609 1.00 0.00 H new ATOM 0 HA ALA A 124 12.531 1.237 -12.323 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.472 -0.975 -12.685 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.722 -1.041 -11.419 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.000 -1.019 -10.970 1.00 0.00 H new ATOM 1914 N ALA A 125 9.436 1.356 -11.196 1.00 0.00 N ATOM 1915 CA ALA A 125 8.096 1.840 -11.504 1.00 0.00 C ATOM 1916 C ALA A 125 8.069 3.358 -11.630 1.00 0.00 C ATOM 1917 O ALA A 125 7.246 3.915 -12.356 1.00 0.00 O ATOM 1918 CB ALA A 125 7.114 1.379 -10.440 1.00 0.00 C ATOM 0 H ALA A 125 9.534 0.953 -10.264 1.00 0.00 H new ATOM 0 HA ALA A 125 7.800 1.421 -12.466 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.117 1.747 -10.681 1.00 0.00 H new ATOM 0 HB2 ALA A 125 7.100 0.290 -10.405 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.420 1.769 -9.469 1.00 0.00 H new ATOM 1924 N GLY A 126 8.978 4.019 -10.927 1.00 0.00 N ATOM 1925 CA GLY A 126 9.051 5.464 -10.981 1.00 0.00 C ATOM 1926 C GLY A 126 8.295 6.117 -9.844 1.00 0.00 C ATOM 1927 O GLY A 126 7.758 7.212 -9.992 1.00 0.00 O ATOM 0 H GLY A 126 9.668 3.578 -10.319 1.00 0.00 H new ATOM 0 HA2 GLY A 126 10.095 5.775 -10.947 1.00 0.00 H new ATOM 0 HA3 GLY A 126 8.646 5.811 -11.931 1.00 0.00 H new ATOM 1931 N PHE A 127 8.254 5.441 -8.705 1.00 0.00 N ATOM 1932 CA PHE A 127 7.555 5.954 -7.540 1.00 0.00 C ATOM 1933 C PHE A 127 8.438 6.928 -6.771 1.00 0.00 C ATOM 1934 O PHE A 127 9.641 6.705 -6.620 1.00 0.00 O ATOM 1935 CB PHE A 127 7.123 4.808 -6.623 1.00 0.00 C ATOM 1936 CG PHE A 127 6.076 3.907 -7.219 1.00 0.00 C ATOM 1937 CD1 PHE A 127 4.972 4.436 -7.868 1.00 0.00 C ATOM 1938 CD2 PHE A 127 6.193 2.532 -7.123 1.00 0.00 C ATOM 1939 CE1 PHE A 127 4.006 3.609 -8.409 1.00 0.00 C ATOM 1940 CE2 PHE A 127 5.228 1.700 -7.659 1.00 0.00 C ATOM 1941 CZ PHE A 127 4.132 2.238 -8.303 1.00 0.00 C ATOM 0 H PHE A 127 8.698 4.534 -8.565 1.00 0.00 H new ATOM 0 HA PHE A 127 6.666 6.482 -7.885 1.00 0.00 H new ATOM 0 HB2 PHE A 127 7.999 4.211 -6.368 1.00 0.00 H new ATOM 0 HB3 PHE A 127 6.740 5.226 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 127 4.865 5.507 -7.952 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.049 2.103 -6.623 1.00 0.00 H new ATOM 0 HE1 PHE A 127 3.152 4.035 -8.915 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.332 0.628 -7.574 1.00 0.00 H new ATOM 0 HZ PHE A 127 3.377 1.590 -8.722 1.00 0.00 H new ATOM 1951 N LYS A 128 7.841 8.007 -6.289 1.00 0.00 N ATOM 1952 CA LYS A 128 8.582 9.015 -5.549 1.00 0.00 C ATOM 1953 C LYS A 128 8.343 8.869 -4.053 1.00 0.00 C ATOM 1954 O LYS A 128 7.207 8.698 -3.602 1.00 0.00 O ATOM 1955 CB LYS A 128 8.206 10.421 -6.026 1.00 0.00 C ATOM 1956 CG LYS A 128 6.713 10.716 -5.995 1.00 0.00 C ATOM 1957 CD LYS A 128 6.408 12.068 -6.618 1.00 0.00 C ATOM 1958 CE LYS A 128 6.859 12.118 -8.068 1.00 0.00 C ATOM 1959 NZ LYS A 128 6.669 13.462 -8.669 1.00 0.00 N ATOM 0 H LYS A 128 6.847 8.207 -6.397 1.00 0.00 H new ATOM 0 HA LYS A 128 9.645 8.865 -5.738 1.00 0.00 H new ATOM 0 HB2 LYS A 128 8.722 11.153 -5.404 1.00 0.00 H new ATOM 0 HB3 LYS A 128 8.570 10.556 -7.045 1.00 0.00 H new ATOM 0 HG2 LYS A 128 6.174 9.935 -6.532 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.357 10.699 -4.965 1.00 0.00 H new ATOM 0 HD2 LYS A 128 5.338 12.265 -6.560 1.00 0.00 H new ATOM 0 HD3 LYS A 128 6.908 12.854 -6.051 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.911 11.840 -8.129 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.301 11.381 -8.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.990 13.449 -9.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.662 13.718 -8.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 7.222 14.162 -8.135 1.00 0.00 H new ATOM 1973 N GLU A 129 9.425 8.922 -3.294 1.00 0.00 N ATOM 1974 CA GLU A 129 9.362 8.741 -1.853 1.00 0.00 C ATOM 1975 C GLU A 129 9.034 10.051 -1.145 1.00 0.00 C ATOM 1976 O GLU A 129 9.581 11.104 -1.468 1.00 0.00 O ATOM 1977 CB GLU A 129 10.683 8.181 -1.331 1.00 0.00 C ATOM 1978 CG GLU A 129 11.031 6.820 -1.909 1.00 0.00 C ATOM 1979 CD GLU A 129 12.302 6.245 -1.321 1.00 0.00 C ATOM 1980 OE1 GLU A 129 12.288 5.862 -0.137 1.00 0.00 O ATOM 1981 OE2 GLU A 129 13.321 6.180 -2.039 1.00 0.00 O ATOM 0 H GLU A 129 10.364 9.090 -3.655 1.00 0.00 H new ATOM 0 HA GLU A 129 8.563 8.031 -1.640 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.484 8.882 -1.564 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.633 8.104 -0.245 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.207 6.131 -1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 129 11.142 6.906 -2.990 1.00 0.00 H new ATOM 1988 N VAL A 130 8.128 9.966 -0.186 1.00 0.00 N ATOM 1989 CA VAL A 130 7.714 11.118 0.596 1.00 0.00 C ATOM 1990 C VAL A 130 8.364 11.067 1.971 1.00 0.00 C ATOM 1991 O VAL A 130 8.848 12.077 2.488 1.00 0.00 O ATOM 1992 CB VAL A 130 6.180 11.142 0.777 1.00 0.00 C ATOM 1993 CG1 VAL A 130 5.720 12.476 1.341 1.00 0.00 C ATOM 1994 CG2 VAL A 130 5.472 10.827 -0.532 1.00 0.00 C ATOM 0 H VAL A 130 7.659 9.098 0.072 1.00 0.00 H new ATOM 0 HA VAL A 130 8.025 12.016 0.062 1.00 0.00 H new ATOM 0 HB VAL A 130 5.914 10.366 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 130 4.636 12.467 1.459 1.00 0.00 H new ATOM 0 HG12 VAL A 130 6.189 12.642 2.311 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.004 13.277 0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.393 10.850 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.747 11.569 -1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 130 5.768 9.836 -0.876 1.00 0.00 H new ATOM 2004 N LYS A 131 8.384 9.858 2.532 1.00 0.00 N ATOM 2005 CA LYS A 131 8.881 9.604 3.878 1.00 0.00 C ATOM 2006 C LYS A 131 7.977 10.254 4.927 1.00 0.00 C ATOM 2007 O LYS A 131 6.886 10.732 4.603 1.00 0.00 O ATOM 2008 CB LYS A 131 10.340 10.042 4.020 1.00 0.00 C ATOM 2009 CG LYS A 131 11.301 9.159 3.230 1.00 0.00 C ATOM 2010 CD LYS A 131 12.763 9.503 3.493 1.00 0.00 C ATOM 2011 CE LYS A 131 13.201 10.773 2.776 1.00 0.00 C ATOM 2012 NZ LYS A 131 12.551 11.993 3.325 1.00 0.00 N ATOM 0 H LYS A 131 8.051 9.020 2.056 1.00 0.00 H new ATOM 0 HA LYS A 131 8.855 8.529 4.054 1.00 0.00 H new ATOM 0 HB2 LYS A 131 10.440 11.073 3.682 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.619 10.024 5.073 1.00 0.00 H new ATOM 0 HG2 LYS A 131 11.125 8.115 3.488 1.00 0.00 H new ATOM 0 HG3 LYS A 131 11.093 9.263 2.165 1.00 0.00 H new ATOM 0 HD2 LYS A 131 12.917 9.623 4.565 1.00 0.00 H new ATOM 0 HD3 LYS A 131 13.392 8.673 3.172 1.00 0.00 H new ATOM 0 HE2 LYS A 131 14.283 10.876 2.855 1.00 0.00 H new ATOM 0 HE3 LYS A 131 12.966 10.687 1.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 13.229 12.781 3.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 11.727 12.240 2.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 12.242 11.812 4.301 1.00 0.00 H new