USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 675 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 12 THR OG1 : rot -159:sc= -0.763 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 14 ASN : amide:sc= 0.753 K(o=0.75,f=-0.014) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.0294 X(o=-0.029,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 141:sc= 1.02 (180deg=-0.984) USER MOD Single : A 41 CYS SG : rot 132:sc= -7.31! USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 149:sc= -6.2! (180deg=-8.9!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0477 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -1.08 X(o=-1.1,f=-0.84) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 29:sc= 0.0273 USER MOD Single : A 58 TYR OH : rot -35:sc= 1.24 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= -0.578 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.069 K(o=-0.069,f=-1) USER MOD ----------------------------------------------------------------- ATOM 49 N GLU A 4 147.748 -7.488 9.848 1.00 0.00 N ATOM 50 CA GLU A 4 146.475 -8.206 9.892 1.00 0.00 C ATOM 51 C GLU A 4 145.351 -7.412 9.230 1.00 0.00 C ATOM 52 O GLU A 4 145.003 -6.317 9.672 1.00 0.00 O ATOM 53 CB GLU A 4 146.102 -8.525 11.343 1.00 0.00 C ATOM 54 CG GLU A 4 145.755 -9.986 11.571 1.00 0.00 C ATOM 55 CD GLU A 4 144.899 -10.197 12.805 1.00 0.00 C ATOM 56 OE1 GLU A 4 145.390 -9.921 13.920 1.00 0.00 O ATOM 57 OE2 GLU A 4 143.741 -10.637 12.657 1.00 0.00 O ATOM 0 HA GLU A 4 146.601 -9.133 9.333 1.00 0.00 H new ATOM 0 HB2 GLU A 4 146.934 -8.251 11.992 1.00 0.00 H new ATOM 0 HB3 GLU A 4 145.253 -7.908 11.636 1.00 0.00 H new ATOM 0 HG2 GLU A 4 145.228 -10.371 10.698 1.00 0.00 H new ATOM 0 HG3 GLU A 4 146.675 -10.563 11.668 1.00 0.00 H new ATOM 64 N ILE A 5 144.782 -7.982 8.171 1.00 0.00 N ATOM 65 CA ILE A 5 143.697 -7.352 7.446 1.00 0.00 C ATOM 66 C ILE A 5 142.390 -7.443 8.232 1.00 0.00 C ATOM 67 O ILE A 5 142.263 -8.261 9.143 1.00 0.00 O ATOM 68 CB ILE A 5 143.505 -7.999 6.059 1.00 0.00 C ATOM 69 CG1 ILE A 5 142.452 -7.239 5.252 1.00 0.00 C ATOM 70 CG2 ILE A 5 143.115 -9.463 6.201 1.00 0.00 C ATOM 71 CD1 ILE A 5 142.551 -7.472 3.761 1.00 0.00 C ATOM 0 H ILE A 5 145.063 -8.889 7.798 1.00 0.00 H new ATOM 0 HA ILE A 5 143.962 -6.303 7.313 1.00 0.00 H new ATOM 0 HB ILE A 5 144.452 -7.946 5.522 1.00 0.00 H new ATOM 0 HG12 ILE A 5 141.460 -7.536 5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 5 142.552 -6.172 5.453 1.00 0.00 H new ATOM 0 HG21 ILE A 5 142.984 -9.902 5.212 1.00 0.00 H new ATOM 0 HG22 ILE A 5 143.900 -9.999 6.735 1.00 0.00 H new ATOM 0 HG23 ILE A 5 142.181 -9.538 6.758 1.00 0.00 H new ATOM 0 HD11 ILE A 5 141.774 -6.902 3.251 1.00 0.00 H new ATOM 0 HD12 ILE A 5 143.530 -7.149 3.406 1.00 0.00 H new ATOM 0 HD13 ILE A 5 142.421 -8.533 3.549 1.00 0.00 H new ATOM 83 N ILE A 6 141.419 -6.605 7.879 1.00 0.00 N ATOM 84 CA ILE A 6 140.127 -6.608 8.563 1.00 0.00 C ATOM 85 C ILE A 6 138.967 -6.704 7.573 1.00 0.00 C ATOM 86 O ILE A 6 138.224 -7.685 7.573 1.00 0.00 O ATOM 87 CB ILE A 6 139.937 -5.357 9.452 1.00 0.00 C ATOM 88 CG1 ILE A 6 140.662 -4.144 8.861 1.00 0.00 C ATOM 89 CG2 ILE A 6 140.432 -5.635 10.864 1.00 0.00 C ATOM 90 CD1 ILE A 6 139.870 -2.859 8.965 1.00 0.00 C ATOM 0 H ILE A 6 141.500 -5.919 7.128 1.00 0.00 H new ATOM 0 HA ILE A 6 140.125 -7.491 9.202 1.00 0.00 H new ATOM 0 HB ILE A 6 138.872 -5.126 9.490 1.00 0.00 H new ATOM 0 HG12 ILE A 6 141.616 -4.016 9.372 1.00 0.00 H new ATOM 0 HG13 ILE A 6 140.886 -4.340 7.812 1.00 0.00 H new ATOM 0 HG21 ILE A 6 140.293 -4.747 11.480 1.00 0.00 H new ATOM 0 HG22 ILE A 6 139.868 -6.464 11.291 1.00 0.00 H new ATOM 0 HG23 ILE A 6 141.490 -5.894 10.834 1.00 0.00 H new ATOM 0 HD11 ILE A 6 140.443 -2.042 8.527 1.00 0.00 H new ATOM 0 HD12 ILE A 6 138.927 -2.968 8.429 1.00 0.00 H new ATOM 0 HD13 ILE A 6 139.668 -2.640 10.014 1.00 0.00 H new ATOM 102 N GLU A 7 138.809 -5.682 6.735 1.00 0.00 N ATOM 103 CA GLU A 7 137.731 -5.664 5.750 1.00 0.00 C ATOM 104 C GLU A 7 138.266 -5.889 4.340 1.00 0.00 C ATOM 105 O GLU A 7 139.478 -5.925 4.122 1.00 0.00 O ATOM 106 CB GLU A 7 136.977 -4.335 5.814 1.00 0.00 C ATOM 107 CG GLU A 7 136.433 -4.010 7.196 1.00 0.00 C ATOM 108 CD GLU A 7 135.797 -2.634 7.262 1.00 0.00 C ATOM 109 OE1 GLU A 7 136.469 -1.651 6.885 1.00 0.00 O ATOM 110 OE2 GLU A 7 134.628 -2.540 7.691 1.00 0.00 O ATOM 0 H GLU A 7 139.411 -4.859 6.718 1.00 0.00 H new ATOM 0 HA GLU A 7 137.047 -6.478 5.989 1.00 0.00 H new ATOM 0 HB2 GLU A 7 137.644 -3.533 5.497 1.00 0.00 H new ATOM 0 HB3 GLU A 7 136.150 -4.361 5.104 1.00 0.00 H new ATOM 0 HG2 GLU A 7 135.696 -4.761 7.478 1.00 0.00 H new ATOM 0 HG3 GLU A 7 137.242 -4.068 7.924 1.00 0.00 H new ATOM 117 N ILE A 8 137.353 -6.043 3.387 1.00 0.00 N ATOM 118 CA ILE A 8 137.729 -6.271 1.993 1.00 0.00 C ATOM 119 C ILE A 8 137.095 -5.241 1.056 1.00 0.00 C ATOM 120 O ILE A 8 137.485 -5.133 -0.105 1.00 0.00 O ATOM 121 CB ILE A 8 137.324 -7.682 1.529 1.00 0.00 C ATOM 122 CG1 ILE A 8 137.780 -8.730 2.546 1.00 0.00 C ATOM 123 CG2 ILE A 8 137.910 -7.976 0.155 1.00 0.00 C ATOM 124 CD1 ILE A 8 136.679 -9.184 3.479 1.00 0.00 C ATOM 0 H ILE A 8 136.347 -6.014 3.553 1.00 0.00 H new ATOM 0 HA ILE A 8 138.813 -6.170 1.947 1.00 0.00 H new ATOM 0 HB ILE A 8 136.237 -7.726 1.456 1.00 0.00 H new ATOM 0 HG12 ILE A 8 138.173 -9.595 2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 8 138.599 -8.320 3.136 1.00 0.00 H new ATOM 0 HG21 ILE A 8 137.615 -8.977 -0.160 1.00 0.00 H new ATOM 0 HG22 ILE A 8 137.538 -7.245 -0.563 1.00 0.00 H new ATOM 0 HG23 ILE A 8 138.997 -7.916 0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 8 137.073 -9.927 4.173 1.00 0.00 H new ATOM 0 HD12 ILE A 8 136.301 -8.329 4.039 1.00 0.00 H new ATOM 0 HD13 ILE A 8 135.868 -9.624 2.898 1.00 0.00 H new ATOM 136 N GLY A 9 136.119 -4.489 1.560 1.00 0.00 N ATOM 137 CA GLY A 9 135.460 -3.489 0.739 1.00 0.00 C ATOM 138 C GLY A 9 136.304 -2.238 0.560 1.00 0.00 C ATOM 139 O GLY A 9 137.258 -2.240 -0.219 1.00 0.00 O ATOM 0 H GLY A 9 135.775 -4.554 2.518 1.00 0.00 H new ATOM 0 HA2 GLY A 9 135.236 -3.916 -0.239 1.00 0.00 H new ATOM 0 HA3 GLY A 9 134.507 -3.219 1.195 1.00 0.00 H new ATOM 143 N PRO A 10 135.983 -1.147 1.277 1.00 0.00 N ATOM 144 CA PRO A 10 136.739 0.106 1.184 1.00 0.00 C ATOM 145 C PRO A 10 138.201 -0.090 1.565 1.00 0.00 C ATOM 146 O PRO A 10 139.082 0.626 1.089 1.00 0.00 O ATOM 147 CB PRO A 10 136.041 1.036 2.185 1.00 0.00 C ATOM 148 CG PRO A 10 135.262 0.132 3.079 1.00 0.00 C ATOM 149 CD PRO A 10 134.873 -1.048 2.237 1.00 0.00 C ATOM 0 HA PRO A 10 136.750 0.502 0.169 1.00 0.00 H new ATOM 0 HB2 PRO A 10 136.766 1.621 2.751 1.00 0.00 H new ATOM 0 HB3 PRO A 10 135.388 1.745 1.675 1.00 0.00 H new ATOM 0 HG2 PRO A 10 135.860 -0.180 3.935 1.00 0.00 H new ATOM 0 HG3 PRO A 10 134.380 0.638 3.473 1.00 0.00 H new ATOM 0 HD2 PRO A 10 134.773 -1.955 2.834 1.00 0.00 H new ATOM 0 HD3 PRO A 10 133.918 -0.889 1.736 1.00 0.00 H new ATOM 157 N PHE A 11 138.449 -1.074 2.424 1.00 0.00 N ATOM 158 CA PHE A 11 139.799 -1.389 2.879 1.00 0.00 C ATOM 159 C PHE A 11 140.776 -1.440 1.707 1.00 0.00 C ATOM 160 O PHE A 11 141.847 -0.835 1.751 1.00 0.00 O ATOM 161 CB PHE A 11 139.789 -2.732 3.614 1.00 0.00 C ATOM 162 CG PHE A 11 141.112 -3.120 4.211 1.00 0.00 C ATOM 163 CD1 PHE A 11 142.191 -3.443 3.401 1.00 0.00 C ATOM 164 CD2 PHE A 11 141.273 -3.177 5.586 1.00 0.00 C ATOM 165 CE1 PHE A 11 143.402 -3.811 3.954 1.00 0.00 C ATOM 166 CE2 PHE A 11 142.483 -3.548 6.141 1.00 0.00 C ATOM 167 CZ PHE A 11 143.548 -3.866 5.324 1.00 0.00 C ATOM 0 H PHE A 11 137.725 -1.672 2.822 1.00 0.00 H new ATOM 0 HA PHE A 11 140.129 -0.603 3.558 1.00 0.00 H new ATOM 0 HB2 PHE A 11 139.043 -2.693 4.408 1.00 0.00 H new ATOM 0 HB3 PHE A 11 139.475 -3.511 2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 11 142.083 -3.406 2.327 1.00 0.00 H new ATOM 0 HD2 PHE A 11 140.443 -2.929 6.231 1.00 0.00 H new ATOM 0 HE1 PHE A 11 144.236 -4.056 3.313 1.00 0.00 H new ATOM 0 HE2 PHE A 11 142.595 -3.589 7.214 1.00 0.00 H new ATOM 0 HZ PHE A 11 144.494 -4.157 5.756 1.00 0.00 H new ATOM 177 N THR A 12 140.398 -2.171 0.665 1.00 0.00 N ATOM 178 CA THR A 12 141.236 -2.311 -0.519 1.00 0.00 C ATOM 179 C THR A 12 141.155 -1.066 -1.399 1.00 0.00 C ATOM 180 O THR A 12 142.170 -0.440 -1.707 1.00 0.00 O ATOM 181 CB THR A 12 140.810 -3.543 -1.320 1.00 0.00 C ATOM 182 OG1 THR A 12 139.570 -4.042 -0.855 1.00 0.00 O ATOM 183 CG2 THR A 12 141.810 -4.678 -1.258 1.00 0.00 C ATOM 0 H THR A 12 139.514 -2.677 0.616 1.00 0.00 H new ATOM 0 HA THR A 12 142.269 -2.432 -0.192 1.00 0.00 H new ATOM 0 HB THR A 12 140.737 -3.200 -2.352 1.00 0.00 H new ATOM 0 HG1 THR A 12 139.472 -4.979 -1.126 1.00 0.00 H new ATOM 0 HG21 THR A 12 141.444 -5.518 -1.848 1.00 0.00 H new ATOM 0 HG22 THR A 12 142.766 -4.343 -1.659 1.00 0.00 H new ATOM 0 HG23 THR A 12 141.941 -4.991 -0.222 1.00 0.00 H new ATOM 191 N GLN A 13 139.939 -0.721 -1.806 1.00 0.00 N ATOM 192 CA GLN A 13 139.717 0.441 -2.659 1.00 0.00 C ATOM 193 C GLN A 13 140.422 1.683 -2.112 1.00 0.00 C ATOM 194 O GLN A 13 140.954 2.489 -2.874 1.00 0.00 O ATOM 195 CB GLN A 13 138.218 0.703 -2.807 1.00 0.00 C ATOM 196 CG GLN A 13 137.886 1.918 -3.659 1.00 0.00 C ATOM 197 CD GLN A 13 137.478 1.546 -5.072 1.00 0.00 C ATOM 198 OE1 GLN A 13 136.489 0.842 -5.278 1.00 0.00 O ATOM 199 NE2 GLN A 13 138.239 2.017 -6.052 1.00 0.00 N ATOM 0 H GLN A 13 139.090 -1.230 -1.559 1.00 0.00 H new ATOM 0 HA GLN A 13 140.142 0.225 -3.639 1.00 0.00 H new ATOM 0 HB2 GLN A 13 137.747 -0.176 -3.246 1.00 0.00 H new ATOM 0 HB3 GLN A 13 137.783 0.836 -1.817 1.00 0.00 H new ATOM 0 HG2 GLN A 13 137.079 2.478 -3.187 1.00 0.00 H new ATOM 0 HG3 GLN A 13 138.752 2.578 -3.697 1.00 0.00 H new ATOM 0 HE21 GLN A 13 139.049 2.597 -5.835 1.00 0.00 H new ATOM 0 HE22 GLN A 13 138.013 1.799 -7.023 1.00 0.00 H new ATOM 208 N ASN A 14 140.422 1.834 -0.789 1.00 0.00 N ATOM 209 CA ASN A 14 141.064 2.981 -0.154 1.00 0.00 C ATOM 210 C ASN A 14 142.483 3.158 -0.666 1.00 0.00 C ATOM 211 O ASN A 14 142.816 4.195 -1.243 1.00 0.00 O ATOM 212 CB ASN A 14 141.067 2.823 1.369 1.00 0.00 C ATOM 213 CG ASN A 14 140.011 3.678 2.042 1.00 0.00 C ATOM 214 OD1 ASN A 14 140.309 4.747 2.575 1.00 0.00 O ATOM 215 ND2 ASN A 14 138.769 3.210 2.021 1.00 0.00 N ATOM 0 H ASN A 14 139.987 1.179 -0.139 1.00 0.00 H new ATOM 0 HA ASN A 14 140.491 3.872 -0.411 1.00 0.00 H new ATOM 0 HB2 ASN A 14 140.899 1.776 1.623 1.00 0.00 H new ATOM 0 HB3 ASN A 14 142.049 3.092 1.757 1.00 0.00 H new ATOM 0 HD21 ASN A 14 138.016 3.742 2.458 1.00 0.00 H new ATOM 0 HD22 ASN A 14 138.567 2.319 1.568 1.00 0.00 H new ATOM 222 N LEU A 15 143.320 2.142 -0.475 1.00 0.00 N ATOM 223 CA LEU A 15 144.693 2.216 -0.952 1.00 0.00 C ATOM 224 C LEU A 15 144.698 2.600 -2.426 1.00 0.00 C ATOM 225 O LEU A 15 145.643 3.216 -2.915 1.00 0.00 O ATOM 226 CB LEU A 15 145.424 0.887 -0.739 1.00 0.00 C ATOM 227 CG LEU A 15 146.856 1.014 -0.208 1.00 0.00 C ATOM 228 CD1 LEU A 15 147.789 1.509 -1.303 1.00 0.00 C ATOM 229 CD2 LEU A 15 146.904 1.945 0.995 1.00 0.00 C ATOM 0 H LEU A 15 143.075 1.272 -0.001 1.00 0.00 H new ATOM 0 HA LEU A 15 145.222 2.978 -0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 15 144.847 0.279 -0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 15 145.450 0.348 -1.686 1.00 0.00 H new ATOM 0 HG LEU A 15 147.191 0.027 0.111 1.00 0.00 H new ATOM 0 HD11 LEU A 15 148.801 1.593 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 15 147.781 0.804 -2.134 1.00 0.00 H new ATOM 0 HD13 LEU A 15 147.454 2.485 -1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 15 147.930 2.021 1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 15 146.548 2.933 0.705 1.00 0.00 H new ATOM 0 HD23 LEU A 15 146.269 1.549 1.787 1.00 0.00 H new ATOM 241 N GLY A 16 143.612 2.257 -3.121 1.00 0.00 N ATOM 242 CA GLY A 16 143.493 2.603 -4.521 1.00 0.00 C ATOM 243 C GLY A 16 143.628 4.097 -4.722 1.00 0.00 C ATOM 244 O GLY A 16 144.300 4.551 -5.650 1.00 0.00 O ATOM 0 H GLY A 16 142.817 1.747 -2.736 1.00 0.00 H new ATOM 0 HA2 GLY A 16 144.261 2.084 -5.094 1.00 0.00 H new ATOM 0 HA3 GLY A 16 142.529 2.266 -4.902 1.00 0.00 H new ATOM 248 N LYS A 17 143.006 4.871 -3.830 1.00 0.00 N ATOM 249 CA LYS A 17 143.090 6.323 -3.905 1.00 0.00 C ATOM 250 C LYS A 17 144.545 6.753 -3.744 1.00 0.00 C ATOM 251 O LYS A 17 145.080 7.516 -4.553 1.00 0.00 O ATOM 252 CB LYS A 17 142.226 6.968 -2.818 1.00 0.00 C ATOM 253 CG LYS A 17 140.738 6.938 -3.127 1.00 0.00 C ATOM 254 CD LYS A 17 140.032 8.168 -2.577 1.00 0.00 C ATOM 255 CE LYS A 17 138.654 7.824 -2.037 1.00 0.00 C ATOM 256 NZ LYS A 17 138.730 7.157 -0.707 1.00 0.00 N ATOM 0 H LYS A 17 142.445 4.517 -3.056 1.00 0.00 H new ATOM 0 HA LYS A 17 142.719 6.652 -4.876 1.00 0.00 H new ATOM 0 HB2 LYS A 17 142.403 6.455 -1.873 1.00 0.00 H new ATOM 0 HB3 LYS A 17 142.540 8.003 -2.682 1.00 0.00 H new ATOM 0 HG2 LYS A 17 140.590 6.883 -4.206 1.00 0.00 H new ATOM 0 HG3 LYS A 17 140.294 6.040 -2.698 1.00 0.00 H new ATOM 0 HD2 LYS A 17 140.635 8.611 -1.784 1.00 0.00 H new ATOM 0 HD3 LYS A 17 139.939 8.918 -3.363 1.00 0.00 H new ATOM 0 HE2 LYS A 17 138.059 8.734 -1.954 1.00 0.00 H new ATOM 0 HE3 LYS A 17 138.140 7.171 -2.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 137.770 6.939 -0.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 139.276 6.276 -0.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 139.197 7.790 -0.027 1.00 0.00 H new ATOM 270 N PHE A 18 145.186 6.228 -2.705 1.00 0.00 N ATOM 271 CA PHE A 18 146.586 6.528 -2.443 1.00 0.00 C ATOM 272 C PHE A 18 147.475 5.894 -3.508 1.00 0.00 C ATOM 273 O PHE A 18 148.652 6.232 -3.635 1.00 0.00 O ATOM 274 CB PHE A 18 146.991 6.026 -1.057 1.00 0.00 C ATOM 275 CG PHE A 18 146.902 7.077 0.013 1.00 0.00 C ATOM 276 CD1 PHE A 18 147.499 8.315 -0.163 1.00 0.00 C ATOM 277 CD2 PHE A 18 146.224 6.826 1.195 1.00 0.00 C ATOM 278 CE1 PHE A 18 147.421 9.284 0.819 1.00 0.00 C ATOM 279 CE2 PHE A 18 146.142 7.792 2.181 1.00 0.00 C ATOM 280 CZ PHE A 18 146.741 9.021 1.992 1.00 0.00 C ATOM 0 H PHE A 18 144.757 5.593 -2.032 1.00 0.00 H new ATOM 0 HA PHE A 18 146.716 7.610 -2.475 1.00 0.00 H new ATOM 0 HB2 PHE A 18 146.353 5.186 -0.783 1.00 0.00 H new ATOM 0 HB3 PHE A 18 148.013 5.649 -1.100 1.00 0.00 H new ATOM 0 HD1 PHE A 18 148.032 8.525 -1.079 1.00 0.00 H new ATOM 0 HD2 PHE A 18 145.754 5.865 1.348 1.00 0.00 H new ATOM 0 HE1 PHE A 18 147.891 10.245 0.670 1.00 0.00 H new ATOM 0 HE2 PHE A 18 145.610 7.585 3.098 1.00 0.00 H new ATOM 0 HZ PHE A 18 146.678 9.777 2.761 1.00 0.00 H new ATOM 290 N ALA A 19 146.897 4.977 -4.277 1.00 0.00 N ATOM 291 CA ALA A 19 147.621 4.296 -5.340 1.00 0.00 C ATOM 292 C ALA A 19 148.076 5.294 -6.394 1.00 0.00 C ATOM 293 O ALA A 19 149.272 5.476 -6.617 1.00 0.00 O ATOM 294 CB ALA A 19 146.750 3.218 -5.968 1.00 0.00 C ATOM 0 H ALA A 19 145.923 4.688 -4.181 1.00 0.00 H new ATOM 0 HA ALA A 19 148.503 3.821 -4.911 1.00 0.00 H new ATOM 0 HB1 ALA A 19 147.305 2.718 -6.761 1.00 0.00 H new ATOM 0 HB2 ALA A 19 146.468 2.490 -5.208 1.00 0.00 H new ATOM 0 HB3 ALA A 19 145.852 3.673 -6.385 1.00 0.00 H new ATOM 300 N VAL A 20 147.111 5.951 -7.031 1.00 0.00 N ATOM 301 CA VAL A 20 147.414 6.945 -8.052 1.00 0.00 C ATOM 302 C VAL A 20 148.301 8.041 -7.473 1.00 0.00 C ATOM 303 O VAL A 20 149.219 8.528 -8.135 1.00 0.00 O ATOM 304 CB VAL A 20 146.132 7.575 -8.630 1.00 0.00 C ATOM 305 CG1 VAL A 20 145.335 8.275 -7.538 1.00 0.00 C ATOM 306 CG2 VAL A 20 146.469 8.541 -9.756 1.00 0.00 C ATOM 0 H VAL A 20 146.115 5.813 -6.858 1.00 0.00 H new ATOM 0 HA VAL A 20 147.938 6.435 -8.860 1.00 0.00 H new ATOM 0 HB VAL A 20 145.515 6.776 -9.040 1.00 0.00 H new ATOM 0 HG11 VAL A 20 144.434 8.712 -7.969 1.00 0.00 H new ATOM 0 HG12 VAL A 20 145.056 7.552 -6.771 1.00 0.00 H new ATOM 0 HG13 VAL A 20 145.943 9.062 -7.092 1.00 0.00 H new ATOM 0 HG21 VAL A 20 145.550 8.975 -10.150 1.00 0.00 H new ATOM 0 HG22 VAL A 20 147.111 9.335 -9.374 1.00 0.00 H new ATOM 0 HG23 VAL A 20 146.988 8.006 -10.551 1.00 0.00 H new ATOM 316 N ASP A 21 148.025 8.415 -6.228 1.00 0.00 N ATOM 317 CA ASP A 21 148.807 9.445 -5.552 1.00 0.00 C ATOM 318 C ASP A 21 150.186 8.912 -5.171 1.00 0.00 C ATOM 319 O ASP A 21 151.126 9.683 -4.967 1.00 0.00 O ATOM 320 CB ASP A 21 148.072 9.933 -4.303 1.00 0.00 C ATOM 321 CG ASP A 21 146.880 10.807 -4.639 1.00 0.00 C ATOM 322 OD1 ASP A 21 145.886 10.274 -5.175 1.00 0.00 O ATOM 323 OD2 ASP A 21 146.940 12.024 -4.368 1.00 0.00 O ATOM 0 H ASP A 21 147.268 8.022 -5.668 1.00 0.00 H new ATOM 0 HA ASP A 21 148.936 10.282 -6.238 1.00 0.00 H new ATOM 0 HB2 ASP A 21 147.737 9.073 -3.723 1.00 0.00 H new ATOM 0 HB3 ASP A 21 148.763 10.493 -3.673 1.00 0.00 H new ATOM 328 N GLU A 22 150.303 7.589 -5.074 1.00 0.00 N ATOM 329 CA GLU A 22 151.566 6.951 -4.718 1.00 0.00 C ATOM 330 C GLU A 22 152.424 6.713 -5.957 1.00 0.00 C ATOM 331 O GLU A 22 153.650 6.810 -5.902 1.00 0.00 O ATOM 332 CB GLU A 22 151.301 5.626 -3.999 1.00 0.00 C ATOM 333 CG GLU A 22 152.560 4.821 -3.706 1.00 0.00 C ATOM 334 CD GLU A 22 152.263 3.521 -2.983 1.00 0.00 C ATOM 335 OE1 GLU A 22 151.178 3.415 -2.374 1.00 0.00 O ATOM 336 OE2 GLU A 22 153.117 2.611 -3.026 1.00 0.00 O ATOM 0 H GLU A 22 149.535 6.938 -5.238 1.00 0.00 H new ATOM 0 HA GLU A 22 152.110 7.618 -4.049 1.00 0.00 H new ATOM 0 HB2 GLU A 22 150.785 5.830 -3.061 1.00 0.00 H new ATOM 0 HB3 GLU A 22 150.628 5.022 -4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 22 153.074 4.603 -4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 22 153.239 5.422 -3.102 1.00 0.00 H new ATOM 343 N GLU A 23 151.772 6.402 -7.074 1.00 0.00 N ATOM 344 CA GLU A 23 152.475 6.149 -8.328 1.00 0.00 C ATOM 345 C GLU A 23 153.447 7.282 -8.652 1.00 0.00 C ATOM 346 O GLU A 23 154.455 7.075 -9.328 1.00 0.00 O ATOM 347 CB GLU A 23 151.474 5.981 -9.472 1.00 0.00 C ATOM 348 CG GLU A 23 151.953 5.040 -10.565 1.00 0.00 C ATOM 349 CD GLU A 23 152.693 5.764 -11.674 1.00 0.00 C ATOM 350 OE1 GLU A 23 153.906 6.012 -11.513 1.00 0.00 O ATOM 351 OE2 GLU A 23 152.059 6.081 -12.702 1.00 0.00 O ATOM 0 H GLU A 23 150.757 6.319 -7.136 1.00 0.00 H new ATOM 0 HA GLU A 23 153.047 5.228 -8.212 1.00 0.00 H new ATOM 0 HB2 GLU A 23 150.533 5.607 -9.069 1.00 0.00 H new ATOM 0 HB3 GLU A 23 151.267 6.958 -9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 23 152.607 4.285 -10.129 1.00 0.00 H new ATOM 0 HG3 GLU A 23 151.097 4.514 -10.987 1.00 0.00 H new ATOM 358 N ASN A 24 153.134 8.478 -8.164 1.00 0.00 N ATOM 359 CA ASN A 24 153.978 9.644 -8.402 1.00 0.00 C ATOM 360 C ASN A 24 155.290 9.540 -7.630 1.00 0.00 C ATOM 361 O ASN A 24 156.327 10.027 -8.082 1.00 0.00 O ATOM 362 CB ASN A 24 153.238 10.922 -8.007 1.00 0.00 C ATOM 363 CG ASN A 24 152.411 11.487 -9.146 1.00 0.00 C ATOM 364 OD1 ASN A 24 152.718 12.551 -9.684 1.00 0.00 O ATOM 365 ND2 ASN A 24 151.354 10.775 -9.520 1.00 0.00 N ATOM 0 H ASN A 24 152.304 8.665 -7.602 1.00 0.00 H new ATOM 0 HA ASN A 24 154.211 9.680 -9.466 1.00 0.00 H new ATOM 0 HB2 ASN A 24 152.587 10.714 -7.158 1.00 0.00 H new ATOM 0 HB3 ASN A 24 153.960 11.670 -7.680 1.00 0.00 H new ATOM 0 HD21 ASN A 24 150.760 11.105 -10.281 1.00 0.00 H new ATOM 0 HD22 ASN A 24 151.136 9.898 -9.046 1.00 0.00 H new ATOM 372 N LYS A 25 155.243 8.904 -6.463 1.00 0.00 N ATOM 373 CA LYS A 25 156.433 8.742 -5.634 1.00 0.00 C ATOM 374 C LYS A 25 157.415 7.764 -6.279 1.00 0.00 C ATOM 375 O LYS A 25 158.355 8.176 -6.959 1.00 0.00 O ATOM 376 CB LYS A 25 156.046 8.264 -4.230 1.00 0.00 C ATOM 377 CG LYS A 25 156.266 9.310 -3.150 1.00 0.00 C ATOM 378 CD LYS A 25 157.656 9.201 -2.545 1.00 0.00 C ATOM 379 CE LYS A 25 157.659 8.313 -1.313 1.00 0.00 C ATOM 380 NZ LYS A 25 158.998 8.268 -0.663 1.00 0.00 N ATOM 0 H LYS A 25 154.396 8.493 -6.071 1.00 0.00 H new ATOM 0 HA LYS A 25 156.924 9.711 -5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 25 154.996 7.970 -4.232 1.00 0.00 H new ATOM 0 HB3 LYS A 25 156.626 7.374 -3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 25 156.129 10.305 -3.573 1.00 0.00 H new ATOM 0 HG3 LYS A 25 155.517 9.190 -2.367 1.00 0.00 H new ATOM 0 HD2 LYS A 25 158.346 8.798 -3.287 1.00 0.00 H new ATOM 0 HD3 LYS A 25 158.017 10.195 -2.280 1.00 0.00 H new ATOM 0 HE2 LYS A 25 156.921 8.680 -0.599 1.00 0.00 H new ATOM 0 HE3 LYS A 25 157.357 7.304 -1.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 158.957 7.651 0.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 159.698 7.894 -1.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 159.275 9.227 -0.373 1.00 0.00 H new ATOM 394 N ILE A 26 157.195 6.468 -6.061 1.00 0.00 N ATOM 395 CA ILE A 26 158.062 5.439 -6.622 1.00 0.00 C ATOM 396 C ILE A 26 158.285 5.648 -8.119 1.00 0.00 C ATOM 397 O ILE A 26 159.371 5.388 -8.635 1.00 0.00 O ATOM 398 CB ILE A 26 157.473 4.032 -6.383 1.00 0.00 C ATOM 399 CG1 ILE A 26 158.493 2.948 -6.741 1.00 0.00 C ATOM 400 CG2 ILE A 26 156.185 3.841 -7.170 1.00 0.00 C ATOM 401 CD1 ILE A 26 159.844 3.143 -6.086 1.00 0.00 C ATOM 0 H ILE A 26 156.423 6.108 -5.500 1.00 0.00 H new ATOM 0 HA ILE A 26 159.022 5.518 -6.113 1.00 0.00 H new ATOM 0 HB ILE A 26 157.237 3.941 -5.323 1.00 0.00 H new ATOM 0 HG12 ILE A 26 158.095 1.976 -6.449 1.00 0.00 H new ATOM 0 HG13 ILE A 26 158.623 2.927 -7.823 1.00 0.00 H new ATOM 0 HG21 ILE A 26 155.790 2.842 -6.985 1.00 0.00 H new ATOM 0 HG22 ILE A 26 155.453 4.585 -6.856 1.00 0.00 H new ATOM 0 HG23 ILE A 26 156.388 3.959 -8.234 1.00 0.00 H new ATOM 0 HD11 ILE A 26 160.514 2.337 -6.386 1.00 0.00 H new ATOM 0 HD12 ILE A 26 160.265 4.099 -6.397 1.00 0.00 H new ATOM 0 HD13 ILE A 26 159.728 3.133 -5.002 1.00 0.00 H new ATOM 413 N GLY A 27 157.250 6.123 -8.805 1.00 0.00 N ATOM 414 CA GLY A 27 157.355 6.360 -10.232 1.00 0.00 C ATOM 415 C GLY A 27 157.591 7.821 -10.561 1.00 0.00 C ATOM 416 O GLY A 27 156.833 8.690 -10.131 1.00 0.00 O ATOM 0 H GLY A 27 156.342 6.348 -8.398 1.00 0.00 H new ATOM 0 HA2 GLY A 27 158.172 5.763 -10.637 1.00 0.00 H new ATOM 0 HA3 GLY A 27 156.441 6.024 -10.721 1.00 0.00 H new ATOM 420 N GLN A 28 158.642 8.092 -11.329 1.00 0.00 N ATOM 421 CA GLN A 28 158.973 9.458 -11.716 1.00 0.00 C ATOM 422 C GLN A 28 157.820 10.100 -12.483 1.00 0.00 C ATOM 423 O GLN A 28 157.623 11.314 -12.429 1.00 0.00 O ATOM 424 CB GLN A 28 160.240 9.476 -12.572 1.00 0.00 C ATOM 425 CG GLN A 28 161.484 9.017 -11.826 1.00 0.00 C ATOM 426 CD GLN A 28 162.522 10.115 -11.689 1.00 0.00 C ATOM 427 OE1 GLN A 28 163.581 10.064 -12.316 1.00 0.00 O ATOM 428 NE2 GLN A 28 162.224 11.114 -10.867 1.00 0.00 N ATOM 0 H GLN A 28 159.278 7.384 -11.695 1.00 0.00 H new ATOM 0 HA GLN A 28 159.149 10.034 -10.807 1.00 0.00 H new ATOM 0 HB2 GLN A 28 160.091 8.836 -13.441 1.00 0.00 H new ATOM 0 HB3 GLN A 28 160.402 10.487 -12.945 1.00 0.00 H new ATOM 0 HG2 GLN A 28 161.199 8.666 -10.834 1.00 0.00 H new ATOM 0 HG3 GLN A 28 161.925 8.169 -12.350 1.00 0.00 H new ATOM 0 HE21 GLN A 28 161.335 11.115 -10.368 1.00 0.00 H new ATOM 0 HE22 GLN A 28 162.884 11.880 -10.735 1.00 0.00 H new ATOM 437 N TYR A 29 157.060 9.274 -13.195 1.00 0.00 N ATOM 438 CA TYR A 29 155.924 9.757 -13.973 1.00 0.00 C ATOM 439 C TYR A 29 154.646 9.021 -13.580 1.00 0.00 C ATOM 440 O TYR A 29 154.554 7.801 -13.717 1.00 0.00 O ATOM 441 CB TYR A 29 156.191 9.578 -15.469 1.00 0.00 C ATOM 442 CG TYR A 29 155.653 10.707 -16.320 1.00 0.00 C ATOM 443 CD1 TYR A 29 154.287 10.885 -16.490 1.00 0.00 C ATOM 444 CD2 TYR A 29 156.514 11.595 -16.953 1.00 0.00 C ATOM 445 CE1 TYR A 29 153.791 11.914 -17.266 1.00 0.00 C ATOM 446 CE2 TYR A 29 156.026 12.627 -17.730 1.00 0.00 C ATOM 447 CZ TYR A 29 154.665 12.783 -17.884 1.00 0.00 C ATOM 448 OH TYR A 29 154.176 13.811 -18.658 1.00 0.00 O ATOM 0 H TYR A 29 157.210 8.267 -13.249 1.00 0.00 H new ATOM 0 HA TYR A 29 155.792 10.818 -13.760 1.00 0.00 H new ATOM 0 HB2 TYR A 29 157.266 9.493 -15.630 1.00 0.00 H new ATOM 0 HB3 TYR A 29 155.744 8.640 -15.800 1.00 0.00 H new ATOM 0 HD1 TYR A 29 153.600 10.207 -16.007 1.00 0.00 H new ATOM 0 HD2 TYR A 29 157.581 11.476 -16.836 1.00 0.00 H new ATOM 0 HE1 TYR A 29 152.725 12.037 -17.388 1.00 0.00 H new ATOM 0 HE2 TYR A 29 156.708 13.309 -18.215 1.00 0.00 H new ATOM 0 HH TYR A 29 154.923 14.332 -19.020 1.00 0.00 H new ATOM 458 N GLY A 30 153.663 9.770 -13.091 1.00 0.00 N ATOM 459 CA GLY A 30 152.406 9.169 -12.686 1.00 0.00 C ATOM 460 C GLY A 30 151.444 8.991 -13.845 1.00 0.00 C ATOM 461 O GLY A 30 151.645 9.558 -14.919 1.00 0.00 O ATOM 0 H GLY A 30 153.714 10.781 -12.968 1.00 0.00 H new ATOM 0 HA2 GLY A 30 152.602 8.199 -12.229 1.00 0.00 H new ATOM 0 HA3 GLY A 30 151.939 9.792 -11.923 1.00 0.00 H new ATOM 465 N ARG A 31 150.399 8.200 -13.627 1.00 0.00 N ATOM 466 CA ARG A 31 149.403 7.948 -14.662 1.00 0.00 C ATOM 467 C ARG A 31 148.122 7.378 -14.059 1.00 0.00 C ATOM 468 O ARG A 31 148.015 7.218 -12.842 1.00 0.00 O ATOM 469 CB ARG A 31 149.963 6.987 -15.713 1.00 0.00 C ATOM 470 CG ARG A 31 149.981 7.567 -17.119 1.00 0.00 C ATOM 471 CD ARG A 31 149.286 6.650 -18.113 1.00 0.00 C ATOM 472 NE ARG A 31 148.554 7.400 -19.131 1.00 0.00 N ATOM 473 CZ ARG A 31 149.140 8.075 -20.117 1.00 0.00 C ATOM 474 NH1 ARG A 31 150.463 8.099 -20.222 1.00 0.00 N ATOM 475 NH2 ARG A 31 148.400 8.730 -21.003 1.00 0.00 N ATOM 0 H ARG A 31 150.220 7.723 -12.744 1.00 0.00 H new ATOM 0 HA ARG A 31 149.163 8.897 -15.141 1.00 0.00 H new ATOM 0 HB2 ARG A 31 150.978 6.705 -15.432 1.00 0.00 H new ATOM 0 HB3 ARG A 31 149.367 6.074 -15.713 1.00 0.00 H new ATOM 0 HG2 ARG A 31 149.491 8.541 -17.118 1.00 0.00 H new ATOM 0 HG3 ARG A 31 151.012 7.729 -17.433 1.00 0.00 H new ATOM 0 HD2 ARG A 31 150.026 6.011 -18.595 1.00 0.00 H new ATOM 0 HD3 ARG A 31 148.597 5.994 -17.581 1.00 0.00 H new ATOM 0 HE ARG A 31 147.535 7.407 -19.083 1.00 0.00 H new ATOM 0 HH11 ARG A 31 151.038 7.598 -19.544 1.00 0.00 H new ATOM 0 HH12 ARG A 31 150.905 8.618 -20.980 1.00 0.00 H new ATOM 0 HH21 ARG A 31 147.383 8.716 -20.928 1.00 0.00 H new ATOM 0 HH22 ARG A 31 148.848 9.248 -21.759 1.00 0.00 H new ATOM 489 N LEU A 32 147.154 7.072 -14.916 1.00 0.00 N ATOM 490 CA LEU A 32 145.881 6.518 -14.469 1.00 0.00 C ATOM 491 C LEU A 32 146.055 5.089 -13.966 1.00 0.00 C ATOM 492 O LEU A 32 146.788 4.298 -14.558 1.00 0.00 O ATOM 493 CB LEU A 32 144.856 6.552 -15.605 1.00 0.00 C ATOM 494 CG LEU A 32 144.311 7.940 -15.945 1.00 0.00 C ATOM 495 CD1 LEU A 32 145.249 8.664 -16.898 1.00 0.00 C ATOM 496 CD2 LEU A 32 142.918 7.832 -16.543 1.00 0.00 C ATOM 0 H LEU A 32 147.227 7.198 -15.926 1.00 0.00 H new ATOM 0 HA LEU A 32 145.517 7.132 -13.645 1.00 0.00 H new ATOM 0 HB2 LEU A 32 145.314 6.129 -16.499 1.00 0.00 H new ATOM 0 HB3 LEU A 32 144.020 5.905 -15.339 1.00 0.00 H new ATOM 0 HG LEU A 32 144.246 8.520 -15.024 1.00 0.00 H new ATOM 0 HD11 LEU A 32 144.844 9.650 -17.128 1.00 0.00 H new ATOM 0 HD12 LEU A 32 146.228 8.774 -16.432 1.00 0.00 H new ATOM 0 HD13 LEU A 32 145.348 8.088 -17.818 1.00 0.00 H new ATOM 0 HD21 LEU A 32 142.545 8.829 -16.779 1.00 0.00 H new ATOM 0 HD22 LEU A 32 142.958 7.234 -17.454 1.00 0.00 H new ATOM 0 HD23 LEU A 32 142.250 7.355 -15.826 1.00 0.00 H new ATOM 508 N THR A 33 145.378 4.766 -12.869 1.00 0.00 N ATOM 509 CA THR A 33 145.459 3.433 -12.283 1.00 0.00 C ATOM 510 C THR A 33 144.296 3.189 -11.327 1.00 0.00 C ATOM 511 O THR A 33 144.449 2.524 -10.302 1.00 0.00 O ATOM 512 CB THR A 33 146.785 3.262 -11.541 1.00 0.00 C ATOM 513 OG1 THR A 33 147.794 4.066 -12.125 1.00 0.00 O ATOM 514 CG2 THR A 33 147.286 1.835 -11.527 1.00 0.00 C ATOM 0 H THR A 33 144.766 5.410 -12.367 1.00 0.00 H new ATOM 0 HA THR A 33 145.403 2.703 -13.090 1.00 0.00 H new ATOM 0 HB THR A 33 146.581 3.567 -10.515 1.00 0.00 H new ATOM 0 HG1 THR A 33 148.634 3.944 -11.635 1.00 0.00 H new ATOM 0 HG21 THR A 33 148.230 1.786 -10.984 1.00 0.00 H new ATOM 0 HG22 THR A 33 146.552 1.196 -11.036 1.00 0.00 H new ATOM 0 HG23 THR A 33 147.438 1.493 -12.551 1.00 0.00 H new ATOM 522 N PHE A 34 143.132 3.739 -11.663 1.00 0.00 N ATOM 523 CA PHE A 34 141.947 3.588 -10.828 1.00 0.00 C ATOM 524 C PHE A 34 140.955 2.597 -11.433 1.00 0.00 C ATOM 525 O PHE A 34 139.749 2.708 -11.216 1.00 0.00 O ATOM 526 CB PHE A 34 141.268 4.943 -10.626 1.00 0.00 C ATOM 527 CG PHE A 34 140.712 5.137 -9.244 1.00 0.00 C ATOM 528 CD1 PHE A 34 141.552 5.158 -8.141 1.00 0.00 C ATOM 529 CD2 PHE A 34 139.350 5.298 -9.047 1.00 0.00 C ATOM 530 CE1 PHE A 34 141.044 5.337 -6.869 1.00 0.00 C ATOM 531 CE2 PHE A 34 138.836 5.477 -7.776 1.00 0.00 C ATOM 532 CZ PHE A 34 139.684 5.497 -6.686 1.00 0.00 C ATOM 0 H PHE A 34 142.986 4.293 -12.507 1.00 0.00 H new ATOM 0 HA PHE A 34 142.270 3.195 -9.864 1.00 0.00 H new ATOM 0 HB2 PHE A 34 141.987 5.735 -10.834 1.00 0.00 H new ATOM 0 HB3 PHE A 34 140.461 5.047 -11.351 1.00 0.00 H new ATOM 0 HD1 PHE A 34 142.616 5.033 -8.278 1.00 0.00 H new ATOM 0 HD2 PHE A 34 138.682 5.284 -9.896 1.00 0.00 H new ATOM 0 HE1 PHE A 34 141.709 5.352 -6.018 1.00 0.00 H new ATOM 0 HE2 PHE A 34 137.772 5.601 -7.636 1.00 0.00 H new ATOM 0 HZ PHE A 34 139.285 5.637 -5.692 1.00 0.00 H new ATOM 542 N ASN A 35 141.462 1.629 -12.193 1.00 0.00 N ATOM 543 CA ASN A 35 140.602 0.630 -12.817 1.00 0.00 C ATOM 544 C ASN A 35 139.978 -0.282 -11.765 1.00 0.00 C ATOM 545 O ASN A 35 138.764 -0.273 -11.567 1.00 0.00 O ATOM 546 CB ASN A 35 141.390 -0.198 -13.832 1.00 0.00 C ATOM 547 CG ASN A 35 140.494 -0.859 -14.860 1.00 0.00 C ATOM 548 OD1 ASN A 35 139.912 -0.191 -15.715 1.00 0.00 O ATOM 549 ND2 ASN A 35 140.377 -2.180 -14.781 1.00 0.00 N ATOM 0 H ASN A 35 142.456 1.516 -12.390 1.00 0.00 H new ATOM 0 HA ASN A 35 139.801 1.153 -13.339 1.00 0.00 H new ATOM 0 HB2 ASN A 35 142.109 0.444 -14.340 1.00 0.00 H new ATOM 0 HB3 ASN A 35 141.962 -0.963 -13.307 1.00 0.00 H new ATOM 0 HD21 ASN A 35 139.787 -2.680 -15.445 1.00 0.00 H new ATOM 0 HD22 ASN A 35 140.878 -2.694 -14.056 1.00 0.00 H new ATOM 556 N LYS A 36 140.815 -1.068 -11.092 1.00 0.00 N ATOM 557 CA LYS A 36 140.332 -1.982 -10.061 1.00 0.00 C ATOM 558 C LYS A 36 141.402 -2.229 -9.001 1.00 0.00 C ATOM 559 O LYS A 36 142.225 -3.133 -9.135 1.00 0.00 O ATOM 560 CB LYS A 36 139.903 -3.310 -10.690 1.00 0.00 C ATOM 561 CG LYS A 36 138.398 -3.444 -10.858 1.00 0.00 C ATOM 562 CD LYS A 36 137.997 -4.883 -11.146 1.00 0.00 C ATOM 563 CE LYS A 36 137.762 -5.108 -12.631 1.00 0.00 C ATOM 564 NZ LYS A 36 138.180 -6.471 -13.058 1.00 0.00 N ATOM 0 H LYS A 36 141.824 -1.091 -11.241 1.00 0.00 H new ATOM 0 HA LYS A 36 139.471 -1.520 -9.577 1.00 0.00 H new ATOM 0 HB2 LYS A 36 140.380 -3.412 -11.665 1.00 0.00 H new ATOM 0 HB3 LYS A 36 140.266 -4.130 -10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 36 137.897 -3.099 -9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 36 138.063 -2.801 -11.672 1.00 0.00 H new ATOM 0 HD2 LYS A 36 138.778 -5.557 -10.794 1.00 0.00 H new ATOM 0 HD3 LYS A 36 137.091 -5.127 -10.592 1.00 0.00 H new ATOM 0 HE2 LYS A 36 136.705 -4.965 -12.857 1.00 0.00 H new ATOM 0 HE3 LYS A 36 138.315 -4.363 -13.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 138.004 -6.585 -14.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 139.194 -6.599 -12.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 137.635 -7.182 -12.531 1.00 0.00 H new ATOM 578 N VAL A 37 141.387 -1.426 -7.946 1.00 0.00 N ATOM 579 CA VAL A 37 142.361 -1.570 -6.871 1.00 0.00 C ATOM 580 C VAL A 37 141.815 -2.445 -5.750 1.00 0.00 C ATOM 581 O VAL A 37 141.027 -1.984 -4.922 1.00 0.00 O ATOM 582 CB VAL A 37 142.762 -0.203 -6.284 1.00 0.00 C ATOM 583 CG1 VAL A 37 144.016 -0.336 -5.429 1.00 0.00 C ATOM 584 CG2 VAL A 37 142.966 0.822 -7.391 1.00 0.00 C ATOM 0 H VAL A 37 140.715 -0.671 -7.811 1.00 0.00 H new ATOM 0 HA VAL A 37 143.241 -2.043 -7.307 1.00 0.00 H new ATOM 0 HB VAL A 37 141.950 0.148 -5.647 1.00 0.00 H new ATOM 0 HG11 VAL A 37 144.284 0.639 -5.023 1.00 0.00 H new ATOM 0 HG12 VAL A 37 143.826 -1.030 -4.611 1.00 0.00 H new ATOM 0 HG13 VAL A 37 144.836 -0.712 -6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 37 143.248 1.779 -6.953 1.00 0.00 H new ATOM 0 HG22 VAL A 37 143.756 0.482 -8.061 1.00 0.00 H new ATOM 0 HG23 VAL A 37 142.040 0.940 -7.953 1.00 0.00 H new ATOM 594 N ILE A 38 142.234 -3.708 -5.721 1.00 0.00 N ATOM 595 CA ILE A 38 141.774 -4.631 -4.691 1.00 0.00 C ATOM 596 C ILE A 38 142.763 -5.799 -4.487 1.00 0.00 C ATOM 597 O ILE A 38 143.926 -5.574 -4.127 1.00 0.00 O ATOM 598 CB ILE A 38 140.361 -5.166 -5.026 1.00 0.00 C ATOM 599 CG1 ILE A 38 140.300 -5.642 -6.480 1.00 0.00 C ATOM 600 CG2 ILE A 38 139.314 -4.092 -4.776 1.00 0.00 C ATOM 601 CD1 ILE A 38 139.360 -6.809 -6.693 1.00 0.00 C ATOM 0 H ILE A 38 142.886 -4.112 -6.394 1.00 0.00 H new ATOM 0 HA ILE A 38 141.723 -4.076 -3.754 1.00 0.00 H new ATOM 0 HB ILE A 38 140.150 -6.014 -4.375 1.00 0.00 H new ATOM 0 HG12 ILE A 38 139.986 -4.812 -7.113 1.00 0.00 H new ATOM 0 HG13 ILE A 38 141.301 -5.928 -6.803 1.00 0.00 H new ATOM 0 HG21 ILE A 38 138.326 -4.484 -5.016 1.00 0.00 H new ATOM 0 HG22 ILE A 38 139.341 -3.794 -3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 38 139.523 -3.226 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 38 139.366 -7.094 -7.745 1.00 0.00 H new ATOM 0 HD12 ILE A 38 139.686 -7.654 -6.086 1.00 0.00 H new ATOM 0 HD13 ILE A 38 138.350 -6.521 -6.401 1.00 0.00 H new ATOM 613 N LYS A 39 142.303 -7.039 -4.709 1.00 0.00 N ATOM 614 CA LYS A 39 143.144 -8.225 -4.546 1.00 0.00 C ATOM 615 C LYS A 39 143.488 -8.469 -3.077 1.00 0.00 C ATOM 616 O LYS A 39 143.344 -7.577 -2.242 1.00 0.00 O ATOM 617 CB LYS A 39 144.422 -8.101 -5.378 1.00 0.00 C ATOM 618 CG LYS A 39 144.425 -8.981 -6.617 1.00 0.00 C ATOM 619 CD LYS A 39 143.970 -8.214 -7.848 1.00 0.00 C ATOM 620 CE LYS A 39 143.471 -9.152 -8.935 1.00 0.00 C ATOM 621 NZ LYS A 39 144.590 -9.874 -9.603 1.00 0.00 N ATOM 0 H LYS A 39 141.348 -7.243 -5.003 1.00 0.00 H new ATOM 0 HA LYS A 39 142.575 -9.083 -4.905 1.00 0.00 H new ATOM 0 HB2 LYS A 39 144.550 -7.062 -5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 39 145.278 -8.360 -4.755 1.00 0.00 H new ATOM 0 HG2 LYS A 39 145.428 -9.374 -6.783 1.00 0.00 H new ATOM 0 HG3 LYS A 39 143.769 -9.837 -6.458 1.00 0.00 H new ATOM 0 HD2 LYS A 39 143.176 -7.519 -7.573 1.00 0.00 H new ATOM 0 HD3 LYS A 39 144.797 -7.617 -8.232 1.00 0.00 H new ATOM 0 HE2 LYS A 39 142.780 -9.875 -8.501 1.00 0.00 H new ATOM 0 HE3 LYS A 39 142.912 -8.582 -9.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 144.305 -10.856 -9.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 144.823 -9.400 -10.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 145.425 -9.871 -8.982 1.00 0.00 H new ATOM 635 N PRO A 40 143.946 -9.692 -2.747 1.00 0.00 N ATOM 636 CA PRO A 40 144.310 -10.067 -1.376 1.00 0.00 C ATOM 637 C PRO A 40 145.289 -9.081 -0.750 1.00 0.00 C ATOM 638 O PRO A 40 146.504 -9.269 -0.813 1.00 0.00 O ATOM 639 CB PRO A 40 144.961 -11.451 -1.526 1.00 0.00 C ATOM 640 CG PRO A 40 145.192 -11.631 -2.989 1.00 0.00 C ATOM 641 CD PRO A 40 144.142 -10.811 -3.680 1.00 0.00 C ATOM 0 HA PRO A 40 143.442 -10.069 -0.717 1.00 0.00 H new ATOM 0 HB2 PRO A 40 145.898 -11.505 -0.972 1.00 0.00 H new ATOM 0 HB3 PRO A 40 144.312 -12.234 -1.133 1.00 0.00 H new ATOM 0 HG2 PRO A 40 146.192 -11.300 -3.269 1.00 0.00 H new ATOM 0 HG3 PRO A 40 145.114 -12.681 -3.270 1.00 0.00 H new ATOM 0 HD2 PRO A 40 144.474 -10.469 -4.660 1.00 0.00 H new ATOM 0 HD3 PRO A 40 143.223 -11.376 -3.835 1.00 0.00 H new ATOM 649 N CYS A 41 144.745 -8.031 -0.152 1.00 0.00 N ATOM 650 CA CYS A 41 145.558 -7.003 0.486 1.00 0.00 C ATOM 651 C CYS A 41 145.841 -7.347 1.946 1.00 0.00 C ATOM 652 O CYS A 41 145.562 -8.458 2.399 1.00 0.00 O ATOM 653 CB CYS A 41 144.846 -5.655 0.396 1.00 0.00 C ATOM 654 SG CYS A 41 143.311 -5.571 1.347 1.00 0.00 S ATOM 0 H CYS A 41 143.740 -7.867 -0.095 1.00 0.00 H new ATOM 0 HA CYS A 41 146.513 -6.948 -0.037 1.00 0.00 H new ATOM 0 HB2 CYS A 41 145.522 -4.874 0.746 1.00 0.00 H new ATOM 0 HB3 CYS A 41 144.626 -5.441 -0.650 1.00 0.00 H new ATOM 0 HG CYS A 41 143.296 -4.478 2.050 1.00 0.00 H new ATOM 660 N MET A 42 146.393 -6.384 2.677 1.00 0.00 N ATOM 661 CA MET A 42 146.714 -6.575 4.087 1.00 0.00 C ATOM 662 C MET A 42 147.285 -5.296 4.692 1.00 0.00 C ATOM 663 O MET A 42 148.220 -4.706 4.153 1.00 0.00 O ATOM 664 CB MET A 42 147.713 -7.723 4.253 1.00 0.00 C ATOM 665 CG MET A 42 147.467 -8.569 5.491 1.00 0.00 C ATOM 666 SD MET A 42 148.967 -9.355 6.108 1.00 0.00 S ATOM 667 CE MET A 42 148.538 -11.086 5.940 1.00 0.00 C ATOM 0 H MET A 42 146.628 -5.460 2.315 1.00 0.00 H new ATOM 0 HA MET A 42 145.793 -6.825 4.614 1.00 0.00 H new ATOM 0 HB2 MET A 42 147.669 -8.362 3.371 1.00 0.00 H new ATOM 0 HB3 MET A 42 148.722 -7.312 4.298 1.00 0.00 H new ATOM 0 HG2 MET A 42 147.041 -7.943 6.275 1.00 0.00 H new ATOM 0 HG3 MET A 42 146.728 -9.337 5.260 1.00 0.00 H new ATOM 0 HE1 MET A 42 149.369 -11.702 6.283 1.00 0.00 H new ATOM 0 HE2 MET A 42 147.655 -11.302 6.541 1.00 0.00 H new ATOM 0 HE3 MET A 42 148.328 -11.309 4.894 1.00 0.00 H new ATOM 677 N LYS A 43 146.714 -4.873 5.815 1.00 0.00 N ATOM 678 CA LYS A 43 147.164 -3.663 6.495 1.00 0.00 C ATOM 679 C LYS A 43 147.238 -3.882 8.001 1.00 0.00 C ATOM 680 O LYS A 43 146.605 -4.791 8.541 1.00 0.00 O ATOM 681 CB LYS A 43 146.222 -2.494 6.191 1.00 0.00 C ATOM 682 CG LYS A 43 146.729 -1.151 6.689 1.00 0.00 C ATOM 683 CD LYS A 43 146.153 -0.806 8.054 1.00 0.00 C ATOM 684 CE LYS A 43 147.019 0.208 8.785 1.00 0.00 C ATOM 685 NZ LYS A 43 146.839 0.133 10.262 1.00 0.00 N ATOM 0 H LYS A 43 145.938 -5.350 6.274 1.00 0.00 H new ATOM 0 HA LYS A 43 148.161 -3.424 6.126 1.00 0.00 H new ATOM 0 HB2 LYS A 43 146.066 -2.436 5.114 1.00 0.00 H new ATOM 0 HB3 LYS A 43 145.251 -2.695 6.643 1.00 0.00 H new ATOM 0 HG2 LYS A 43 147.817 -1.171 6.747 1.00 0.00 H new ATOM 0 HG3 LYS A 43 146.462 -0.373 5.974 1.00 0.00 H new ATOM 0 HD2 LYS A 43 145.146 -0.407 7.935 1.00 0.00 H new ATOM 0 HD3 LYS A 43 146.068 -1.712 8.654 1.00 0.00 H new ATOM 0 HE2 LYS A 43 148.067 0.035 8.538 1.00 0.00 H new ATOM 0 HE3 LYS A 43 146.772 1.212 8.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 147.727 0.398 10.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 146.084 0.786 10.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 146.580 -0.838 10.531 1.00 0.00 H new ATOM 699 N LYS A 44 148.008 -3.037 8.673 1.00 0.00 N ATOM 700 CA LYS A 44 148.163 -3.124 10.117 1.00 0.00 C ATOM 701 C LYS A 44 148.824 -1.863 10.656 1.00 0.00 C ATOM 702 O LYS A 44 149.473 -1.128 9.912 1.00 0.00 O ATOM 703 CB LYS A 44 148.996 -4.343 10.496 1.00 0.00 C ATOM 704 CG LYS A 44 148.626 -4.939 11.846 1.00 0.00 C ATOM 705 CD LYS A 44 147.134 -5.221 11.953 1.00 0.00 C ATOM 706 CE LYS A 44 146.442 -4.240 12.887 1.00 0.00 C ATOM 707 NZ LYS A 44 145.510 -4.927 13.822 1.00 0.00 N ATOM 0 H LYS A 44 148.537 -2.281 8.238 1.00 0.00 H new ATOM 0 HA LYS A 44 147.172 -3.224 10.559 1.00 0.00 H new ATOM 0 HB2 LYS A 44 148.878 -5.106 9.727 1.00 0.00 H new ATOM 0 HB3 LYS A 44 150.049 -4.063 10.508 1.00 0.00 H new ATOM 0 HG2 LYS A 44 149.182 -5.864 11.999 1.00 0.00 H new ATOM 0 HG3 LYS A 44 148.924 -4.253 12.639 1.00 0.00 H new ATOM 0 HD2 LYS A 44 146.681 -5.163 10.963 1.00 0.00 H new ATOM 0 HD3 LYS A 44 146.981 -6.238 12.315 1.00 0.00 H new ATOM 0 HE2 LYS A 44 147.192 -3.693 13.459 1.00 0.00 H new ATOM 0 HE3 LYS A 44 145.891 -3.506 12.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 145.059 -4.224 14.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 144.779 -5.429 13.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 146.040 -5.609 14.401 1.00 0.00 H new ATOM 721 N THR A 45 148.651 -1.611 11.944 1.00 0.00 N ATOM 722 CA THR A 45 149.225 -0.439 12.565 1.00 0.00 C ATOM 723 C THR A 45 150.556 -0.761 13.239 1.00 0.00 C ATOM 724 O THR A 45 150.971 -1.923 13.308 1.00 0.00 O ATOM 725 CB THR A 45 148.247 0.162 13.576 1.00 0.00 C ATOM 726 OG1 THR A 45 147.323 -0.814 14.022 1.00 0.00 O ATOM 727 CG2 THR A 45 147.456 1.326 13.023 1.00 0.00 C ATOM 0 H THR A 45 148.116 -2.206 12.576 1.00 0.00 H new ATOM 0 HA THR A 45 149.417 0.294 11.781 1.00 0.00 H new ATOM 0 HB THR A 45 148.866 0.523 14.398 1.00 0.00 H new ATOM 0 HG1 THR A 45 146.708 -0.410 14.669 1.00 0.00 H new ATOM 0 HG21 THR A 45 146.782 1.705 13.791 1.00 0.00 H new ATOM 0 HG22 THR A 45 148.140 2.118 12.717 1.00 0.00 H new ATOM 0 HG23 THR A 45 146.876 0.995 12.162 1.00 0.00 H new ATOM 735 N ILE A 46 151.218 0.282 13.734 1.00 0.00 N ATOM 736 CA ILE A 46 152.503 0.132 14.407 1.00 0.00 C ATOM 737 C ILE A 46 152.550 0.968 15.679 1.00 0.00 C ATOM 738 O ILE A 46 153.440 1.800 15.853 1.00 0.00 O ATOM 739 CB ILE A 46 153.677 0.546 13.493 1.00 0.00 C ATOM 740 CG1 ILE A 46 153.381 0.201 12.030 1.00 0.00 C ATOM 741 CG2 ILE A 46 154.965 -0.123 13.950 1.00 0.00 C ATOM 742 CD1 ILE A 46 153.264 -1.283 11.771 1.00 0.00 C ATOM 0 H ILE A 46 150.883 1.244 13.681 1.00 0.00 H new ATOM 0 HA ILE A 46 152.606 -0.924 14.657 1.00 0.00 H new ATOM 0 HB ILE A 46 153.801 1.626 13.566 1.00 0.00 H new ATOM 0 HG12 ILE A 46 152.453 0.688 11.731 1.00 0.00 H new ATOM 0 HG13 ILE A 46 154.172 0.610 11.402 1.00 0.00 H new ATOM 0 HG21 ILE A 46 155.783 0.178 13.296 1.00 0.00 H new ATOM 0 HG22 ILE A 46 155.188 0.178 14.973 1.00 0.00 H new ATOM 0 HG23 ILE A 46 154.847 -1.206 13.908 1.00 0.00 H new ATOM 0 HD11 ILE A 46 153.054 -1.453 10.715 1.00 0.00 H new ATOM 0 HD12 ILE A 46 154.200 -1.774 12.038 1.00 0.00 H new ATOM 0 HD13 ILE A 46 152.454 -1.695 12.373 1.00 0.00 H new ATOM 754 N TYR A 47 151.587 0.750 16.566 1.00 0.00 N ATOM 755 CA TYR A 47 151.525 1.492 17.820 1.00 0.00 C ATOM 756 C TYR A 47 152.286 0.764 18.920 1.00 0.00 C ATOM 757 O TYR A 47 152.232 -0.461 19.019 1.00 0.00 O ATOM 758 CB TYR A 47 150.070 1.709 18.242 1.00 0.00 C ATOM 759 CG TYR A 47 149.344 0.433 18.602 1.00 0.00 C ATOM 760 CD1 TYR A 47 148.662 -0.298 17.638 1.00 0.00 C ATOM 761 CD2 TYR A 47 149.340 -0.042 19.908 1.00 0.00 C ATOM 762 CE1 TYR A 47 147.997 -1.465 17.964 1.00 0.00 C ATOM 763 CE2 TYR A 47 148.678 -1.208 20.243 1.00 0.00 C ATOM 764 CZ TYR A 47 148.008 -1.915 19.267 1.00 0.00 C ATOM 765 OH TYR A 47 147.347 -3.076 19.595 1.00 0.00 O ATOM 0 H TYR A 47 150.840 0.067 16.441 1.00 0.00 H new ATOM 0 HA TYR A 47 151.994 2.463 17.661 1.00 0.00 H new ATOM 0 HB2 TYR A 47 150.046 2.384 19.098 1.00 0.00 H new ATOM 0 HB3 TYR A 47 149.536 2.204 17.431 1.00 0.00 H new ATOM 0 HD1 TYR A 47 148.651 0.051 16.616 1.00 0.00 H new ATOM 0 HD2 TYR A 47 149.863 0.510 20.675 1.00 0.00 H new ATOM 0 HE1 TYR A 47 147.472 -2.021 17.202 1.00 0.00 H new ATOM 0 HE2 TYR A 47 148.685 -1.563 21.263 1.00 0.00 H new ATOM 0 HH TYR A 47 147.454 -3.254 20.553 1.00 0.00 H new ATOM 775 N GLU A 48 152.997 1.526 19.744 1.00 0.00 N ATOM 776 CA GLU A 48 153.771 0.950 20.836 1.00 0.00 C ATOM 777 C GLU A 48 152.862 0.528 21.981 1.00 0.00 C ATOM 778 O GLU A 48 152.540 -0.649 22.140 1.00 0.00 O ATOM 779 CB GLU A 48 154.824 1.944 21.326 1.00 0.00 C ATOM 780 CG GLU A 48 155.647 1.435 22.499 1.00 0.00 C ATOM 781 CD GLU A 48 156.424 0.177 22.164 1.00 0.00 C ATOM 782 OE1 GLU A 48 157.225 0.211 21.206 1.00 0.00 O ATOM 783 OE2 GLU A 48 156.233 -0.843 22.861 1.00 0.00 O ATOM 0 H GLU A 48 153.053 2.542 19.676 1.00 0.00 H new ATOM 0 HA GLU A 48 154.280 0.062 20.462 1.00 0.00 H new ATOM 0 HB2 GLU A 48 155.494 2.186 20.501 1.00 0.00 H new ATOM 0 HB3 GLU A 48 154.329 2.871 21.616 1.00 0.00 H new ATOM 0 HG2 GLU A 48 156.342 2.213 22.815 1.00 0.00 H new ATOM 0 HG3 GLU A 48 154.986 1.236 23.342 1.00 0.00 H new ATOM 790 N ASN A 49 152.461 1.502 22.770 1.00 0.00 N ATOM 791 CA ASN A 49 151.586 1.263 23.913 1.00 0.00 C ATOM 792 C ASN A 49 151.132 2.584 24.520 1.00 0.00 C ATOM 793 O ASN A 49 149.936 2.842 24.652 1.00 0.00 O ATOM 794 CB ASN A 49 152.306 0.418 24.968 1.00 0.00 C ATOM 795 CG ASN A 49 151.930 -1.048 24.888 1.00 0.00 C ATOM 796 OD1 ASN A 49 152.798 -1.921 24.857 1.00 0.00 O ATOM 797 ND2 ASN A 49 150.632 -1.326 24.853 1.00 0.00 N ATOM 0 H ASN A 49 152.727 2.479 22.644 1.00 0.00 H new ATOM 0 HA ASN A 49 150.708 0.718 23.567 1.00 0.00 H new ATOM 0 HB2 ASN A 49 153.383 0.522 24.839 1.00 0.00 H new ATOM 0 HB3 ASN A 49 152.065 0.799 25.961 1.00 0.00 H new ATOM 0 HD21 ASN A 49 150.319 -2.295 24.798 1.00 0.00 H new ATOM 0 HD22 ASN A 49 149.948 -0.570 24.881 1.00 0.00 H new ATOM 804 N GLU A 50 152.100 3.421 24.877 1.00 0.00 N ATOM 805 CA GLU A 50 151.807 4.724 25.458 1.00 0.00 C ATOM 806 C GLU A 50 151.900 5.809 24.390 1.00 0.00 C ATOM 807 O GLU A 50 152.298 6.939 24.670 1.00 0.00 O ATOM 808 CB GLU A 50 152.779 5.028 26.599 1.00 0.00 C ATOM 809 CG GLU A 50 152.144 5.787 27.753 1.00 0.00 C ATOM 810 CD GLU A 50 153.162 6.531 28.594 1.00 0.00 C ATOM 811 OE1 GLU A 50 153.826 5.885 29.430 1.00 0.00 O ATOM 812 OE2 GLU A 50 153.295 7.759 28.415 1.00 0.00 O ATOM 0 H GLU A 50 153.095 3.219 24.774 1.00 0.00 H new ATOM 0 HA GLU A 50 150.793 4.707 25.857 1.00 0.00 H new ATOM 0 HB2 GLU A 50 153.191 4.091 26.974 1.00 0.00 H new ATOM 0 HB3 GLU A 50 153.614 5.609 26.209 1.00 0.00 H new ATOM 0 HG2 GLU A 50 151.416 6.496 27.359 1.00 0.00 H new ATOM 0 HG3 GLU A 50 151.598 5.088 28.386 1.00 0.00 H new ATOM 819 N ARG A 51 151.536 5.449 23.162 1.00 0.00 N ATOM 820 CA ARG A 51 151.580 6.382 22.042 1.00 0.00 C ATOM 821 C ARG A 51 153.016 6.801 21.748 1.00 0.00 C ATOM 822 O ARG A 51 153.307 7.988 21.594 1.00 0.00 O ATOM 823 CB ARG A 51 150.722 7.615 22.338 1.00 0.00 C ATOM 824 CG ARG A 51 150.651 8.600 21.180 1.00 0.00 C ATOM 825 CD ARG A 51 150.890 10.030 21.642 1.00 0.00 C ATOM 826 NE ARG A 51 149.685 10.849 21.532 1.00 0.00 N ATOM 827 CZ ARG A 51 149.508 11.999 22.178 1.00 0.00 C ATOM 828 NH1 ARG A 51 150.455 12.471 22.979 1.00 0.00 N ATOM 829 NH2 ARG A 51 148.381 12.682 22.021 1.00 0.00 N ATOM 0 H ARG A 51 151.207 4.515 22.918 1.00 0.00 H new ATOM 0 HA ARG A 51 151.178 5.878 21.163 1.00 0.00 H new ATOM 0 HB2 ARG A 51 149.712 7.292 22.592 1.00 0.00 H new ATOM 0 HB3 ARG A 51 151.123 8.125 23.214 1.00 0.00 H new ATOM 0 HG2 ARG A 51 151.393 8.332 20.428 1.00 0.00 H new ATOM 0 HG3 ARG A 51 149.674 8.530 20.702 1.00 0.00 H new ATOM 0 HD2 ARG A 51 151.231 10.024 22.677 1.00 0.00 H new ATOM 0 HD3 ARG A 51 151.687 10.475 21.046 1.00 0.00 H new ATOM 0 HE ARG A 51 148.935 10.520 20.924 1.00 0.00 H new ATOM 0 HH11 ARG A 51 151.324 11.952 23.102 1.00 0.00 H new ATOM 0 HH12 ARG A 51 150.314 13.353 23.471 1.00 0.00 H new ATOM 0 HH21 ARG A 51 147.650 12.326 21.405 1.00 0.00 H new ATOM 0 HH22 ARG A 51 148.246 13.563 22.516 1.00 0.00 H new ATOM 843 N GLU A 52 153.915 5.823 21.672 1.00 0.00 N ATOM 844 CA GLU A 52 155.320 6.106 21.399 1.00 0.00 C ATOM 845 C GLU A 52 155.600 6.142 19.902 1.00 0.00 C ATOM 846 O GLU A 52 156.568 6.759 19.457 1.00 0.00 O ATOM 847 CB GLU A 52 156.222 5.077 22.083 1.00 0.00 C ATOM 848 CG GLU A 52 156.365 5.291 23.581 1.00 0.00 C ATOM 849 CD GLU A 52 156.982 4.098 24.285 1.00 0.00 C ATOM 850 OE1 GLU A 52 158.170 3.810 24.035 1.00 0.00 O ATOM 851 OE2 GLU A 52 156.275 3.452 25.087 1.00 0.00 O ATOM 0 H GLU A 52 153.697 4.834 21.795 1.00 0.00 H new ATOM 0 HA GLU A 52 155.542 7.092 21.807 1.00 0.00 H new ATOM 0 HB2 GLU A 52 155.821 4.079 21.904 1.00 0.00 H new ATOM 0 HB3 GLU A 52 157.210 5.111 21.624 1.00 0.00 H new ATOM 0 HG2 GLU A 52 156.980 6.172 23.761 1.00 0.00 H new ATOM 0 HG3 GLU A 52 155.384 5.494 24.010 1.00 0.00 H new ATOM 858 N ILE A 53 154.747 5.485 19.131 1.00 0.00 N ATOM 859 CA ILE A 53 154.905 5.452 17.680 1.00 0.00 C ATOM 860 C ILE A 53 153.564 5.639 16.971 1.00 0.00 C ATOM 861 O ILE A 53 153.194 6.755 16.608 1.00 0.00 O ATOM 862 CB ILE A 53 155.619 4.154 17.212 1.00 0.00 C ATOM 863 CG1 ILE A 53 155.406 3.900 15.711 1.00 0.00 C ATOM 864 CG2 ILE A 53 155.174 2.957 18.037 1.00 0.00 C ATOM 865 CD1 ILE A 53 156.078 2.641 15.206 1.00 0.00 C ATOM 0 H ILE A 53 153.940 4.968 19.481 1.00 0.00 H new ATOM 0 HA ILE A 53 155.544 6.290 17.402 1.00 0.00 H new ATOM 0 HB ILE A 53 156.688 4.295 17.371 1.00 0.00 H new ATOM 0 HG12 ILE A 53 154.337 3.836 15.510 1.00 0.00 H new ATOM 0 HG13 ILE A 53 155.785 4.754 15.150 1.00 0.00 H new ATOM 0 HG21 ILE A 53 155.690 2.062 17.688 1.00 0.00 H new ATOM 0 HG22 ILE A 53 155.415 3.128 19.086 1.00 0.00 H new ATOM 0 HG23 ILE A 53 154.098 2.821 17.929 1.00 0.00 H new ATOM 0 HD11 ILE A 53 155.884 2.528 14.139 1.00 0.00 H new ATOM 0 HD12 ILE A 53 157.153 2.710 15.374 1.00 0.00 H new ATOM 0 HD13 ILE A 53 155.682 1.778 15.740 1.00 0.00 H new ATOM 877 N LYS A 54 152.849 4.547 16.782 1.00 0.00 N ATOM 878 CA LYS A 54 151.543 4.568 16.121 1.00 0.00 C ATOM 879 C LYS A 54 151.679 4.692 14.603 1.00 0.00 C ATOM 880 O LYS A 54 151.102 5.591 13.990 1.00 0.00 O ATOM 881 CB LYS A 54 150.684 5.715 16.663 1.00 0.00 C ATOM 882 CG LYS A 54 149.208 5.371 16.773 1.00 0.00 C ATOM 883 CD LYS A 54 148.568 6.040 17.981 1.00 0.00 C ATOM 884 CE LYS A 54 147.170 6.544 17.662 1.00 0.00 C ATOM 885 NZ LYS A 54 146.476 7.059 18.875 1.00 0.00 N ATOM 0 H LYS A 54 153.149 3.618 17.079 1.00 0.00 H new ATOM 0 HA LYS A 54 151.054 3.619 16.339 1.00 0.00 H new ATOM 0 HB2 LYS A 54 151.056 6.003 17.647 1.00 0.00 H new ATOM 0 HB3 LYS A 54 150.799 6.582 16.013 1.00 0.00 H new ATOM 0 HG2 LYS A 54 148.692 5.685 15.866 1.00 0.00 H new ATOM 0 HG3 LYS A 54 149.090 4.290 16.849 1.00 0.00 H new ATOM 0 HD2 LYS A 54 148.521 5.332 18.808 1.00 0.00 H new ATOM 0 HD3 LYS A 54 149.190 6.873 18.309 1.00 0.00 H new ATOM 0 HE2 LYS A 54 147.231 7.335 16.915 1.00 0.00 H new ATOM 0 HE3 LYS A 54 146.584 5.736 17.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 145.526 7.393 18.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 146.395 6.297 19.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 147.022 7.847 19.279 1.00 0.00 H new ATOM 899 N GLY A 55 152.429 3.774 13.998 1.00 0.00 N ATOM 900 CA GLY A 55 152.608 3.788 12.556 1.00 0.00 C ATOM 901 C GLY A 55 151.488 3.054 11.845 1.00 0.00 C ATOM 902 O GLY A 55 150.410 2.867 12.408 1.00 0.00 O ATOM 0 H GLY A 55 152.917 3.020 14.482 1.00 0.00 H new ATOM 0 HA2 GLY A 55 152.648 4.819 12.204 1.00 0.00 H new ATOM 0 HA3 GLY A 55 153.563 3.327 12.303 1.00 0.00 H new ATOM 906 N TYR A 56 151.740 2.629 10.613 1.00 0.00 N ATOM 907 CA TYR A 56 150.738 1.904 9.844 1.00 0.00 C ATOM 908 C TYR A 56 151.284 1.473 8.490 1.00 0.00 C ATOM 909 O TYR A 56 151.620 2.308 7.648 1.00 0.00 O ATOM 910 CB TYR A 56 149.482 2.760 9.657 1.00 0.00 C ATOM 911 CG TYR A 56 149.750 4.122 9.055 1.00 0.00 C ATOM 912 CD1 TYR A 56 150.163 5.184 9.850 1.00 0.00 C ATOM 913 CD2 TYR A 56 149.586 4.346 7.694 1.00 0.00 C ATOM 914 CE1 TYR A 56 150.405 6.431 9.305 1.00 0.00 C ATOM 915 CE2 TYR A 56 149.827 5.589 7.142 1.00 0.00 C ATOM 916 CZ TYR A 56 150.236 6.629 7.950 1.00 0.00 C ATOM 917 OH TYR A 56 150.475 7.869 7.403 1.00 0.00 O ATOM 0 H TYR A 56 152.625 2.773 10.127 1.00 0.00 H new ATOM 0 HA TYR A 56 150.475 1.007 10.405 1.00 0.00 H new ATOM 0 HB2 TYR A 56 148.781 2.223 9.018 1.00 0.00 H new ATOM 0 HB3 TYR A 56 148.996 2.891 10.624 1.00 0.00 H new ATOM 0 HD1 TYR A 56 150.297 5.033 10.911 1.00 0.00 H new ATOM 0 HD2 TYR A 56 149.265 3.535 7.057 1.00 0.00 H new ATOM 0 HE1 TYR A 56 150.725 7.246 9.937 1.00 0.00 H new ATOM 0 HE2 TYR A 56 149.696 5.746 6.082 1.00 0.00 H new ATOM 0 HH TYR A 56 151.154 8.336 7.934 1.00 0.00 H new ATOM 927 N GLU A 57 151.364 0.163 8.286 1.00 0.00 N ATOM 928 CA GLU A 57 151.863 -0.386 7.030 1.00 0.00 C ATOM 929 C GLU A 57 150.708 -0.865 6.165 1.00 0.00 C ATOM 930 O GLU A 57 149.920 -1.716 6.579 1.00 0.00 O ATOM 931 CB GLU A 57 152.839 -1.534 7.292 1.00 0.00 C ATOM 932 CG GLU A 57 153.826 -1.249 8.414 1.00 0.00 C ATOM 933 CD GLU A 57 154.698 -2.445 8.739 1.00 0.00 C ATOM 934 OE1 GLU A 57 155.752 -2.605 8.089 1.00 0.00 O ATOM 935 OE2 GLU A 57 154.327 -3.223 9.644 1.00 0.00 O ATOM 0 H GLU A 57 151.090 -0.539 8.974 1.00 0.00 H new ATOM 0 HA GLU A 57 152.394 0.404 6.499 1.00 0.00 H new ATOM 0 HB2 GLU A 57 152.273 -2.433 7.537 1.00 0.00 H new ATOM 0 HB3 GLU A 57 153.393 -1.745 6.377 1.00 0.00 H new ATOM 0 HG2 GLU A 57 154.459 -0.408 8.131 1.00 0.00 H new ATOM 0 HG3 GLU A 57 153.278 -0.949 9.308 1.00 0.00 H new ATOM 942 N TYR A 58 150.603 -0.303 4.967 1.00 0.00 N ATOM 943 CA TYR A 58 149.529 -0.663 4.051 1.00 0.00 C ATOM 944 C TYR A 58 150.060 -1.346 2.795 1.00 0.00 C ATOM 945 O TYR A 58 150.784 -0.743 2.003 1.00 0.00 O ATOM 946 CB TYR A 58 148.731 0.583 3.666 1.00 0.00 C ATOM 947 CG TYR A 58 147.232 0.378 3.700 1.00 0.00 C ATOM 948 CD1 TYR A 58 146.661 -0.794 3.221 1.00 0.00 C ATOM 949 CD2 TYR A 58 146.391 1.357 4.214 1.00 0.00 C ATOM 950 CE1 TYR A 58 145.293 -0.986 3.253 1.00 0.00 C ATOM 951 CE2 TYR A 58 145.022 1.172 4.249 1.00 0.00 C ATOM 952 CZ TYR A 58 144.478 0.001 3.766 1.00 0.00 C ATOM 953 OH TYR A 58 143.113 -0.186 3.802 1.00 0.00 O ATOM 0 H TYR A 58 151.247 0.402 4.608 1.00 0.00 H new ATOM 0 HA TYR A 58 148.879 -1.371 4.566 1.00 0.00 H new ATOM 0 HB2 TYR A 58 148.993 1.396 4.343 1.00 0.00 H new ATOM 0 HB3 TYR A 58 149.024 0.896 2.664 1.00 0.00 H new ATOM 0 HD1 TYR A 58 147.297 -1.568 2.817 1.00 0.00 H new ATOM 0 HD2 TYR A 58 146.813 2.276 4.592 1.00 0.00 H new ATOM 0 HE1 TYR A 58 144.865 -1.904 2.878 1.00 0.00 H new ATOM 0 HE2 TYR A 58 144.381 1.942 4.653 1.00 0.00 H new ATOM 0 HH TYR A 58 142.832 -0.700 3.016 1.00 0.00 H new ATOM 963 N GLN A 59 149.671 -2.602 2.611 1.00 0.00 N ATOM 964 CA GLN A 59 150.078 -3.375 1.445 1.00 0.00 C ATOM 965 C GLN A 59 148.847 -3.782 0.646 1.00 0.00 C ATOM 966 O GLN A 59 148.006 -4.536 1.136 1.00 0.00 O ATOM 967 CB GLN A 59 150.863 -4.618 1.871 1.00 0.00 C ATOM 968 CG GLN A 59 152.253 -4.308 2.401 1.00 0.00 C ATOM 969 CD GLN A 59 152.663 -5.231 3.533 1.00 0.00 C ATOM 970 OE1 GLN A 59 152.392 -6.432 3.499 1.00 0.00 O ATOM 971 NE2 GLN A 59 153.319 -4.674 4.544 1.00 0.00 N ATOM 0 H GLN A 59 149.070 -3.109 3.260 1.00 0.00 H new ATOM 0 HA GLN A 59 150.725 -2.758 0.822 1.00 0.00 H new ATOM 0 HB2 GLN A 59 150.300 -5.147 2.640 1.00 0.00 H new ATOM 0 HB3 GLN A 59 150.950 -5.292 1.019 1.00 0.00 H new ATOM 0 HG2 GLN A 59 152.975 -4.392 1.589 1.00 0.00 H new ATOM 0 HG3 GLN A 59 152.284 -3.276 2.749 1.00 0.00 H new ATOM 0 HE21 GLN A 59 153.523 -3.675 4.531 1.00 0.00 H new ATOM 0 HE22 GLN A 59 153.619 -5.245 5.334 1.00 0.00 H new ATOM 980 N LEU A 60 148.729 -3.271 -0.575 1.00 0.00 N ATOM 981 CA LEU A 60 147.580 -3.582 -1.406 1.00 0.00 C ATOM 982 C LEU A 60 147.980 -3.979 -2.823 1.00 0.00 C ATOM 983 O LEU A 60 149.094 -3.706 -3.266 1.00 0.00 O ATOM 984 CB LEU A 60 146.616 -2.395 -1.450 1.00 0.00 C ATOM 985 CG LEU A 60 145.145 -2.748 -1.216 1.00 0.00 C ATOM 986 CD1 LEU A 60 144.700 -2.315 0.174 1.00 0.00 C ATOM 987 CD2 LEU A 60 144.261 -2.115 -2.284 1.00 0.00 C ATOM 0 H LEU A 60 149.410 -2.645 -1.005 1.00 0.00 H new ATOM 0 HA LEU A 60 147.082 -4.439 -0.953 1.00 0.00 H new ATOM 0 HB2 LEU A 60 146.924 -1.668 -0.698 1.00 0.00 H new ATOM 0 HB3 LEU A 60 146.707 -1.908 -2.421 1.00 0.00 H new ATOM 0 HG LEU A 60 145.042 -3.831 -1.285 1.00 0.00 H new ATOM 0 HD11 LEU A 60 143.652 -2.576 0.318 1.00 0.00 H new ATOM 0 HD12 LEU A 60 145.307 -2.822 0.925 1.00 0.00 H new ATOM 0 HD13 LEU A 60 144.823 -1.237 0.276 1.00 0.00 H new ATOM 0 HD21 LEU A 60 143.220 -2.379 -2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 60 144.372 -1.031 -2.252 1.00 0.00 H new ATOM 0 HD23 LEU A 60 144.558 -2.482 -3.267 1.00 0.00 H new ATOM 999 N TYR A 61 147.049 -4.619 -3.529 1.00 0.00 N ATOM 1000 CA TYR A 61 147.283 -5.050 -4.901 1.00 0.00 C ATOM 1001 C TYR A 61 146.351 -4.300 -5.846 1.00 0.00 C ATOM 1002 O TYR A 61 145.208 -4.706 -6.058 1.00 0.00 O ATOM 1003 CB TYR A 61 147.059 -6.557 -5.023 1.00 0.00 C ATOM 1004 CG TYR A 61 148.275 -7.382 -4.661 1.00 0.00 C ATOM 1005 CD1 TYR A 61 148.594 -7.637 -3.333 1.00 0.00 C ATOM 1006 CD2 TYR A 61 149.101 -7.907 -5.646 1.00 0.00 C ATOM 1007 CE1 TYR A 61 149.702 -8.392 -2.998 1.00 0.00 C ATOM 1008 CE2 TYR A 61 150.210 -8.665 -5.319 1.00 0.00 C ATOM 1009 CZ TYR A 61 150.506 -8.903 -3.993 1.00 0.00 C ATOM 1010 OH TYR A 61 151.610 -9.655 -3.664 1.00 0.00 O ATOM 0 H TYR A 61 146.123 -4.850 -3.169 1.00 0.00 H new ATOM 0 HA TYR A 61 148.315 -4.827 -5.173 1.00 0.00 H new ATOM 0 HB2 TYR A 61 146.229 -6.846 -4.378 1.00 0.00 H new ATOM 0 HB3 TYR A 61 146.764 -6.790 -6.046 1.00 0.00 H new ATOM 0 HD1 TYR A 61 147.966 -7.239 -2.550 1.00 0.00 H new ATOM 0 HD2 TYR A 61 148.873 -7.720 -6.685 1.00 0.00 H new ATOM 0 HE1 TYR A 61 149.936 -8.581 -1.961 1.00 0.00 H new ATOM 0 HE2 TYR A 61 150.841 -9.068 -6.097 1.00 0.00 H new ATOM 0 HH TYR A 61 152.068 -9.940 -4.482 1.00 0.00 H new ATOM 1020 N VAL A 62 146.839 -3.195 -6.392 1.00 0.00 N ATOM 1021 CA VAL A 62 146.040 -2.375 -7.294 1.00 0.00 C ATOM 1022 C VAL A 62 145.910 -3.013 -8.674 1.00 0.00 C ATOM 1023 O VAL A 62 146.781 -2.847 -9.528 1.00 0.00 O ATOM 1024 CB VAL A 62 146.633 -0.958 -7.439 1.00 0.00 C ATOM 1025 CG1 VAL A 62 148.063 -1.019 -7.955 1.00 0.00 C ATOM 1026 CG2 VAL A 62 145.763 -0.101 -8.350 1.00 0.00 C ATOM 0 H VAL A 62 147.783 -2.845 -6.227 1.00 0.00 H new ATOM 0 HA VAL A 62 145.047 -2.302 -6.849 1.00 0.00 H new ATOM 0 HB VAL A 62 146.651 -0.495 -6.453 1.00 0.00 H new ATOM 0 HG11 VAL A 62 148.459 -0.008 -8.049 1.00 0.00 H new ATOM 0 HG12 VAL A 62 148.678 -1.586 -7.256 1.00 0.00 H new ATOM 0 HG13 VAL A 62 148.078 -1.506 -8.930 1.00 0.00 H new ATOM 0 HG21 VAL A 62 146.199 0.894 -8.439 1.00 0.00 H new ATOM 0 HG22 VAL A 62 145.705 -0.561 -9.336 1.00 0.00 H new ATOM 0 HG23 VAL A 62 144.761 -0.022 -7.928 1.00 0.00 H new ATOM 1036 N TYR A 63 144.809 -3.727 -8.892 1.00 0.00 N ATOM 1037 CA TYR A 63 144.564 -4.368 -10.179 1.00 0.00 C ATOM 1038 C TYR A 63 144.025 -3.350 -11.176 1.00 0.00 C ATOM 1039 O TYR A 63 142.829 -3.319 -11.469 1.00 0.00 O ATOM 1040 CB TYR A 63 143.581 -5.531 -10.025 1.00 0.00 C ATOM 1041 CG TYR A 63 143.472 -6.401 -11.256 1.00 0.00 C ATOM 1042 CD1 TYR A 63 144.321 -7.485 -11.440 1.00 0.00 C ATOM 1043 CD2 TYR A 63 142.520 -6.141 -12.233 1.00 0.00 C ATOM 1044 CE1 TYR A 63 144.226 -8.284 -12.565 1.00 0.00 C ATOM 1045 CE2 TYR A 63 142.418 -6.934 -13.360 1.00 0.00 C ATOM 1046 CZ TYR A 63 143.273 -8.004 -13.520 1.00 0.00 C ATOM 1047 OH TYR A 63 143.174 -8.797 -14.641 1.00 0.00 O ATOM 0 H TYR A 63 144.076 -3.875 -8.198 1.00 0.00 H new ATOM 0 HA TYR A 63 145.508 -4.764 -10.553 1.00 0.00 H new ATOM 0 HB2 TYR A 63 143.891 -6.148 -9.181 1.00 0.00 H new ATOM 0 HB3 TYR A 63 142.595 -5.133 -9.784 1.00 0.00 H new ATOM 0 HD1 TYR A 63 145.068 -7.708 -10.692 1.00 0.00 H new ATOM 0 HD2 TYR A 63 141.848 -5.305 -12.110 1.00 0.00 H new ATOM 0 HE1 TYR A 63 144.895 -9.122 -12.694 1.00 0.00 H new ATOM 0 HE2 TYR A 63 141.673 -6.717 -14.111 1.00 0.00 H new ATOM 0 HH TYR A 63 142.452 -8.465 -15.214 1.00 0.00 H new ATOM 1057 N ALA A 64 144.915 -2.506 -11.686 1.00 0.00 N ATOM 1058 CA ALA A 64 144.526 -1.474 -12.638 1.00 0.00 C ATOM 1059 C ALA A 64 144.393 -2.037 -14.047 1.00 0.00 C ATOM 1060 O ALA A 64 144.632 -3.222 -14.279 1.00 0.00 O ATOM 1061 CB ALA A 64 145.530 -0.332 -12.614 1.00 0.00 C ATOM 0 H ALA A 64 145.909 -2.517 -11.456 1.00 0.00 H new ATOM 0 HA ALA A 64 143.549 -1.094 -12.340 1.00 0.00 H new ATOM 0 HB1 ALA A 64 145.228 0.433 -13.330 1.00 0.00 H new ATOM 0 HB2 ALA A 64 145.565 0.100 -11.614 1.00 0.00 H new ATOM 0 HB3 ALA A 64 146.517 -0.710 -12.881 1.00 0.00 H new ATOM 1067 N SER A 65 144.011 -1.176 -14.984 1.00 0.00 N ATOM 1068 CA SER A 65 143.846 -1.583 -16.374 1.00 0.00 C ATOM 1069 C SER A 65 145.139 -2.179 -16.921 1.00 0.00 C ATOM 1070 O SER A 65 145.118 -3.154 -17.671 1.00 0.00 O ATOM 1071 CB SER A 65 143.418 -0.390 -17.232 1.00 0.00 C ATOM 1072 OG SER A 65 143.250 -0.768 -18.587 1.00 0.00 O ATOM 0 H SER A 65 143.810 -0.192 -14.806 1.00 0.00 H new ATOM 0 HA SER A 65 143.068 -2.346 -16.413 1.00 0.00 H new ATOM 0 HB2 SER A 65 142.484 0.021 -16.848 1.00 0.00 H new ATOM 0 HB3 SER A 65 144.167 0.399 -17.162 1.00 0.00 H new ATOM 0 HG SER A 65 142.975 0.012 -19.113 1.00 0.00 H new ATOM 1078 N ASP A 66 146.265 -1.585 -16.535 1.00 0.00 N ATOM 1079 CA ASP A 66 147.569 -2.053 -16.981 1.00 0.00 C ATOM 1080 C ASP A 66 147.765 -3.522 -16.651 1.00 0.00 C ATOM 1081 O ASP A 66 148.042 -4.342 -17.525 1.00 0.00 O ATOM 1082 CB ASP A 66 148.680 -1.219 -16.342 1.00 0.00 C ATOM 1083 CG ASP A 66 149.871 -1.038 -17.263 1.00 0.00 C ATOM 1084 OD1 ASP A 66 149.676 -0.541 -18.392 1.00 0.00 O ATOM 1085 OD2 ASP A 66 150.996 -1.393 -16.854 1.00 0.00 O ATOM 0 H ASP A 66 146.298 -0.777 -15.913 1.00 0.00 H new ATOM 0 HA ASP A 66 147.615 -1.937 -18.064 1.00 0.00 H new ATOM 0 HB2 ASP A 66 148.284 -0.241 -16.068 1.00 0.00 H new ATOM 0 HB3 ASP A 66 149.007 -1.700 -15.420 1.00 0.00 H new ATOM 1090 N LYS A 67 147.617 -3.833 -15.380 1.00 0.00 N ATOM 1091 CA LYS A 67 147.771 -5.199 -14.891 1.00 0.00 C ATOM 1092 C LYS A 67 147.543 -5.272 -13.382 1.00 0.00 C ATOM 1093 O LYS A 67 147.147 -4.288 -12.753 1.00 0.00 O ATOM 1094 CB LYS A 67 149.164 -5.730 -15.234 1.00 0.00 C ATOM 1095 CG LYS A 67 149.196 -6.580 -16.493 1.00 0.00 C ATOM 1096 CD LYS A 67 149.573 -8.021 -16.190 1.00 0.00 C ATOM 1097 CE LYS A 67 149.232 -8.945 -17.349 1.00 0.00 C ATOM 1098 NZ LYS A 67 148.189 -9.941 -16.979 1.00 0.00 N ATOM 0 H LYS A 67 147.388 -3.154 -14.655 1.00 0.00 H new ATOM 0 HA LYS A 67 147.020 -5.819 -15.381 1.00 0.00 H new ATOM 0 HB2 LYS A 67 149.845 -4.888 -15.356 1.00 0.00 H new ATOM 0 HB3 LYS A 67 149.535 -6.321 -14.397 1.00 0.00 H new ATOM 0 HG2 LYS A 67 148.219 -6.553 -16.975 1.00 0.00 H new ATOM 0 HG3 LYS A 67 149.911 -6.158 -17.199 1.00 0.00 H new ATOM 0 HD2 LYS A 67 150.640 -8.081 -15.978 1.00 0.00 H new ATOM 0 HD3 LYS A 67 149.050 -8.353 -15.293 1.00 0.00 H new ATOM 0 HE2 LYS A 67 148.884 -8.352 -18.195 1.00 0.00 H new ATOM 0 HE3 LYS A 67 150.132 -9.466 -17.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 147.986 -10.551 -17.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 148.531 -10.524 -16.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 147.321 -9.445 -16.693 1.00 0.00 H new ATOM 1112 N LEU A 68 147.798 -6.446 -12.811 1.00 0.00 N ATOM 1113 CA LEU A 68 147.626 -6.656 -11.379 1.00 0.00 C ATOM 1114 C LEU A 68 148.763 -6.005 -10.597 1.00 0.00 C ATOM 1115 O LEU A 68 149.650 -6.689 -10.086 1.00 0.00 O ATOM 1116 CB LEU A 68 147.567 -8.153 -11.066 1.00 0.00 C ATOM 1117 CG LEU A 68 148.753 -8.970 -11.588 1.00 0.00 C ATOM 1118 CD1 LEU A 68 149.176 -10.013 -10.566 1.00 0.00 C ATOM 1119 CD2 LEU A 68 148.403 -9.630 -12.913 1.00 0.00 C ATOM 0 H LEU A 68 148.125 -7.267 -13.320 1.00 0.00 H new ATOM 0 HA LEU A 68 146.687 -6.192 -11.077 1.00 0.00 H new ATOM 0 HB2 LEU A 68 147.504 -8.281 -9.985 1.00 0.00 H new ATOM 0 HB3 LEU A 68 146.649 -8.562 -11.489 1.00 0.00 H new ATOM 0 HG LEU A 68 149.591 -8.293 -11.752 1.00 0.00 H new ATOM 0 HD11 LEU A 68 150.020 -10.583 -10.955 1.00 0.00 H new ATOM 0 HD12 LEU A 68 149.469 -9.518 -9.640 1.00 0.00 H new ATOM 0 HD13 LEU A 68 148.343 -10.687 -10.368 1.00 0.00 H new ATOM 0 HD21 LEU A 68 149.257 -10.206 -13.269 1.00 0.00 H new ATOM 0 HD22 LEU A 68 147.550 -10.294 -12.775 1.00 0.00 H new ATOM 0 HD23 LEU A 68 148.151 -8.864 -13.646 1.00 0.00 H new ATOM 1131 N PHE A 69 148.731 -4.680 -10.509 1.00 0.00 N ATOM 1132 CA PHE A 69 149.761 -3.937 -9.793 1.00 0.00 C ATOM 1133 C PHE A 69 149.610 -4.105 -8.284 1.00 0.00 C ATOM 1134 O PHE A 69 148.613 -4.643 -7.803 1.00 0.00 O ATOM 1135 CB PHE A 69 149.703 -2.454 -10.165 1.00 0.00 C ATOM 1136 CG PHE A 69 150.598 -2.089 -11.315 1.00 0.00 C ATOM 1137 CD1 PHE A 69 150.575 -2.825 -12.489 1.00 0.00 C ATOM 1138 CD2 PHE A 69 151.460 -1.009 -11.222 1.00 0.00 C ATOM 1139 CE1 PHE A 69 151.396 -2.490 -13.549 1.00 0.00 C ATOM 1140 CE2 PHE A 69 152.285 -0.670 -12.278 1.00 0.00 C ATOM 1141 CZ PHE A 69 152.253 -1.411 -13.443 1.00 0.00 C ATOM 0 H PHE A 69 148.003 -4.099 -10.924 1.00 0.00 H new ATOM 0 HA PHE A 69 150.731 -4.339 -10.086 1.00 0.00 H new ATOM 0 HB2 PHE A 69 148.676 -2.191 -10.417 1.00 0.00 H new ATOM 0 HB3 PHE A 69 149.981 -1.858 -9.295 1.00 0.00 H new ATOM 0 HD1 PHE A 69 149.908 -3.670 -12.577 1.00 0.00 H new ATOM 0 HD2 PHE A 69 151.488 -0.425 -10.314 1.00 0.00 H new ATOM 0 HE1 PHE A 69 151.368 -3.071 -14.459 1.00 0.00 H new ATOM 0 HE2 PHE A 69 152.954 0.174 -12.192 1.00 0.00 H new ATOM 0 HZ PHE A 69 152.896 -1.148 -14.270 1.00 0.00 H new ATOM 1151 N ARG A 70 150.606 -3.632 -7.544 1.00 0.00 N ATOM 1152 CA ARG A 70 150.594 -3.720 -6.098 1.00 0.00 C ATOM 1153 C ARG A 70 151.434 -2.606 -5.486 1.00 0.00 C ATOM 1154 O ARG A 70 152.549 -2.340 -5.935 1.00 0.00 O ATOM 1155 CB ARG A 70 151.110 -5.088 -5.642 1.00 0.00 C ATOM 1156 CG ARG A 70 151.170 -5.249 -4.131 1.00 0.00 C ATOM 1157 CD ARG A 70 152.389 -6.054 -3.708 1.00 0.00 C ATOM 1158 NE ARG A 70 152.646 -5.946 -2.272 1.00 0.00 N ATOM 1159 CZ ARG A 70 153.810 -6.245 -1.703 1.00 0.00 C ATOM 1160 NH1 ARG A 70 154.828 -6.671 -2.441 1.00 0.00 N ATOM 1161 NH2 ARG A 70 153.959 -6.119 -0.391 1.00 0.00 N ATOM 0 H ARG A 70 151.436 -3.181 -7.930 1.00 0.00 H new ATOM 0 HA ARG A 70 149.566 -3.604 -5.755 1.00 0.00 H new ATOM 0 HB2 ARG A 70 150.467 -5.865 -6.056 1.00 0.00 H new ATOM 0 HB3 ARG A 70 152.106 -5.246 -6.055 1.00 0.00 H new ATOM 0 HG2 ARG A 70 151.199 -4.267 -3.660 1.00 0.00 H new ATOM 0 HG3 ARG A 70 150.265 -5.744 -3.780 1.00 0.00 H new ATOM 0 HD2 ARG A 70 152.241 -7.101 -3.972 1.00 0.00 H new ATOM 0 HD3 ARG A 70 153.262 -5.706 -4.260 1.00 0.00 H new ATOM 0 HE ARG A 70 151.888 -5.622 -1.672 1.00 0.00 H new ATOM 0 HH11 ARG A 70 154.720 -6.770 -3.450 1.00 0.00 H new ATOM 0 HH12 ARG A 70 155.718 -6.899 -1.999 1.00 0.00 H new ATOM 0 HH21 ARG A 70 153.181 -5.793 0.182 1.00 0.00 H new ATOM 0 HH22 ARG A 70 154.852 -6.348 0.045 1.00 0.00 H new ATOM 1175 N ALA A 71 150.893 -1.955 -4.461 1.00 0.00 N ATOM 1176 CA ALA A 71 151.602 -0.869 -3.799 1.00 0.00 C ATOM 1177 C ALA A 71 151.870 -1.192 -2.339 1.00 0.00 C ATOM 1178 O ALA A 71 151.167 -2.005 -1.739 1.00 0.00 O ATOM 1179 CB ALA A 71 150.818 0.428 -3.923 1.00 0.00 C ATOM 0 H ALA A 71 149.972 -2.160 -4.074 1.00 0.00 H new ATOM 0 HA ALA A 71 152.565 -0.746 -4.294 1.00 0.00 H new ATOM 0 HB1 ALA A 71 151.361 1.230 -3.423 1.00 0.00 H new ATOM 0 HB2 ALA A 71 150.691 0.677 -4.977 1.00 0.00 H new ATOM 0 HB3 ALA A 71 149.839 0.308 -3.458 1.00 0.00 H new ATOM 1185 N ASP A 72 152.890 -0.556 -1.758 1.00 0.00 N ATOM 1186 CA ASP A 72 153.215 -0.813 -0.359 1.00 0.00 C ATOM 1187 C ASP A 72 153.499 0.480 0.395 1.00 0.00 C ATOM 1188 O ASP A 72 154.176 1.377 -0.116 1.00 0.00 O ATOM 1189 CB ASP A 72 154.415 -1.754 -0.251 1.00 0.00 C ATOM 1190 CG ASP A 72 154.455 -2.491 1.072 1.00 0.00 C ATOM 1191 OD1 ASP A 72 153.939 -1.945 2.070 1.00 0.00 O ATOM 1192 OD2 ASP A 72 155.003 -3.612 1.112 1.00 0.00 O ATOM 0 H ASP A 72 153.491 0.124 -2.224 1.00 0.00 H new ATOM 0 HA ASP A 72 152.346 -1.288 0.097 1.00 0.00 H new ATOM 0 HB2 ASP A 72 154.380 -2.477 -1.066 1.00 0.00 H new ATOM 0 HB3 ASP A 72 155.334 -1.181 -0.372 1.00 0.00 H new ATOM 1197 N ILE A 73 152.977 0.560 1.617 1.00 0.00 N ATOM 1198 CA ILE A 73 153.160 1.730 2.469 1.00 0.00 C ATOM 1199 C ILE A 73 153.502 1.309 3.897 1.00 0.00 C ATOM 1200 O ILE A 73 153.033 0.275 4.375 1.00 0.00 O ATOM 1201 CB ILE A 73 151.887 2.604 2.495 1.00 0.00 C ATOM 1202 CG1 ILE A 73 151.352 2.818 1.076 1.00 0.00 C ATOM 1203 CG2 ILE A 73 152.170 3.943 3.162 1.00 0.00 C ATOM 1204 CD1 ILE A 73 149.890 3.207 1.037 1.00 0.00 C ATOM 0 H ILE A 73 152.419 -0.180 2.041 1.00 0.00 H new ATOM 0 HA ILE A 73 153.983 2.310 2.052 1.00 0.00 H new ATOM 0 HB ILE A 73 151.127 2.082 3.076 1.00 0.00 H new ATOM 0 HG12 ILE A 73 151.940 3.595 0.587 1.00 0.00 H new ATOM 0 HG13 ILE A 73 151.492 1.903 0.501 1.00 0.00 H new ATOM 0 HG21 ILE A 73 151.261 4.545 3.171 1.00 0.00 H new ATOM 0 HG22 ILE A 73 152.504 3.776 4.186 1.00 0.00 H new ATOM 0 HG23 ILE A 73 152.948 4.469 2.608 1.00 0.00 H new ATOM 0 HD11 ILE A 73 149.577 3.343 0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 73 149.292 2.420 1.497 1.00 0.00 H new ATOM 0 HD13 ILE A 73 149.747 4.139 1.584 1.00 0.00 H new ATOM 1216 N SER A 74 154.317 2.110 4.575 1.00 0.00 N ATOM 1217 CA SER A 74 154.714 1.811 5.949 1.00 0.00 C ATOM 1218 C SER A 74 155.208 3.067 6.662 1.00 0.00 C ATOM 1219 O SER A 74 156.070 3.781 6.151 1.00 0.00 O ATOM 1220 CB SER A 74 155.806 0.740 5.966 1.00 0.00 C ATOM 1221 OG SER A 74 156.824 1.034 5.025 1.00 0.00 O ATOM 0 H SER A 74 154.716 2.970 4.198 1.00 0.00 H new ATOM 0 HA SER A 74 153.838 1.436 6.478 1.00 0.00 H new ATOM 0 HB2 SER A 74 156.238 0.673 6.964 1.00 0.00 H new ATOM 0 HB3 SER A 74 155.369 -0.233 5.741 1.00 0.00 H new ATOM 0 HG SER A 74 157.511 0.335 5.057 1.00 0.00 H new ATOM 1227 N GLU A 75 154.656 3.334 7.845 1.00 0.00 N ATOM 1228 CA GLU A 75 155.048 4.506 8.615 1.00 0.00 C ATOM 1229 C GLU A 75 155.476 4.119 10.026 1.00 0.00 C ATOM 1230 O GLU A 75 155.090 3.068 10.538 1.00 0.00 O ATOM 1231 CB GLU A 75 153.898 5.512 8.674 1.00 0.00 C ATOM 1232 CG GLU A 75 153.280 5.808 7.318 1.00 0.00 C ATOM 1233 CD GLU A 75 153.145 7.293 7.047 1.00 0.00 C ATOM 1234 OE1 GLU A 75 152.970 8.059 8.018 1.00 0.00 O ATOM 1235 OE2 GLU A 75 153.215 7.691 5.865 1.00 0.00 O ATOM 0 H GLU A 75 153.940 2.756 8.286 1.00 0.00 H new ATOM 0 HA GLU A 75 155.900 4.967 8.114 1.00 0.00 H new ATOM 0 HB2 GLU A 75 153.125 5.129 9.341 1.00 0.00 H new ATOM 0 HB3 GLU A 75 154.262 6.443 9.109 1.00 0.00 H new ATOM 0 HG2 GLU A 75 153.892 5.355 6.538 1.00 0.00 H new ATOM 0 HG3 GLU A 75 152.296 5.342 7.262 1.00 0.00 H new ATOM 1242 N ASP A 76 156.270 4.982 10.651 1.00 0.00 N ATOM 1243 CA ASP A 76 156.747 4.748 11.998 1.00 0.00 C ATOM 1244 C ASP A 76 157.076 6.067 12.690 1.00 0.00 C ATOM 1245 O ASP A 76 156.964 7.138 12.091 1.00 0.00 O ATOM 1246 CB ASP A 76 157.973 3.831 11.984 1.00 0.00 C ATOM 1247 CG ASP A 76 157.642 2.417 12.419 1.00 0.00 C ATOM 1248 OD1 ASP A 76 156.871 1.741 11.705 1.00 0.00 O ATOM 1249 OD2 ASP A 76 158.153 1.985 13.474 1.00 0.00 O ATOM 0 H ASP A 76 156.596 5.855 10.237 1.00 0.00 H new ATOM 0 HA ASP A 76 155.953 4.254 12.559 1.00 0.00 H new ATOM 0 HB2 ASP A 76 158.396 3.810 10.980 1.00 0.00 H new ATOM 0 HB3 ASP A 76 158.738 4.241 12.643 1.00 0.00 H new ATOM 1342 N ARG A 82 158.746 6.276 7.430 1.00 0.00 N ATOM 1343 CA ARG A 82 157.646 6.601 6.532 1.00 0.00 C ATOM 1344 C ARG A 82 157.927 6.049 5.139 1.00 0.00 C ATOM 1345 O ARG A 82 159.068 6.062 4.680 1.00 0.00 O ATOM 1346 CB ARG A 82 157.440 8.115 6.469 1.00 0.00 C ATOM 1347 CG ARG A 82 156.422 8.630 7.476 1.00 0.00 C ATOM 1348 CD ARG A 82 156.341 10.149 7.466 1.00 0.00 C ATOM 1349 NE ARG A 82 156.578 10.718 8.791 1.00 0.00 N ATOM 1350 CZ ARG A 82 157.788 10.965 9.290 1.00 0.00 C ATOM 1351 NH1 ARG A 82 158.877 10.689 8.584 1.00 0.00 N ATOM 1352 NH2 ARG A 82 157.909 11.491 10.502 1.00 0.00 N ATOM 0 HA ARG A 82 156.734 6.142 6.915 1.00 0.00 H new ATOM 0 HB2 ARG A 82 158.395 8.611 6.643 1.00 0.00 H new ATOM 0 HB3 ARG A 82 157.117 8.389 5.465 1.00 0.00 H new ATOM 0 HG2 ARG A 82 155.441 8.212 7.249 1.00 0.00 H new ATOM 0 HG3 ARG A 82 156.692 8.286 8.475 1.00 0.00 H new ATOM 0 HD2 ARG A 82 157.074 10.547 6.764 1.00 0.00 H new ATOM 0 HD3 ARG A 82 155.358 10.457 7.109 1.00 0.00 H new ATOM 0 HE ARG A 82 155.767 10.940 9.369 1.00 0.00 H new ATOM 0 HH11 ARG A 82 158.791 10.285 7.652 1.00 0.00 H new ATOM 0 HH12 ARG A 82 159.800 10.881 8.974 1.00 0.00 H new ATOM 0 HH21 ARG A 82 157.076 11.706 11.050 1.00 0.00 H new ATOM 0 HH22 ARG A 82 158.835 11.681 10.886 1.00 0.00 H new ATOM 1366 N LYS A 83 156.889 5.558 4.468 1.00 0.00 N ATOM 1367 CA LYS A 83 157.054 5.004 3.139 1.00 0.00 C ATOM 1368 C LYS A 83 155.743 4.981 2.358 1.00 0.00 C ATOM 1369 O LYS A 83 154.655 5.036 2.927 1.00 0.00 O ATOM 1370 CB LYS A 83 157.642 3.593 3.216 1.00 0.00 C ATOM 1371 CG LYS A 83 159.164 3.564 3.177 1.00 0.00 C ATOM 1372 CD LYS A 83 159.684 2.736 2.009 1.00 0.00 C ATOM 1373 CE LYS A 83 160.824 1.825 2.435 1.00 0.00 C ATOM 1374 NZ LYS A 83 161.355 1.029 1.295 1.00 0.00 N ATOM 0 H LYS A 83 155.934 5.535 4.824 1.00 0.00 H new ATOM 0 HA LYS A 83 157.745 5.655 2.604 1.00 0.00 H new ATOM 0 HB2 LYS A 83 157.301 3.116 4.135 1.00 0.00 H new ATOM 0 HB3 LYS A 83 157.254 3.001 2.387 1.00 0.00 H new ATOM 0 HG2 LYS A 83 159.545 4.582 3.099 1.00 0.00 H new ATOM 0 HG3 LYS A 83 159.544 3.152 4.112 1.00 0.00 H new ATOM 0 HD2 LYS A 83 158.872 2.136 1.597 1.00 0.00 H new ATOM 0 HD3 LYS A 83 160.025 3.400 1.214 1.00 0.00 H new ATOM 0 HE2 LYS A 83 161.627 2.425 2.864 1.00 0.00 H new ATOM 0 HE3 LYS A 83 160.477 1.151 3.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 162.131 0.421 1.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 160.596 0.437 0.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 161.710 1.672 0.559 1.00 0.00 H new ATOM 1388 N LEU A 84 155.884 4.900 1.039 1.00 0.00 N ATOM 1389 CA LEU A 84 154.762 4.865 0.105 1.00 0.00 C ATOM 1390 C LEU A 84 155.321 4.901 -1.312 1.00 0.00 C ATOM 1391 O LEU A 84 155.568 5.974 -1.862 1.00 0.00 O ATOM 1392 CB LEU A 84 153.825 6.055 0.336 1.00 0.00 C ATOM 1393 CG LEU A 84 152.592 6.096 -0.571 1.00 0.00 C ATOM 1394 CD1 LEU A 84 151.316 6.161 0.254 1.00 0.00 C ATOM 1395 CD2 LEU A 84 152.671 7.278 -1.526 1.00 0.00 C ATOM 0 H LEU A 84 156.794 4.856 0.581 1.00 0.00 H new ATOM 0 HA LEU A 84 154.183 3.954 0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 84 153.493 6.040 1.374 1.00 0.00 H new ATOM 0 HB3 LEU A 84 154.391 6.976 0.196 1.00 0.00 H new ATOM 0 HG LEU A 84 152.571 5.178 -1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 84 150.453 6.189 -0.412 1.00 0.00 H new ATOM 0 HD12 LEU A 84 151.252 5.281 0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 84 151.327 7.059 0.872 1.00 0.00 H new ATOM 0 HD21 LEU A 84 151.786 7.291 -2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 84 152.720 8.205 -0.954 1.00 0.00 H new ATOM 0 HD23 LEU A 84 153.563 7.186 -2.146 1.00 0.00 H new ATOM 1407 N LEU A 85 155.582 3.725 -1.876 1.00 0.00 N ATOM 1408 CA LEU A 85 156.183 3.644 -3.198 1.00 0.00 C ATOM 1409 C LEU A 85 155.662 2.468 -4.015 1.00 0.00 C ATOM 1410 O LEU A 85 155.007 2.663 -5.038 1.00 0.00 O ATOM 1411 CB LEU A 85 157.692 3.500 -3.038 1.00 0.00 C ATOM 1412 CG LEU A 85 158.119 2.744 -1.779 1.00 0.00 C ATOM 1413 CD1 LEU A 85 159.296 1.827 -2.076 1.00 0.00 C ATOM 1414 CD2 LEU A 85 158.466 3.721 -0.669 1.00 0.00 C ATOM 0 H LEU A 85 155.388 2.823 -1.440 1.00 0.00 H new ATOM 0 HA LEU A 85 155.919 4.555 -3.735 1.00 0.00 H new ATOM 0 HB2 LEU A 85 158.091 2.984 -3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 85 158.141 4.493 -3.022 1.00 0.00 H new ATOM 0 HG LEU A 85 157.284 2.127 -1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 85 159.584 1.299 -1.167 1.00 0.00 H new ATOM 0 HD12 LEU A 85 159.011 1.105 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 85 160.138 2.420 -2.433 1.00 0.00 H new ATOM 0 HD21 LEU A 85 158.768 3.169 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 85 159.285 4.363 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 85 157.594 4.333 -0.437 1.00 0.00 H new ATOM 1426 N ARG A 86 155.994 1.251 -3.568 1.00 0.00 N ATOM 1427 CA ARG A 86 155.602 0.020 -4.259 1.00 0.00 C ATOM 1428 C ARG A 86 154.423 0.249 -5.191 1.00 0.00 C ATOM 1429 O ARG A 86 153.419 0.840 -4.791 1.00 0.00 O ATOM 1430 CB ARG A 86 155.272 -1.076 -3.245 1.00 0.00 C ATOM 1431 CG ARG A 86 156.226 -2.259 -3.293 1.00 0.00 C ATOM 1432 CD ARG A 86 157.256 -2.195 -2.174 1.00 0.00 C ATOM 1433 NE ARG A 86 157.230 -3.393 -1.338 1.00 0.00 N ATOM 1434 CZ ARG A 86 157.799 -4.547 -1.677 1.00 0.00 C ATOM 1435 NH1 ARG A 86 158.436 -4.666 -2.835 1.00 0.00 N ATOM 1436 NH2 ARG A 86 157.729 -5.587 -0.856 1.00 0.00 N ATOM 0 H ARG A 86 156.540 1.094 -2.721 1.00 0.00 H new ATOM 0 HA ARG A 86 156.447 -0.300 -4.868 1.00 0.00 H new ATOM 0 HB2 ARG A 86 155.288 -0.648 -2.243 1.00 0.00 H new ATOM 0 HB3 ARG A 86 154.257 -1.431 -3.424 1.00 0.00 H new ATOM 0 HG2 ARG A 86 155.660 -3.187 -3.214 1.00 0.00 H new ATOM 0 HG3 ARG A 86 156.735 -2.277 -4.256 1.00 0.00 H new ATOM 0 HD2 ARG A 86 158.251 -2.074 -2.603 1.00 0.00 H new ATOM 0 HD3 ARG A 86 157.066 -1.317 -1.556 1.00 0.00 H new ATOM 0 HE ARG A 86 156.747 -3.342 -0.441 1.00 0.00 H new ATOM 0 HH11 ARG A 86 158.491 -3.870 -3.471 1.00 0.00 H new ATOM 0 HH12 ARG A 86 158.870 -5.553 -3.089 1.00 0.00 H new ATOM 0 HH21 ARG A 86 157.239 -5.502 0.035 1.00 0.00 H new ATOM 0 HH22 ARG A 86 158.165 -6.472 -1.115 1.00 0.00 H new ATOM 1450 N PHE A 87 154.562 -0.213 -6.431 1.00 0.00 N ATOM 1451 CA PHE A 87 153.518 -0.058 -7.436 1.00 0.00 C ATOM 1452 C PHE A 87 153.812 -0.920 -8.661 1.00 0.00 C ATOM 1453 O PHE A 87 153.733 -0.451 -9.797 1.00 0.00 O ATOM 1454 CB PHE A 87 153.398 1.412 -7.848 1.00 0.00 C ATOM 1455 CG PHE A 87 151.979 1.883 -7.972 1.00 0.00 C ATOM 1456 CD1 PHE A 87 151.175 1.998 -6.851 1.00 0.00 C ATOM 1457 CD2 PHE A 87 151.448 2.211 -9.210 1.00 0.00 C ATOM 1458 CE1 PHE A 87 149.870 2.429 -6.960 1.00 0.00 C ATOM 1459 CE2 PHE A 87 150.142 2.643 -9.326 1.00 0.00 C ATOM 1460 CZ PHE A 87 149.350 2.753 -8.199 1.00 0.00 C ATOM 0 H PHE A 87 155.394 -0.701 -6.764 1.00 0.00 H new ATOM 0 HA PHE A 87 152.574 -0.386 -7.002 1.00 0.00 H new ATOM 0 HB2 PHE A 87 153.915 2.030 -7.114 1.00 0.00 H new ATOM 0 HB3 PHE A 87 153.906 1.557 -8.802 1.00 0.00 H new ATOM 0 HD1 PHE A 87 151.575 1.747 -5.880 1.00 0.00 H new ATOM 0 HD2 PHE A 87 152.063 2.128 -10.094 1.00 0.00 H new ATOM 0 HE1 PHE A 87 149.254 2.513 -6.077 1.00 0.00 H new ATOM 0 HE2 PHE A 87 149.740 2.895 -10.296 1.00 0.00 H new ATOM 0 HZ PHE A 87 148.328 3.091 -8.286 1.00 0.00 H new ATOM 1470 N ASN A 88 154.156 -2.180 -8.423 1.00 0.00 N ATOM 1471 CA ASN A 88 154.465 -3.107 -9.507 1.00 0.00 C ATOM 1472 C ASN A 88 153.453 -4.245 -9.561 1.00 0.00 C ATOM 1473 O ASN A 88 152.791 -4.549 -8.570 1.00 0.00 O ATOM 1474 CB ASN A 88 155.876 -3.672 -9.332 1.00 0.00 C ATOM 1475 CG ASN A 88 156.591 -3.863 -10.655 1.00 0.00 C ATOM 1476 OD1 ASN A 88 155.965 -3.890 -11.714 1.00 0.00 O ATOM 1477 ND2 ASN A 88 157.911 -3.996 -10.600 1.00 0.00 N ATOM 0 H ASN A 88 154.228 -2.584 -7.489 1.00 0.00 H new ATOM 0 HA ASN A 88 154.412 -2.557 -10.447 1.00 0.00 H new ATOM 0 HB2 ASN A 88 156.458 -3.000 -8.702 1.00 0.00 H new ATOM 0 HB3 ASN A 88 155.820 -4.628 -8.811 1.00 0.00 H new ATOM 0 HD21 ASN A 88 158.447 -4.127 -11.458 1.00 0.00 H new ATOM 0 HD22 ASN A 88 158.389 -3.967 -9.700 1.00 0.00 H new