USER MOD reduce.3.24.130724 H: found=0, std=0, add=662, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 662 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 57 GLN : amide:sc= -0.0343 K(o=0.58,f=-1.9!) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.616 K(o=0.58,f=-1.9) USER MOD Set 2.1: A 19 ASN : amide:sc= 1.01 K(o=-1.3,f=-3.2) USER MOD Set 2.2: A 31 GLN : amide:sc= -2.27! C(o=-1.3!,f=-3.2!) USER MOD Set 3.1: A 28 SER OG : rot -90:sc= 1.25 USER MOD Set 3.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= -0.0362 X(o=-0.036,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 171:sc= 0.566 (180deg=0.499) USER MOD Single : A 25 GLN : amide:sc= 1.12 K(o=1.1,f=-0.55) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.12) USER MOD Single : A 38 THR OG1 : rot -160:sc= -1.25 USER MOD Single : A 41 SER OG : rot -133:sc= 1.43 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 179:sc= -0.893 (180deg=-0.902) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -62:sc= -0.541 USER MOD Single : A 51 GLN : amide:sc=-0.00556 X(o=-0.0056,f=-0.017) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 154:sc= -0.0556 (180deg=-0.392) USER MOD Single : A 65 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.85) USER MOD Single : A 68 ASN : amide:sc= 0.926 K(o=0.93,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.00728 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.167 USER MOD Single : A 75 GLN : amide:sc= -0.0759 K(o=-0.076,f=-0.87) USER MOD Single : A 78 MET CE :methyl -102:sc= -0.985 (180deg=-1.96) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.58) USER MOD Single : A 90 GLN : amide:sc= -0.532 K(o=-0.53,f=-3.8!) USER MOD Single : B 358 ASN : amide:sc= -0.613 K(o=-0.61,f=-1.7) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N HIS A 17 -6.318 12.263 12.289 1.00 10.00 N ATOM 14 CA HIS A 17 -5.960 11.116 11.469 1.00 10.00 C ATOM 15 C HIS A 17 -6.991 10.874 10.371 1.00 10.00 C ATOM 16 O HIS A 17 -8.096 11.421 10.403 1.00 10.00 O ATOM 17 CB HIS A 17 -5.818 9.866 12.336 1.00 10.00 C ATOM 18 CG HIS A 17 -4.596 9.867 13.206 1.00 10.00 C ATOM 19 ND1 HIS A 17 -4.600 10.441 14.455 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.370 9.349 12.963 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.383 10.261 14.940 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.599 9.605 14.069 1.00 10.00 N ATOM 0 HA HIS A 17 -5.003 11.333 10.994 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.702 9.771 12.967 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.792 8.988 11.690 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.057 8.832 12.068 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -3.060 10.599 15.914 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.621 9.347 14.203 1.00 10.00 H new ATOM 30 N ILE A 18 -6.616 10.054 9.400 1.00 10.00 N ATOM 31 CA ILE A 18 -7.488 9.729 8.284 1.00 10.00 C ATOM 32 C ILE A 18 -7.695 8.217 8.196 1.00 10.00 C ATOM 33 O ILE A 18 -6.787 7.444 8.497 1.00 10.00 O ATOM 34 CB ILE A 18 -6.913 10.273 6.952 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.914 10.080 5.810 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.583 9.607 6.619 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.488 10.734 4.515 1.00 10.00 C ATOM 0 H ILE A 18 -5.704 9.598 9.364 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.452 10.207 8.456 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.735 11.341 7.074 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -8.056 9.013 5.639 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.880 10.486 6.112 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -5.201 10.007 5.680 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.867 9.806 7.416 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.729 8.531 6.523 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -8.245 10.556 3.751 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.374 11.807 4.670 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.538 10.311 4.189 1.00 10.00 H new ATOM 49 N ASN A 19 -8.894 7.803 7.808 1.00 10.00 N ATOM 50 CA ASN A 19 -9.220 6.386 7.694 1.00 10.00 C ATOM 51 C ASN A 19 -9.109 5.918 6.250 1.00 10.00 C ATOM 52 O ASN A 19 -9.820 6.412 5.376 1.00 10.00 O ATOM 53 CB ASN A 19 -10.642 6.126 8.203 1.00 10.00 C ATOM 54 CG ASN A 19 -10.810 6.442 9.676 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.636 5.577 10.534 1.00 10.00 O ATOM 56 ND2 ASN A 19 -11.158 7.684 9.979 1.00 10.00 N ATOM 0 H ASN A 19 -9.661 8.431 7.566 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.508 5.828 8.302 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.344 6.727 7.626 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.899 5.081 8.029 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -11.291 7.953 10.954 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.292 8.371 9.237 1.00 10.00 H new ATOM 63 N LEU A 20 -8.214 4.976 5.999 1.00 10.00 N ATOM 64 CA LEU A 20 -8.023 4.436 4.658 1.00 10.00 C ATOM 65 C LEU A 20 -8.273 2.930 4.649 1.00 10.00 C ATOM 66 O LEU A 20 -7.729 2.202 5.477 1.00 10.00 O ATOM 67 CB LEU A 20 -6.606 4.734 4.162 1.00 10.00 C ATOM 68 CG LEU A 20 -6.220 6.215 4.141 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.756 6.376 3.768 1.00 10.00 C ATOM 70 CD2 LEU A 20 -7.104 6.988 3.171 1.00 10.00 C ATOM 0 H LEU A 20 -7.605 4.567 6.708 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.739 4.914 3.989 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.897 4.199 4.794 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.499 4.333 3.154 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.371 6.623 5.141 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.498 7.435 3.758 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -4.135 5.858 4.499 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.584 5.951 2.779 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.813 8.038 3.171 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.987 6.579 2.167 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.146 6.900 3.479 1.00 10.00 H new ATOM 82 N LYS A 21 -9.097 2.469 3.719 1.00 10.00 N ATOM 83 CA LYS A 21 -9.411 1.049 3.616 1.00 10.00 C ATOM 84 C LYS A 21 -8.455 0.347 2.664 1.00 10.00 C ATOM 85 O LYS A 21 -8.333 0.726 1.496 1.00 10.00 O ATOM 86 CB LYS A 21 -10.838 0.829 3.109 1.00 10.00 C ATOM 87 CG LYS A 21 -11.916 1.583 3.871 1.00 10.00 C ATOM 88 CD LYS A 21 -13.222 1.554 3.098 1.00 10.00 C ATOM 89 CE LYS A 21 -14.331 2.279 3.832 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.312 2.873 2.888 1.00 10.00 N ATOM 0 H LYS A 21 -9.560 3.056 3.025 1.00 10.00 H new ATOM 0 HA LYS A 21 -9.311 0.632 4.618 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -10.884 1.122 2.060 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -11.062 -0.237 3.152 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -12.057 1.135 4.855 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.603 2.615 4.032 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.075 2.012 2.120 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -13.518 0.519 2.924 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -14.841 1.585 4.499 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.903 3.064 4.455 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -16.133 3.228 3.418 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -14.866 3.659 2.373 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.624 2.148 2.210 1.00 10.00 H new ATOM 104 N VAL A 22 -7.775 -0.667 3.162 1.00 10.00 N ATOM 105 CA VAL A 22 -6.859 -1.443 2.347 1.00 10.00 C ATOM 106 C VAL A 22 -7.356 -2.877 2.266 1.00 10.00 C ATOM 107 O VAL A 22 -7.247 -3.642 3.226 1.00 10.00 O ATOM 108 CB VAL A 22 -5.422 -1.417 2.902 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.466 -2.148 1.969 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.965 0.015 3.119 1.00 10.00 C ATOM 0 H VAL A 22 -7.840 -0.975 4.132 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.830 -0.995 1.354 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.417 -1.933 3.862 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.458 -2.116 2.383 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.782 -3.186 1.864 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.472 -1.666 0.991 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.948 0.017 3.511 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.989 0.552 2.171 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.629 0.505 3.831 1.00 10.00 H new ATOM 120 N ALA A 23 -7.921 -3.229 1.125 1.00 10.00 N ATOM 121 CA ALA A 23 -8.464 -4.559 0.925 1.00 10.00 C ATOM 122 C ALA A 23 -7.724 -5.288 -0.183 1.00 10.00 C ATOM 123 O ALA A 23 -7.327 -4.681 -1.179 1.00 10.00 O ATOM 124 CB ALA A 23 -9.950 -4.476 0.608 1.00 10.00 C ATOM 0 H ALA A 23 -8.016 -2.609 0.320 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.332 -5.125 1.847 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.347 -5.480 0.460 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.473 -3.998 1.436 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -10.096 -3.890 -0.300 1.00 10.00 H new ATOM 130 N GLY A 24 -7.539 -6.586 0.003 1.00 10.00 N ATOM 131 CA GLY A 24 -6.856 -7.391 -0.987 1.00 10.00 C ATOM 132 C GLY A 24 -7.823 -8.010 -1.975 1.00 10.00 C ATOM 133 O GLY A 24 -8.892 -7.462 -2.236 1.00 10.00 O ATOM 0 H GLY A 24 -7.852 -7.099 0.827 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -6.135 -6.774 -1.523 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.292 -8.179 -0.488 1.00 10.00 H new ATOM 137 N GLN A 25 -7.462 -9.167 -2.508 1.00 10.00 N ATOM 138 CA GLN A 25 -8.307 -9.861 -3.474 1.00 10.00 C ATOM 139 C GLN A 25 -9.167 -10.914 -2.779 1.00 10.00 C ATOM 140 O GLN A 25 -9.770 -11.774 -3.424 1.00 10.00 O ATOM 141 CB GLN A 25 -7.446 -10.516 -4.559 1.00 10.00 C ATOM 142 CG GLN A 25 -6.600 -9.528 -5.348 1.00 10.00 C ATOM 143 CD GLN A 25 -7.434 -8.534 -6.133 1.00 10.00 C ATOM 144 OE1 GLN A 25 -8.530 -8.849 -6.595 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.922 -7.324 -6.283 1.00 10.00 N ATOM 0 H GLN A 25 -6.589 -9.647 -2.289 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.966 -9.129 -3.941 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.790 -11.252 -4.095 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -8.095 -11.057 -5.248 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.948 -8.987 -4.662 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -5.955 -10.076 -6.035 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -6.010 -7.103 -5.884 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -7.440 -6.611 -6.798 1.00 10.00 H new ATOM 154 N ASP A 26 -9.213 -10.847 -1.459 1.00 10.00 N ATOM 155 CA ASP A 26 -9.993 -11.789 -0.671 1.00 10.00 C ATOM 156 C ASP A 26 -11.134 -11.081 0.064 1.00 10.00 C ATOM 157 O ASP A 26 -12.147 -10.740 -0.548 1.00 10.00 O ATOM 158 CB ASP A 26 -9.089 -12.561 0.308 1.00 10.00 C ATOM 159 CG ASP A 26 -8.145 -11.668 1.094 1.00 10.00 C ATOM 160 OD1 ASP A 26 -7.067 -11.321 0.572 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.482 -11.311 2.240 1.00 10.00 O ATOM 0 H ASP A 26 -8.717 -10.147 -0.908 1.00 10.00 H new ATOM 0 HA ASP A 26 -10.441 -12.512 -1.353 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.715 -13.118 1.006 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -8.504 -13.293 -0.250 1.00 10.00 H new ATOM 166 N GLY A 27 -10.974 -10.863 1.364 1.00 10.00 N ATOM 167 CA GLY A 27 -12.004 -10.203 2.138 1.00 10.00 C ATOM 168 C GLY A 27 -11.446 -9.409 3.304 1.00 10.00 C ATOM 169 O GLY A 27 -12.202 -8.888 4.119 1.00 10.00 O ATOM 0 H GLY A 27 -10.146 -11.133 1.896 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.569 -9.536 1.487 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.704 -10.949 2.514 1.00 10.00 H new ATOM 173 N SER A 28 -10.128 -9.321 3.398 1.00 10.00 N ATOM 174 CA SER A 28 -9.499 -8.574 4.474 1.00 10.00 C ATOM 175 C SER A 28 -9.586 -7.077 4.199 1.00 10.00 C ATOM 176 O SER A 28 -9.118 -6.603 3.161 1.00 10.00 O ATOM 177 CB SER A 28 -8.038 -9.001 4.633 1.00 10.00 C ATOM 178 OG SER A 28 -7.416 -9.187 3.370 1.00 10.00 O ATOM 0 H SER A 28 -9.476 -9.756 2.745 1.00 10.00 H new ATOM 0 HA SER A 28 -10.027 -8.789 5.403 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.495 -8.245 5.201 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.987 -9.927 5.206 1.00 10.00 H new ATOM 0 HG SER A 28 -7.532 -10.116 3.082 1.00 10.00 H new ATOM 184 N VAL A 29 -10.204 -6.335 5.113 1.00 10.00 N ATOM 185 CA VAL A 29 -10.336 -4.894 4.939 1.00 10.00 C ATOM 186 C VAL A 29 -9.743 -4.164 6.134 1.00 10.00 C ATOM 187 O VAL A 29 -10.447 -3.834 7.085 1.00 10.00 O ATOM 188 CB VAL A 29 -11.808 -4.453 4.755 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.873 -3.016 4.260 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.542 -5.377 3.794 1.00 10.00 C ATOM 0 H VAL A 29 -10.616 -6.702 5.971 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.792 -4.635 4.030 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.301 -4.514 5.725 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.915 -2.721 4.136 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.394 -2.359 4.986 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -11.357 -2.937 3.303 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.574 -5.043 3.684 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -12.049 -5.357 2.822 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.530 -6.394 4.186 1.00 10.00 H new ATOM 200 N VAL A 30 -8.445 -3.926 6.088 1.00 10.00 N ATOM 201 CA VAL A 30 -7.774 -3.243 7.180 1.00 10.00 C ATOM 202 C VAL A 30 -8.000 -1.737 7.086 1.00 10.00 C ATOM 203 O VAL A 30 -8.071 -1.171 5.988 1.00 10.00 O ATOM 204 CB VAL A 30 -6.264 -3.562 7.216 1.00 10.00 C ATOM 205 CG1 VAL A 30 -6.046 -5.056 7.393 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.567 -3.068 5.961 1.00 10.00 C ATOM 0 H VAL A 30 -7.838 -4.193 5.313 1.00 10.00 H new ATOM 0 HA VAL A 30 -8.208 -3.608 8.111 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.828 -3.039 8.067 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.977 -5.267 7.417 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.501 -5.382 8.328 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.503 -5.592 6.561 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.505 -3.307 6.016 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -6.003 -3.553 5.088 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.692 -1.988 5.877 1.00 10.00 H new ATOM 216 N GLN A 31 -8.127 -1.100 8.238 1.00 10.00 N ATOM 217 CA GLN A 31 -8.361 0.333 8.300 1.00 10.00 C ATOM 218 C GLN A 31 -7.095 1.052 8.743 1.00 10.00 C ATOM 219 O GLN A 31 -6.703 0.991 9.910 1.00 10.00 O ATOM 220 CB GLN A 31 -9.507 0.643 9.273 1.00 10.00 C ATOM 221 CG GLN A 31 -9.990 2.086 9.217 1.00 10.00 C ATOM 222 CD GLN A 31 -11.169 2.275 8.281 1.00 10.00 C ATOM 223 OE1 GLN A 31 -11.359 1.516 7.332 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.973 3.289 8.549 1.00 10.00 N ATOM 0 H GLN A 31 -8.072 -1.556 9.149 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.638 0.684 7.306 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.345 -0.019 9.055 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.179 0.419 10.288 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -10.272 2.409 10.219 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.169 2.727 8.894 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -11.780 3.896 9.346 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.786 3.465 7.959 1.00 10.00 H new ATOM 233 N PHE A 32 -6.444 1.716 7.810 1.00 10.00 N ATOM 234 CA PHE A 32 -5.230 2.445 8.112 1.00 10.00 C ATOM 235 C PHE A 32 -5.565 3.850 8.579 1.00 10.00 C ATOM 236 O PHE A 32 -5.973 4.696 7.789 1.00 10.00 O ATOM 237 CB PHE A 32 -4.314 2.494 6.891 1.00 10.00 C ATOM 238 CG PHE A 32 -3.304 1.384 6.866 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.586 0.187 6.233 1.00 10.00 C ATOM 240 CD2 PHE A 32 -2.075 1.535 7.486 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.662 -0.839 6.212 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.145 0.512 7.469 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.441 -0.676 6.833 1.00 10.00 C ATOM 0 H PHE A 32 -6.736 1.766 6.834 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.705 1.925 8.913 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.921 2.445 5.987 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.793 3.451 6.874 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.542 0.053 5.749 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.840 2.462 7.988 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.895 -1.767 5.711 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.188 0.643 7.953 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.717 -1.478 6.821 1.00 10.00 H new ATOM 253 N LYS A 33 -5.405 4.085 9.869 1.00 10.00 N ATOM 254 CA LYS A 33 -5.687 5.387 10.444 1.00 10.00 C ATOM 255 C LYS A 33 -4.378 6.135 10.665 1.00 10.00 C ATOM 256 O LYS A 33 -3.855 6.200 11.778 1.00 10.00 O ATOM 257 CB LYS A 33 -6.461 5.238 11.759 1.00 10.00 C ATOM 258 CG LYS A 33 -7.037 6.543 12.279 1.00 10.00 C ATOM 259 CD LYS A 33 -7.883 6.327 13.523 1.00 10.00 C ATOM 260 CE LYS A 33 -8.508 7.629 13.995 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.429 7.424 15.142 1.00 10.00 N ATOM 0 H LYS A 33 -5.080 3.389 10.540 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.310 5.959 9.756 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.273 4.525 11.614 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.798 4.817 12.515 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -6.225 7.234 12.506 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.644 7.008 11.502 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.667 5.600 13.311 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -7.266 5.908 14.318 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.720 8.325 14.283 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -9.053 8.088 13.171 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.832 8.338 15.431 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -10.196 6.780 14.861 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.904 7.010 15.939 1.00 10.00 H new ATOM 275 N ILE A 34 -3.841 6.671 9.584 1.00 10.00 N ATOM 276 CA ILE A 34 -2.584 7.396 9.629 1.00 10.00 C ATOM 277 C ILE A 34 -2.820 8.887 9.437 1.00 10.00 C ATOM 278 O ILE A 34 -3.964 9.340 9.398 1.00 10.00 O ATOM 279 CB ILE A 34 -1.601 6.885 8.550 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.212 7.020 7.149 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.221 5.440 8.829 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.230 6.751 6.026 1.00 10.00 C ATOM 0 H ILE A 34 -4.261 6.617 8.656 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.142 7.224 10.610 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.700 7.497 8.587 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -3.050 6.329 7.060 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.615 8.026 7.034 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.529 5.091 8.063 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.744 5.371 9.807 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.117 4.819 8.818 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.734 6.865 5.066 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.403 7.459 6.088 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.845 5.735 6.115 1.00 10.00 H new ATOM 294 N LYS A 35 -1.744 9.650 9.338 1.00 10.00 N ATOM 295 CA LYS A 35 -1.859 11.088 9.143 1.00 10.00 C ATOM 296 C LYS A 35 -1.860 11.409 7.654 1.00 10.00 C ATOM 297 O LYS A 35 -1.370 10.623 6.840 1.00 10.00 O ATOM 298 CB LYS A 35 -0.726 11.828 9.857 1.00 10.00 C ATOM 299 CG LYS A 35 -0.696 11.576 11.354 1.00 10.00 C ATOM 300 CD LYS A 35 0.318 12.462 12.056 1.00 10.00 C ATOM 301 CE LYS A 35 0.396 12.149 13.541 1.00 10.00 C ATOM 302 NZ LYS A 35 1.230 13.135 14.276 1.00 10.00 N ATOM 0 H LYS A 35 -0.787 9.302 9.389 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.800 11.425 9.576 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.227 11.523 9.425 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.830 12.898 9.677 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -1.686 11.755 11.772 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -0.455 10.530 11.541 1.00 10.00 H new ATOM 0 HD2 LYS A 35 1.299 12.324 11.602 1.00 10.00 H new ATOM 0 HD3 LYS A 35 0.046 13.508 11.917 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -0.609 12.139 13.962 1.00 10.00 H new ATOM 0 HE3 LYS A 35 0.810 11.150 13.679 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 1.256 12.884 15.285 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 2.196 13.127 13.892 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.822 14.085 14.166 1.00 10.00 H new ATOM 316 N ARG A 36 -2.400 12.567 7.296 1.00 10.00 N ATOM 317 CA ARG A 36 -2.480 12.974 5.897 1.00 10.00 C ATOM 318 C ARG A 36 -1.094 13.234 5.311 1.00 10.00 C ATOM 319 O ARG A 36 -0.913 13.223 4.094 1.00 10.00 O ATOM 320 CB ARG A 36 -3.353 14.221 5.747 1.00 10.00 C ATOM 321 CG ARG A 36 -4.706 14.100 6.430 1.00 10.00 C ATOM 322 CD ARG A 36 -5.733 15.038 5.818 1.00 10.00 C ATOM 323 NE ARG A 36 -6.403 14.441 4.662 1.00 10.00 N ATOM 324 CZ ARG A 36 -7.695 14.621 4.377 1.00 10.00 C ATOM 325 NH1 ARG A 36 -8.442 15.428 5.125 1.00 10.00 N ATOM 326 NH2 ARG A 36 -8.237 14.009 3.333 1.00 10.00 N ATOM 0 H ARG A 36 -2.789 13.242 7.954 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.935 12.153 5.343 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -2.822 15.079 6.160 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.507 14.422 4.687 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.061 13.072 6.353 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.598 14.322 7.492 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.476 15.302 6.571 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.243 15.963 5.515 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.851 13.853 4.038 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -8.028 15.913 5.921 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -9.428 15.562 4.902 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -7.667 13.400 2.746 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -9.224 14.147 3.117 1.00 10.00 H new ATOM 340 N HIS A 37 -0.119 13.445 6.184 1.00 10.00 N ATOM 341 CA HIS A 37 1.248 13.709 5.751 1.00 10.00 C ATOM 342 C HIS A 37 2.150 12.506 6.017 1.00 10.00 C ATOM 343 O HIS A 37 3.370 12.639 6.114 1.00 10.00 O ATOM 344 CB HIS A 37 1.807 14.967 6.434 1.00 10.00 C ATOM 345 CG HIS A 37 1.422 15.114 7.878 1.00 10.00 C ATOM 346 ND1 HIS A 37 2.189 14.578 8.883 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.361 15.752 8.423 1.00 10.00 C ATOM 348 CE1 HIS A 37 1.580 14.902 10.010 1.00 10.00 C ATOM 349 NE2 HIS A 37 0.469 15.613 9.781 1.00 10.00 N ATOM 0 H HIS A 37 -0.248 13.439 7.196 1.00 10.00 H new ATOM 0 HA HIS A 37 1.228 13.886 4.676 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.894 14.952 6.361 1.00 10.00 H new ATOM 0 HB3 HIS A 37 1.463 15.845 5.888 1.00 10.00 H new ATOM 0 HD2 HIS A 37 -0.421 16.271 7.889 1.00 10.00 H new ATOM 0 HE1 HIS A 37 1.934 14.628 10.993 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -0.173 15.980 10.483 1.00 10.00 H new ATOM 357 N THR A 38 1.545 11.334 6.144 1.00 10.00 N ATOM 358 CA THR A 38 2.293 10.107 6.368 1.00 10.00 C ATOM 359 C THR A 38 2.513 9.383 5.038 1.00 10.00 C ATOM 360 O THR A 38 1.551 9.008 4.369 1.00 10.00 O ATOM 361 CB THR A 38 1.561 9.174 7.358 1.00 10.00 C ATOM 362 OG1 THR A 38 1.373 9.848 8.609 1.00 10.00 O ATOM 363 CG2 THR A 38 2.342 7.885 7.589 1.00 10.00 C ATOM 0 H THR A 38 0.534 11.208 6.095 1.00 10.00 H new ATOM 0 HA THR A 38 3.256 10.373 6.804 1.00 10.00 H new ATOM 0 HB THR A 38 0.595 8.915 6.925 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.210 9.188 9.315 1.00 10.00 H new ATOM 0 HG21 THR A 38 1.799 7.251 8.290 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.463 7.358 6.642 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.323 8.123 8.000 1.00 10.00 H new ATOM 371 N PRO A 39 3.784 9.216 4.628 1.00 10.00 N ATOM 372 CA PRO A 39 4.141 8.550 3.368 1.00 10.00 C ATOM 373 C PRO A 39 3.459 7.196 3.196 1.00 10.00 C ATOM 374 O PRO A 39 3.528 6.332 4.075 1.00 10.00 O ATOM 375 CB PRO A 39 5.657 8.376 3.475 1.00 10.00 C ATOM 376 CG PRO A 39 6.097 9.471 4.380 1.00 10.00 C ATOM 377 CD PRO A 39 4.978 9.672 5.364 1.00 10.00 C ATOM 0 HA PRO A 39 3.821 9.131 2.503 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.916 7.398 3.881 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.135 8.453 2.498 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.023 9.206 4.891 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.292 10.385 3.820 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.134 9.092 6.273 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.890 10.716 5.663 1.00 10.00 H new ATOM 385 N LEU A 40 2.821 7.012 2.043 1.00 10.00 N ATOM 386 CA LEU A 40 2.116 5.772 1.740 1.00 10.00 C ATOM 387 C LEU A 40 3.088 4.610 1.591 1.00 10.00 C ATOM 388 O LEU A 40 2.689 3.445 1.600 1.00 10.00 O ATOM 389 CB LEU A 40 1.281 5.931 0.469 1.00 10.00 C ATOM 390 CG LEU A 40 0.088 6.878 0.595 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.495 7.183 -0.775 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.976 6.280 1.504 1.00 10.00 C ATOM 0 H LEU A 40 2.779 7.710 1.301 1.00 10.00 H new ATOM 0 HA LEU A 40 1.450 5.551 2.574 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.929 6.291 -0.331 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.916 4.949 0.167 1.00 10.00 H new ATOM 0 HG LEU A 40 0.435 7.811 1.039 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.344 7.859 -0.667 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.266 7.653 -1.398 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -0.826 6.256 -1.244 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.817 6.969 1.581 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.319 5.333 1.088 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.554 6.110 2.495 1.00 10.00 H new ATOM 404 N SER A 41 4.365 4.936 1.467 1.00 10.00 N ATOM 405 CA SER A 41 5.409 3.937 1.338 1.00 10.00 C ATOM 406 C SER A 41 5.434 3.039 2.570 1.00 10.00 C ATOM 407 O SER A 41 5.563 1.818 2.468 1.00 10.00 O ATOM 408 CB SER A 41 6.752 4.639 1.171 1.00 10.00 C ATOM 409 OG SER A 41 6.608 6.033 1.403 1.00 10.00 O ATOM 0 H SER A 41 4.704 5.898 1.453 1.00 10.00 H new ATOM 0 HA SER A 41 5.212 3.316 0.464 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.479 4.220 1.867 1.00 10.00 H new ATOM 0 HB3 SER A 41 7.138 4.468 0.166 1.00 10.00 H new ATOM 0 HG SER A 41 7.061 6.532 0.691 1.00 10.00 H new ATOM 415 N LYS A 42 5.279 3.658 3.736 1.00 10.00 N ATOM 416 CA LYS A 42 5.281 2.928 4.993 1.00 10.00 C ATOM 417 C LYS A 42 3.966 2.182 5.168 1.00 10.00 C ATOM 418 O LYS A 42 3.905 1.160 5.850 1.00 10.00 O ATOM 419 CB LYS A 42 5.530 3.879 6.164 1.00 10.00 C ATOM 420 CG LYS A 42 6.770 4.738 5.977 1.00 10.00 C ATOM 421 CD LYS A 42 7.458 5.040 7.298 1.00 10.00 C ATOM 422 CE LYS A 42 8.723 5.856 7.085 1.00 10.00 C ATOM 423 NZ LYS A 42 9.517 5.998 8.333 1.00 10.00 N ATOM 0 H LYS A 42 5.150 4.665 3.834 1.00 10.00 H new ATOM 0 HA LYS A 42 6.090 2.198 4.974 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.662 4.526 6.291 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.631 3.299 7.081 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.468 4.228 5.313 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.493 5.673 5.490 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.776 5.585 7.950 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.705 4.107 7.804 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.335 5.380 6.319 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.457 6.845 6.711 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.370 6.561 8.140 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.943 6.476 9.057 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 9.795 5.057 8.677 1.00 10.00 H new ATOM 437 N LEU A 43 2.917 2.695 4.534 1.00 10.00 N ATOM 438 CA LEU A 43 1.603 2.066 4.586 1.00 10.00 C ATOM 439 C LEU A 43 1.642 0.757 3.810 1.00 10.00 C ATOM 440 O LEU A 43 1.176 -0.279 4.285 1.00 10.00 O ATOM 441 CB LEU A 43 0.538 3.008 4.002 1.00 10.00 C ATOM 442 CG LEU A 43 -0.883 2.435 3.912 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.908 3.521 4.197 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.138 1.825 2.538 1.00 10.00 C ATOM 0 H LEU A 43 2.952 3.548 3.976 1.00 10.00 H new ATOM 0 HA LEU A 43 1.340 1.859 5.624 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.507 3.912 4.610 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.853 3.307 3.002 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.979 1.649 4.661 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.912 3.101 4.130 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.748 3.919 5.199 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.801 4.323 3.467 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.152 1.426 2.500 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -1.021 2.592 1.772 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.424 1.021 2.359 1.00 10.00 H new ATOM 456 N MET A 44 2.228 0.816 2.615 1.00 10.00 N ATOM 457 CA MET A 44 2.355 -0.358 1.761 1.00 10.00 C ATOM 458 C MET A 44 3.233 -1.402 2.439 1.00 10.00 C ATOM 459 O MET A 44 2.917 -2.591 2.439 1.00 10.00 O ATOM 460 CB MET A 44 2.956 0.019 0.403 1.00 10.00 C ATOM 461 CG MET A 44 2.118 1.007 -0.390 1.00 10.00 C ATOM 462 SD MET A 44 2.670 1.189 -2.097 1.00 10.00 S ATOM 463 CE MET A 44 4.368 1.712 -1.864 1.00 10.00 C ATOM 0 H MET A 44 2.623 1.669 2.218 1.00 10.00 H new ATOM 0 HA MET A 44 1.360 -0.772 1.598 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.947 0.444 0.561 1.00 10.00 H new ATOM 0 HB3 MET A 44 3.088 -0.887 -0.189 1.00 10.00 H new ATOM 0 HG2 MET A 44 1.078 0.680 -0.383 1.00 10.00 H new ATOM 0 HG3 MET A 44 2.150 1.979 0.102 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.844 1.847 -2.835 1.00 10.00 H new ATOM 0 HE2 MET A 44 4.387 2.655 -1.317 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.908 0.953 -1.298 1.00 10.00 H new ATOM 473 N LYS A 45 4.329 -0.938 3.035 1.00 10.00 N ATOM 474 CA LYS A 45 5.256 -1.822 3.726 1.00 10.00 C ATOM 475 C LYS A 45 4.601 -2.434 4.963 1.00 10.00 C ATOM 476 O LYS A 45 4.833 -3.599 5.275 1.00 10.00 O ATOM 477 CB LYS A 45 6.533 -1.067 4.110 1.00 10.00 C ATOM 478 CG LYS A 45 7.443 -0.792 2.919 1.00 10.00 C ATOM 479 CD LYS A 45 8.650 0.049 3.301 1.00 10.00 C ATOM 480 CE LYS A 45 9.473 0.419 2.074 1.00 10.00 C ATOM 481 NZ LYS A 45 10.651 1.260 2.417 1.00 10.00 N ATOM 0 H LYS A 45 4.594 0.047 3.052 1.00 10.00 H new ATOM 0 HA LYS A 45 5.525 -2.632 3.048 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.262 -0.121 4.579 1.00 10.00 H new ATOM 0 HB3 LYS A 45 7.081 -1.646 4.853 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.781 -1.738 2.496 1.00 10.00 H new ATOM 0 HG3 LYS A 45 6.876 -0.279 2.142 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.319 0.956 3.807 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.272 -0.502 4.007 1.00 10.00 H new ATOM 0 HE2 LYS A 45 9.811 -0.491 1.578 1.00 10.00 H new ATOM 0 HE3 LYS A 45 8.842 0.954 1.364 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.180 1.486 1.551 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.329 2.141 2.866 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.268 0.741 3.074 1.00 10.00 H new ATOM 495 N ALA A 46 3.766 -1.656 5.646 1.00 10.00 N ATOM 496 CA ALA A 46 3.074 -2.135 6.840 1.00 10.00 C ATOM 497 C ALA A 46 2.218 -3.355 6.519 1.00 10.00 C ATOM 498 O ALA A 46 2.242 -4.354 7.241 1.00 10.00 O ATOM 499 CB ALA A 46 2.213 -1.032 7.437 1.00 10.00 C ATOM 0 H ALA A 46 3.552 -0.691 5.394 1.00 10.00 H new ATOM 0 HA ALA A 46 3.827 -2.426 7.572 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.705 -1.407 8.325 1.00 10.00 H new ATOM 0 HB2 ALA A 46 2.843 -0.186 7.710 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.472 -0.712 6.704 1.00 10.00 H new ATOM 505 N TYR A 47 1.467 -3.272 5.429 1.00 10.00 N ATOM 506 CA TYR A 47 0.619 -4.377 5.007 1.00 10.00 C ATOM 507 C TYR A 47 1.483 -5.524 4.497 1.00 10.00 C ATOM 508 O TYR A 47 1.183 -6.695 4.730 1.00 10.00 O ATOM 509 CB TYR A 47 -0.357 -3.922 3.916 1.00 10.00 C ATOM 510 CG TYR A 47 -1.456 -4.922 3.624 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.511 -5.594 2.407 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.440 -5.198 4.567 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.515 -6.508 2.139 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.447 -6.110 4.306 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.480 -6.763 3.092 1.00 10.00 C ATOM 516 OH TYR A 47 -4.480 -7.674 2.829 1.00 10.00 O ATOM 0 H TYR A 47 1.428 -2.453 4.823 1.00 10.00 H new ATOM 0 HA TYR A 47 0.038 -4.720 5.863 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.809 -2.977 4.217 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.201 -3.731 2.999 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -0.757 -5.399 1.659 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.418 -4.691 5.520 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.543 -7.019 1.188 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.204 -6.310 5.050 1.00 10.00 H new ATOM 0 HH TYR A 47 -5.077 -7.737 3.604 1.00 10.00 H new ATOM 526 N CYS A 48 2.571 -5.172 3.824 1.00 10.00 N ATOM 527 CA CYS A 48 3.495 -6.155 3.274 1.00 10.00 C ATOM 528 C CYS A 48 4.119 -7.008 4.377 1.00 10.00 C ATOM 529 O CYS A 48 4.202 -8.234 4.252 1.00 10.00 O ATOM 530 CB CYS A 48 4.591 -5.452 2.477 1.00 10.00 C ATOM 531 SG CYS A 48 5.536 -6.548 1.399 1.00 10.00 S ATOM 0 H CYS A 48 2.837 -4.204 3.645 1.00 10.00 H new ATOM 0 HA CYS A 48 2.932 -6.815 2.614 1.00 10.00 H new ATOM 0 HB2 CYS A 48 4.138 -4.666 1.872 1.00 10.00 H new ATOM 0 HB3 CYS A 48 5.275 -4.965 3.172 1.00 10.00 H new ATOM 0 HG CYS A 48 6.146 -7.443 2.118 1.00 10.00 H new ATOM 537 N GLU A 49 4.551 -6.356 5.453 1.00 10.00 N ATOM 538 CA GLU A 49 5.165 -7.049 6.583 1.00 10.00 C ATOM 539 C GLU A 49 4.189 -8.050 7.188 1.00 10.00 C ATOM 540 O GLU A 49 4.584 -9.126 7.633 1.00 10.00 O ATOM 541 CB GLU A 49 5.604 -6.048 7.654 1.00 10.00 C ATOM 542 CG GLU A 49 6.686 -5.088 7.190 1.00 10.00 C ATOM 543 CD GLU A 49 8.000 -5.777 6.886 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.510 -6.508 7.760 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.538 -5.570 5.781 1.00 10.00 O ATOM 0 H GLU A 49 4.487 -5.344 5.567 1.00 10.00 H new ATOM 0 HA GLU A 49 6.042 -7.583 6.217 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.736 -5.473 7.978 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.966 -6.596 8.524 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.342 -4.565 6.298 1.00 10.00 H new ATOM 0 HG3 GLU A 49 6.848 -4.333 7.959 1.00 10.00 H new ATOM 552 N ARG A 50 2.912 -7.689 7.190 1.00 10.00 N ATOM 553 CA ARG A 50 1.873 -8.552 7.736 1.00 10.00 C ATOM 554 C ARG A 50 1.712 -9.815 6.903 1.00 10.00 C ATOM 555 O ARG A 50 1.579 -10.913 7.447 1.00 10.00 O ATOM 556 CB ARG A 50 0.550 -7.803 7.811 1.00 10.00 C ATOM 557 CG ARG A 50 0.495 -6.821 8.957 1.00 10.00 C ATOM 558 CD ARG A 50 -0.740 -5.951 8.867 1.00 10.00 C ATOM 559 NE ARG A 50 -1.082 -5.351 10.148 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.322 -5.046 10.508 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.328 -5.266 9.675 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.553 -4.530 11.704 1.00 10.00 N ATOM 0 H ARG A 50 2.571 -6.802 6.819 1.00 10.00 H new ATOM 0 HA ARG A 50 2.175 -8.845 8.742 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.386 -7.270 6.874 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.263 -8.521 7.915 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.495 -7.361 9.904 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.387 -6.195 8.947 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.576 -5.164 8.131 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.579 -6.549 8.512 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.327 -5.154 10.805 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.150 -5.670 8.756 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.281 -5.031 9.953 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.779 -4.367 12.347 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.506 -4.295 11.983 1.00 10.00 H new ATOM 576 N GLN A 51 1.741 -9.657 5.586 1.00 10.00 N ATOM 577 CA GLN A 51 1.603 -10.792 4.685 1.00 10.00 C ATOM 578 C GLN A 51 2.888 -11.616 4.680 1.00 10.00 C ATOM 579 O GLN A 51 2.893 -12.777 4.273 1.00 10.00 O ATOM 580 CB GLN A 51 1.283 -10.325 3.262 1.00 10.00 C ATOM 581 CG GLN A 51 0.181 -9.275 3.173 1.00 10.00 C ATOM 582 CD GLN A 51 -1.106 -9.695 3.860 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.327 -9.388 5.031 1.00 10.00 O ATOM 584 NE2 GLN A 51 -1.961 -10.397 3.136 1.00 10.00 N ATOM 0 H GLN A 51 1.858 -8.757 5.120 1.00 10.00 H new ATOM 0 HA GLN A 51 0.778 -11.410 5.040 1.00 10.00 H new ATOM 0 HB2 GLN A 51 2.190 -9.920 2.814 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.992 -11.190 2.666 1.00 10.00 H new ATOM 0 HG2 GLN A 51 0.537 -8.346 3.620 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.027 -9.065 2.124 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -1.739 -10.630 2.168 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -2.843 -10.705 3.545 1.00 10.00 H new ATOM 593 N GLY A 52 3.974 -10.998 5.131 1.00 10.00 N ATOM 594 CA GLY A 52 5.255 -11.673 5.183 1.00 10.00 C ATOM 595 C GLY A 52 5.855 -11.860 3.808 1.00 10.00 C ATOM 596 O GLY A 52 6.522 -12.862 3.544 1.00 10.00 O ATOM 0 H GLY A 52 3.988 -10.034 5.464 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.943 -11.098 5.803 1.00 10.00 H new ATOM 0 HA3 GLY A 52 5.133 -12.645 5.660 1.00 10.00 H new ATOM 600 N LEU A 53 5.626 -10.892 2.932 1.00 10.00 N ATOM 601 CA LEU A 53 6.135 -10.956 1.568 1.00 10.00 C ATOM 602 C LEU A 53 7.032 -9.760 1.279 1.00 10.00 C ATOM 603 O LEU A 53 7.271 -8.928 2.154 1.00 10.00 O ATOM 604 CB LEU A 53 4.973 -10.983 0.572 1.00 10.00 C ATOM 605 CG LEU A 53 3.889 -12.024 0.855 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.658 -11.747 0.010 1.00 10.00 C ATOM 607 CD2 LEU A 53 4.408 -13.428 0.593 1.00 10.00 C ATOM 0 H LEU A 53 5.089 -10.050 3.142 1.00 10.00 H new ATOM 0 HA LEU A 53 6.720 -11.870 1.461 1.00 10.00 H new ATOM 0 HB2 LEU A 53 4.509 -9.997 0.554 1.00 10.00 H new ATOM 0 HB3 LEU A 53 5.375 -11.164 -0.425 1.00 10.00 H new ATOM 0 HG LEU A 53 3.613 -11.954 1.907 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.895 -12.496 0.222 1.00 10.00 H new ATOM 0 HD12 LEU A 53 2.270 -10.756 0.247 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.924 -11.790 -1.046 1.00 10.00 H new ATOM 0 HD21 LEU A 53 3.620 -14.152 0.801 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.714 -13.514 -0.450 1.00 10.00 H new ATOM 0 HD23 LEU A 53 5.263 -13.626 1.240 1.00 10.00 H new ATOM 619 N SER A 54 7.522 -9.681 0.050 1.00 10.00 N ATOM 620 CA SER A 54 8.379 -8.582 -0.362 1.00 10.00 C ATOM 621 C SER A 54 7.535 -7.485 -1.001 1.00 10.00 C ATOM 622 O SER A 54 6.571 -7.774 -1.714 1.00 10.00 O ATOM 623 CB SER A 54 9.438 -9.080 -1.350 1.00 10.00 C ATOM 624 OG SER A 54 10.315 -8.035 -1.740 1.00 10.00 O ATOM 0 H SER A 54 7.339 -10.369 -0.681 1.00 10.00 H new ATOM 0 HA SER A 54 8.886 -8.176 0.514 1.00 10.00 H new ATOM 0 HB2 SER A 54 10.012 -9.887 -0.895 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.949 -9.494 -2.232 1.00 10.00 H new ATOM 0 HG SER A 54 10.980 -8.384 -2.369 1.00 10.00 H new ATOM 630 N MET A 55 7.898 -6.230 -0.754 1.00 10.00 N ATOM 631 CA MET A 55 7.160 -5.094 -1.303 1.00 10.00 C ATOM 632 C MET A 55 7.293 -5.047 -2.820 1.00 10.00 C ATOM 633 O MET A 55 6.511 -4.392 -3.507 1.00 10.00 O ATOM 634 CB MET A 55 7.658 -3.779 -0.694 1.00 10.00 C ATOM 635 CG MET A 55 6.676 -2.627 -0.852 1.00 10.00 C ATOM 636 SD MET A 55 7.445 -1.015 -0.600 1.00 10.00 S ATOM 637 CE MET A 55 8.436 -0.873 -2.086 1.00 10.00 C ATOM 0 H MET A 55 8.699 -5.972 -0.177 1.00 10.00 H new ATOM 0 HA MET A 55 6.108 -5.222 -1.048 1.00 10.00 H new ATOM 0 HB2 MET A 55 7.859 -3.932 0.366 1.00 10.00 H new ATOM 0 HB3 MET A 55 8.604 -3.506 -1.162 1.00 10.00 H new ATOM 0 HG2 MET A 55 6.237 -2.663 -1.849 1.00 10.00 H new ATOM 0 HG3 MET A 55 5.860 -2.751 -0.140 1.00 10.00 H new ATOM 0 HE1 MET A 55 8.594 0.180 -2.319 1.00 10.00 H new ATOM 0 HE2 MET A 55 9.399 -1.358 -1.929 1.00 10.00 H new ATOM 0 HE3 MET A 55 7.919 -1.354 -2.916 1.00 10.00 H new ATOM 647 N ARG A 56 8.288 -5.754 -3.340 1.00 10.00 N ATOM 648 CA ARG A 56 8.518 -5.801 -4.776 1.00 10.00 C ATOM 649 C ARG A 56 7.673 -6.899 -5.415 1.00 10.00 C ATOM 650 O ARG A 56 7.673 -7.069 -6.633 1.00 10.00 O ATOM 651 CB ARG A 56 9.999 -6.038 -5.073 1.00 10.00 C ATOM 652 CG ARG A 56 10.596 -5.004 -6.009 1.00 10.00 C ATOM 653 CD ARG A 56 12.075 -5.258 -6.253 1.00 10.00 C ATOM 654 NE ARG A 56 12.303 -6.402 -7.136 1.00 10.00 N ATOM 655 CZ ARG A 56 13.204 -6.416 -8.117 1.00 10.00 C ATOM 656 NH1 ARG A 56 13.961 -5.353 -8.353 1.00 10.00 N ATOM 657 NH2 ARG A 56 13.353 -7.501 -8.861 1.00 10.00 N ATOM 0 H ARG A 56 8.948 -6.302 -2.788 1.00 10.00 H new ATOM 0 HA ARG A 56 8.225 -4.841 -5.202 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.556 -6.034 -4.136 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.121 -7.028 -5.512 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.062 -5.021 -6.959 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.462 -4.009 -5.586 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.527 -4.368 -6.691 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.574 -5.433 -5.300 1.00 10.00 H new ATOM 0 HE ARG A 56 11.738 -7.239 -6.992 1.00 10.00 H new ATOM 0 HH11 ARG A 56 13.856 -4.515 -7.781 1.00 10.00 H new ATOM 0 HH12 ARG A 56 14.648 -5.373 -9.106 1.00 10.00 H new ATOM 0 HH21 ARG A 56 12.778 -8.325 -8.683 1.00 10.00 H new ATOM 0 HH22 ARG A 56 14.042 -7.513 -9.613 1.00 10.00 H new ATOM 671 N GLN A 57 6.934 -7.623 -4.584 1.00 10.00 N ATOM 672 CA GLN A 57 6.082 -8.706 -5.053 1.00 10.00 C ATOM 673 C GLN A 57 4.645 -8.228 -5.245 1.00 10.00 C ATOM 674 O GLN A 57 3.981 -8.600 -6.210 1.00 10.00 O ATOM 675 CB GLN A 57 6.119 -9.864 -4.054 1.00 10.00 C ATOM 676 CG GLN A 57 5.226 -11.034 -4.430 1.00 10.00 C ATOM 677 CD GLN A 57 5.047 -12.008 -3.287 1.00 10.00 C ATOM 678 OE1 GLN A 57 5.925 -12.153 -2.437 1.00 10.00 O ATOM 679 NE2 GLN A 57 3.909 -12.681 -3.256 1.00 10.00 N ATOM 0 H GLN A 57 6.909 -7.477 -3.575 1.00 10.00 H new ATOM 0 HA GLN A 57 6.459 -9.047 -6.017 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.146 -10.219 -3.963 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.821 -9.494 -3.073 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.251 -10.659 -4.741 1.00 10.00 H new ATOM 0 HG3 GLN A 57 5.655 -11.556 -5.286 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.207 -12.530 -3.981 1.00 10.00 H new ATOM 0 HE22 GLN A 57 3.733 -13.351 -2.507 1.00 10.00 H new ATOM 688 N ILE A 58 4.171 -7.397 -4.330 1.00 10.00 N ATOM 689 CA ILE A 58 2.810 -6.881 -4.407 1.00 10.00 C ATOM 690 C ILE A 58 2.788 -5.482 -5.012 1.00 10.00 C ATOM 691 O ILE A 58 3.819 -4.814 -5.091 1.00 10.00 O ATOM 692 CB ILE A 58 2.125 -6.859 -3.025 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.073 -6.296 -1.963 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.659 -8.258 -2.644 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.461 -6.231 -0.578 1.00 10.00 C ATOM 0 H ILE A 58 4.705 -7.065 -3.527 1.00 10.00 H new ATOM 0 HA ILE A 58 2.253 -7.559 -5.054 1.00 10.00 H new ATOM 0 HB ILE A 58 1.253 -6.208 -3.080 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.971 -6.913 -1.926 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.386 -5.295 -2.261 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.178 -8.228 -1.667 1.00 10.00 H new ATOM 0 HG22 ILE A 58 0.949 -8.620 -3.387 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.517 -8.929 -2.605 1.00 10.00 H new ATOM 0 HD11 ILE A 58 3.189 -5.822 0.123 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.579 -5.591 -0.600 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.174 -7.233 -0.260 1.00 10.00 H new ATOM 707 N ARG A 59 1.620 -5.058 -5.468 1.00 10.00 N ATOM 708 CA ARG A 59 1.456 -3.740 -6.069 1.00 10.00 C ATOM 709 C ARG A 59 0.250 -3.033 -5.466 1.00 10.00 C ATOM 710 O ARG A 59 -0.761 -3.666 -5.170 1.00 10.00 O ATOM 711 CB ARG A 59 1.272 -3.853 -7.587 1.00 10.00 C ATOM 712 CG ARG A 59 2.476 -4.421 -8.321 1.00 10.00 C ATOM 713 CD ARG A 59 3.694 -3.519 -8.188 1.00 10.00 C ATOM 714 NE ARG A 59 4.846 -4.054 -8.911 1.00 10.00 N ATOM 715 CZ ARG A 59 5.681 -4.969 -8.418 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.527 -5.426 -7.180 1.00 10.00 N ATOM 717 NH2 ARG A 59 6.691 -5.412 -9.157 1.00 10.00 N ATOM 0 H ARG A 59 0.764 -5.611 -5.434 1.00 10.00 H new ATOM 0 HA ARG A 59 2.357 -3.162 -5.864 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.406 -4.483 -7.791 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.049 -2.865 -7.989 1.00 10.00 H new ATOM 0 HG2 ARG A 59 2.710 -5.409 -7.925 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.232 -4.549 -9.376 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.455 -2.526 -8.569 1.00 10.00 H new ATOM 0 HD3 ARG A 59 3.948 -3.403 -7.134 1.00 10.00 H new ATOM 0 HE ARG A 59 5.022 -3.705 -9.853 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.765 -5.077 -6.599 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.171 -6.126 -6.811 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.828 -5.052 -10.102 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.330 -6.112 -8.780 1.00 10.00 H new ATOM 731 N PHE A 60 0.365 -1.726 -5.281 1.00 10.00 N ATOM 732 CA PHE A 60 -0.721 -0.932 -4.719 1.00 10.00 C ATOM 733 C PHE A 60 -1.152 0.143 -5.706 1.00 10.00 C ATOM 734 O PHE A 60 -0.312 0.812 -6.314 1.00 10.00 O ATOM 735 CB PHE A 60 -0.295 -0.279 -3.401 1.00 10.00 C ATOM 736 CG PHE A 60 -0.133 -1.245 -2.261 1.00 10.00 C ATOM 737 CD1 PHE A 60 0.991 -2.049 -2.168 1.00 10.00 C ATOM 738 CD2 PHE A 60 -1.104 -1.340 -1.275 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.143 -2.930 -1.117 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.957 -2.221 -0.222 1.00 10.00 C ATOM 741 CZ PHE A 60 0.168 -3.018 -0.143 1.00 10.00 C ATOM 0 H PHE A 60 1.202 -1.190 -5.512 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.560 -1.599 -4.522 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.648 0.245 -3.556 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.035 0.472 -3.124 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.757 -1.986 -2.927 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.985 -0.718 -1.332 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.025 -3.551 -1.056 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.721 -2.287 0.539 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.285 -3.709 0.679 1.00 10.00 H new ATOM 751 N ARG A 61 -2.454 0.300 -5.870 1.00 10.00 N ATOM 752 CA ARG A 61 -2.993 1.291 -6.786 1.00 10.00 C ATOM 753 C ARG A 61 -4.067 2.129 -6.109 1.00 10.00 C ATOM 754 O ARG A 61 -4.791 1.650 -5.240 1.00 10.00 O ATOM 755 CB ARG A 61 -3.586 0.618 -8.028 1.00 10.00 C ATOM 756 CG ARG A 61 -2.574 -0.113 -8.894 1.00 10.00 C ATOM 757 CD ARG A 61 -3.231 -0.646 -10.156 1.00 10.00 C ATOM 758 NE ARG A 61 -2.390 -1.613 -10.862 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.861 -2.489 -11.750 1.00 10.00 C ATOM 760 NH1 ARG A 61 -4.154 -2.504 -12.043 1.00 10.00 N ATOM 761 NH2 ARG A 61 -2.042 -3.345 -12.348 1.00 10.00 N ATOM 0 H ARG A 61 -3.160 -0.248 -5.379 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.171 1.940 -7.087 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.352 -0.090 -7.711 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.083 1.376 -8.634 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.760 0.562 -9.159 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.134 -0.937 -8.331 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.180 -1.116 -9.897 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.459 0.186 -10.822 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.389 -1.617 -10.664 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -4.787 -1.846 -11.589 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -4.515 -3.174 -12.722 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -1.046 -3.335 -12.129 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -2.409 -4.013 -13.026 1.00 10.00 H new ATOM 775 N PHE A 62 -4.157 3.383 -6.510 1.00 10.00 N ATOM 776 CA PHE A 62 -5.147 4.297 -5.980 1.00 10.00 C ATOM 777 C PHE A 62 -5.939 4.896 -7.132 1.00 10.00 C ATOM 778 O PHE A 62 -5.367 5.547 -8.010 1.00 10.00 O ATOM 779 CB PHE A 62 -4.486 5.411 -5.159 1.00 10.00 C ATOM 780 CG PHE A 62 -5.436 6.509 -4.768 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.445 6.277 -3.843 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.324 7.774 -5.327 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.323 7.283 -3.486 1.00 10.00 C ATOM 784 CE2 PHE A 62 -6.200 8.783 -4.973 1.00 10.00 C ATOM 785 CZ PHE A 62 -7.200 8.538 -4.051 1.00 10.00 C ATOM 0 H PHE A 62 -3.544 3.796 -7.213 1.00 10.00 H new ATOM 0 HA PHE A 62 -5.816 3.747 -5.318 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.051 4.979 -4.258 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.665 5.839 -5.735 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.545 5.299 -3.397 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.544 7.973 -6.047 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.104 7.088 -2.766 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -6.103 9.763 -5.417 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.884 9.326 -3.773 1.00 10.00 H new ATOM 795 N ASP A 63 -7.242 4.619 -7.153 1.00 10.00 N ATOM 796 CA ASP A 63 -8.141 5.128 -8.194 1.00 10.00 C ATOM 797 C ASP A 63 -7.771 4.557 -9.567 1.00 10.00 C ATOM 798 O ASP A 63 -8.245 5.024 -10.603 1.00 10.00 O ATOM 799 CB ASP A 63 -8.116 6.663 -8.220 1.00 10.00 C ATOM 800 CG ASP A 63 -9.332 7.258 -8.901 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.465 6.976 -8.460 1.00 10.00 O ATOM 802 OD2 ASP A 63 -9.160 8.013 -9.883 1.00 10.00 O ATOM 0 H ASP A 63 -7.705 4.038 -6.454 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.154 4.802 -7.958 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.057 7.038 -7.198 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -7.216 6.999 -8.735 1.00 10.00 H new ATOM 807 N GLY A 64 -6.921 3.535 -9.567 1.00 10.00 N ATOM 808 CA GLY A 64 -6.504 2.905 -10.805 1.00 10.00 C ATOM 809 C GLY A 64 -5.026 3.090 -11.099 1.00 10.00 C ATOM 810 O GLY A 64 -4.423 2.278 -11.804 1.00 10.00 O ATOM 0 H GLY A 64 -6.512 3.130 -8.725 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.728 1.839 -10.757 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.087 3.316 -11.629 1.00 10.00 H new ATOM 814 N GLN A 65 -4.436 4.146 -10.554 1.00 10.00 N ATOM 815 CA GLN A 65 -3.022 4.433 -10.781 1.00 10.00 C ATOM 816 C GLN A 65 -2.153 3.911 -9.640 1.00 10.00 C ATOM 817 O GLN A 65 -2.521 4.024 -8.474 1.00 10.00 O ATOM 818 CB GLN A 65 -2.809 5.938 -10.955 1.00 10.00 C ATOM 819 CG GLN A 65 -3.157 6.441 -12.344 1.00 10.00 C ATOM 820 CD GLN A 65 -2.395 5.709 -13.431 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.860 4.701 -13.960 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.213 6.203 -13.762 1.00 10.00 N ATOM 0 H GLN A 65 -4.912 4.818 -9.952 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.722 3.918 -11.694 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.415 6.470 -10.222 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.767 6.177 -10.741 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.227 6.324 -12.512 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -2.939 7.507 -12.407 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -0.863 7.042 -13.299 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.652 5.745 -14.480 1.00 10.00 H new ATOM 831 N PRO A 66 -0.988 3.319 -9.962 1.00 10.00 N ATOM 832 CA PRO A 66 -0.063 2.792 -8.950 1.00 10.00 C ATOM 833 C PRO A 66 0.491 3.889 -8.038 1.00 10.00 C ATOM 834 O PRO A 66 0.759 5.008 -8.484 1.00 10.00 O ATOM 835 CB PRO A 66 1.066 2.158 -9.775 1.00 10.00 C ATOM 836 CG PRO A 66 0.505 1.987 -11.146 1.00 10.00 C ATOM 837 CD PRO A 66 -0.481 3.101 -11.328 1.00 10.00 C ATOM 0 HA PRO A 66 -0.559 2.089 -8.281 1.00 10.00 H new ATOM 0 HB2 PRO A 66 1.949 2.797 -9.789 1.00 10.00 H new ATOM 0 HB3 PRO A 66 1.371 1.201 -9.353 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.292 2.035 -11.899 1.00 10.00 H new ATOM 0 HG3 PRO A 66 0.021 1.016 -11.252 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.009 3.997 -11.731 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -1.280 2.825 -12.016 1.00 10.00 H new ATOM 845 N ILE A 67 0.659 3.554 -6.765 1.00 10.00 N ATOM 846 CA ILE A 67 1.166 4.494 -5.775 1.00 10.00 C ATOM 847 C ILE A 67 2.694 4.477 -5.732 1.00 10.00 C ATOM 848 O ILE A 67 3.312 3.412 -5.764 1.00 10.00 O ATOM 849 CB ILE A 67 0.611 4.161 -4.371 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.917 4.230 -4.377 1.00 10.00 C ATOM 851 CG2 ILE A 67 1.181 5.107 -3.323 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.550 3.727 -3.097 1.00 10.00 C ATOM 0 H ILE A 67 0.449 2.628 -6.392 1.00 10.00 H new ATOM 0 HA ILE A 67 0.832 5.489 -6.068 1.00 10.00 H new ATOM 0 HB ILE A 67 0.916 3.147 -4.114 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.225 5.262 -4.544 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.296 3.644 -5.215 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.775 4.852 -2.344 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.267 5.014 -3.301 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.909 6.133 -3.573 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.635 3.805 -3.172 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.272 2.685 -2.938 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.200 4.328 -2.258 1.00 10.00 H new ATOM 864 N ASN A 68 3.295 5.658 -5.673 1.00 10.00 N ATOM 865 CA ASN A 68 4.746 5.780 -5.616 1.00 10.00 C ATOM 866 C ASN A 68 5.218 5.795 -4.169 1.00 10.00 C ATOM 867 O ASN A 68 4.442 6.069 -3.254 1.00 10.00 O ATOM 868 CB ASN A 68 5.213 7.060 -6.313 1.00 10.00 C ATOM 869 CG ASN A 68 4.885 7.080 -7.793 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.678 6.639 -8.624 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.713 7.595 -8.127 1.00 10.00 N ATOM 0 H ASN A 68 2.798 6.549 -5.663 1.00 10.00 H new ATOM 0 HA ASN A 68 5.175 4.920 -6.130 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.748 7.920 -5.831 1.00 10.00 H new ATOM 0 HB3 ASN A 68 6.290 7.166 -6.183 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.436 7.638 -9.108 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.087 7.949 -7.404 1.00 10.00 H new ATOM 878 N GLU A 69 6.502 5.522 -3.966 1.00 10.00 N ATOM 879 CA GLU A 69 7.076 5.504 -2.625 1.00 10.00 C ATOM 880 C GLU A 69 7.173 6.916 -2.046 1.00 10.00 C ATOM 881 O GLU A 69 7.462 7.095 -0.864 1.00 10.00 O ATOM 882 CB GLU A 69 8.460 4.855 -2.647 1.00 10.00 C ATOM 883 CG GLU A 69 8.430 3.365 -2.949 1.00 10.00 C ATOM 884 CD GLU A 69 9.800 2.732 -2.856 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.454 2.876 -1.803 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.233 2.091 -3.838 1.00 10.00 O ATOM 0 H GLU A 69 7.165 5.310 -4.712 1.00 10.00 H new ATOM 0 HA GLU A 69 6.415 4.917 -1.987 1.00 10.00 H new ATOM 0 HB2 GLU A 69 9.075 5.356 -3.394 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.941 5.012 -1.681 1.00 10.00 H new ATOM 0 HG2 GLU A 69 7.755 2.869 -2.252 1.00 10.00 H new ATOM 0 HG3 GLU A 69 8.027 3.208 -3.949 1.00 10.00 H new ATOM 893 N THR A 70 6.936 7.915 -2.879 1.00 10.00 N ATOM 894 CA THR A 70 6.994 9.299 -2.441 1.00 10.00 C ATOM 895 C THR A 70 5.603 9.919 -2.383 1.00 10.00 C ATOM 896 O THR A 70 5.457 11.125 -2.179 1.00 10.00 O ATOM 897 CB THR A 70 7.875 10.128 -3.385 1.00 10.00 C ATOM 898 OG1 THR A 70 7.989 9.452 -4.646 1.00 10.00 O ATOM 899 CG2 THR A 70 9.256 10.343 -2.786 1.00 10.00 C ATOM 0 H THR A 70 6.701 7.793 -3.864 1.00 10.00 H new ATOM 0 HA THR A 70 7.425 9.305 -1.440 1.00 10.00 H new ATOM 0 HB THR A 70 7.411 11.104 -3.531 1.00 10.00 H new ATOM 0 HG1 THR A 70 8.550 9.981 -5.251 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.863 10.933 -3.473 1.00 10.00 H new ATOM 0 HG22 THR A 70 9.163 10.872 -1.838 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.734 9.378 -2.617 1.00 10.00 H new ATOM 907 N ASP A 71 4.585 9.086 -2.550 1.00 10.00 N ATOM 908 CA ASP A 71 3.209 9.562 -2.528 1.00 10.00 C ATOM 909 C ASP A 71 2.675 9.607 -1.108 1.00 10.00 C ATOM 910 O ASP A 71 3.079 8.816 -0.251 1.00 10.00 O ATOM 911 CB ASP A 71 2.311 8.679 -3.394 1.00 10.00 C ATOM 912 CG ASP A 71 2.322 9.099 -4.852 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.352 10.320 -5.125 1.00 10.00 O ATOM 914 OD2 ASP A 71 2.300 8.214 -5.733 1.00 10.00 O ATOM 0 H ASP A 71 4.685 8.082 -2.701 1.00 10.00 H new ATOM 0 HA ASP A 71 3.203 10.572 -2.937 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.639 7.643 -3.315 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.290 8.720 -3.014 1.00 10.00 H new ATOM 919 N THR A 72 1.769 10.538 -0.868 1.00 10.00 N ATOM 920 CA THR A 72 1.161 10.711 0.439 1.00 10.00 C ATOM 921 C THR A 72 -0.344 10.893 0.284 1.00 10.00 C ATOM 922 O THR A 72 -0.810 11.247 -0.803 1.00 10.00 O ATOM 923 CB THR A 72 1.756 11.939 1.162 1.00 10.00 C ATOM 924 OG1 THR A 72 2.118 12.938 0.202 1.00 10.00 O ATOM 925 CG2 THR A 72 2.978 11.559 1.983 1.00 10.00 C ATOM 0 H THR A 72 1.434 11.195 -1.573 1.00 10.00 H new ATOM 0 HA THR A 72 1.366 9.822 1.035 1.00 10.00 H new ATOM 0 HB THR A 72 0.997 12.332 1.839 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.493 13.716 0.665 1.00 10.00 H new ATOM 0 HG21 THR A 72 3.373 12.445 2.479 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.697 10.819 2.732 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.741 11.140 1.327 1.00 10.00 H new ATOM 933 N PRO A 73 -1.131 10.653 1.349 1.00 10.00 N ATOM 934 CA PRO A 73 -2.587 10.813 1.303 1.00 10.00 C ATOM 935 C PRO A 73 -2.987 12.206 0.829 1.00 10.00 C ATOM 936 O PRO A 73 -3.947 12.365 0.080 1.00 10.00 O ATOM 937 CB PRO A 73 -3.020 10.598 2.754 1.00 10.00 C ATOM 938 CG PRO A 73 -1.941 9.772 3.355 1.00 10.00 C ATOM 939 CD PRO A 73 -0.670 10.194 2.672 1.00 10.00 C ATOM 0 HA PRO A 73 -3.055 10.120 0.604 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.130 11.547 3.279 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -3.983 10.090 2.808 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -1.879 9.934 4.431 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.132 8.710 3.203 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.164 10.989 3.220 1.00 10.00 H new ATOM 0 HD3 PRO A 73 0.035 9.367 2.588 1.00 10.00 H new ATOM 947 N ALA A 74 -2.237 13.208 1.270 1.00 10.00 N ATOM 948 CA ALA A 74 -2.492 14.590 0.891 1.00 10.00 C ATOM 949 C ALA A 74 -2.161 14.829 -0.581 1.00 10.00 C ATOM 950 O ALA A 74 -2.920 15.477 -1.299 1.00 10.00 O ATOM 951 CB ALA A 74 -1.681 15.527 1.769 1.00 10.00 C ATOM 0 H ALA A 74 -1.441 13.086 1.896 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.553 14.792 1.034 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -1.878 16.559 1.479 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -1.963 15.383 2.812 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -0.619 15.312 1.647 1.00 10.00 H new ATOM 957 N GLN A 75 -1.030 14.284 -1.024 1.00 10.00 N ATOM 958 CA GLN A 75 -0.583 14.440 -2.407 1.00 10.00 C ATOM 959 C GLN A 75 -1.582 13.821 -3.381 1.00 10.00 C ATOM 960 O GLN A 75 -1.877 14.392 -4.434 1.00 10.00 O ATOM 961 CB GLN A 75 0.792 13.789 -2.585 1.00 10.00 C ATOM 962 CG GLN A 75 1.437 14.049 -3.937 1.00 10.00 C ATOM 963 CD GLN A 75 1.719 15.518 -4.178 1.00 10.00 C ATOM 964 OE1 GLN A 75 1.917 16.287 -3.239 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.759 15.909 -5.440 1.00 10.00 N ATOM 0 H GLN A 75 -0.403 13.728 -0.442 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.512 15.506 -2.625 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.457 14.153 -1.802 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.692 12.713 -2.444 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.370 13.489 -4.004 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.783 13.675 -4.725 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.588 15.237 -6.188 1.00 10.00 H new ATOM 0 HE22 GLN A 75 1.960 16.883 -5.666 1.00 10.00 H new ATOM 974 N LEU A 76 -2.104 12.656 -3.027 1.00 10.00 N ATOM 975 CA LEU A 76 -3.070 11.966 -3.874 1.00 10.00 C ATOM 976 C LEU A 76 -4.494 12.439 -3.592 1.00 10.00 C ATOM 977 O LEU A 76 -5.445 11.949 -4.198 1.00 10.00 O ATOM 978 CB LEU A 76 -2.970 10.453 -3.670 1.00 10.00 C ATOM 979 CG LEU A 76 -1.712 9.797 -4.245 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.733 8.296 -3.992 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.593 10.084 -5.734 1.00 10.00 C ATOM 0 H LEU A 76 -1.876 12.168 -2.161 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.834 12.204 -4.911 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.013 10.244 -2.601 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.844 9.983 -4.122 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.842 10.221 -3.743 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.832 7.844 -4.407 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.772 8.108 -2.919 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.610 7.859 -4.469 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.693 9.610 -6.125 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.466 9.688 -6.252 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.534 11.161 -5.893 1.00 10.00 H new ATOM 993 N GLU A 77 -4.621 13.397 -2.673 1.00 10.00 N ATOM 994 CA GLU A 77 -5.915 13.959 -2.289 1.00 10.00 C ATOM 995 C GLU A 77 -6.879 12.871 -1.824 1.00 10.00 C ATOM 996 O GLU A 77 -8.066 12.882 -2.161 1.00 10.00 O ATOM 997 CB GLU A 77 -6.525 14.745 -3.448 1.00 10.00 C ATOM 998 CG GLU A 77 -5.741 15.992 -3.817 1.00 10.00 C ATOM 999 CD GLU A 77 -6.643 17.108 -4.288 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -7.033 17.102 -5.473 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -6.972 17.996 -3.473 1.00 10.00 O ATOM 0 H GLU A 77 -3.830 13.804 -2.175 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.745 14.638 -1.454 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.591 14.096 -4.321 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.544 15.031 -3.186 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -5.168 16.329 -2.953 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -5.023 15.750 -4.601 1.00 10.00 H new ATOM 1008 N MET A 78 -6.358 11.944 -1.036 1.00 10.00 N ATOM 1009 CA MET A 78 -7.156 10.848 -0.514 1.00 10.00 C ATOM 1010 C MET A 78 -8.013 11.346 0.635 1.00 10.00 C ATOM 1011 O MET A 78 -7.548 12.133 1.470 1.00 10.00 O ATOM 1012 CB MET A 78 -6.259 9.706 -0.042 1.00 10.00 C ATOM 1013 CG MET A 78 -5.290 9.223 -1.105 1.00 10.00 C ATOM 1014 SD MET A 78 -4.072 8.059 -0.462 1.00 10.00 S ATOM 1015 CE MET A 78 -5.105 6.630 -0.153 1.00 10.00 C ATOM 0 H MET A 78 -5.381 11.930 -0.743 1.00 10.00 H new ATOM 0 HA MET A 78 -7.799 10.472 -1.309 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.695 10.034 0.831 1.00 10.00 H new ATOM 0 HB3 MET A 78 -6.883 8.871 0.277 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.849 8.748 -1.911 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.774 10.081 -1.537 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.322 6.561 0.913 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.038 6.729 -0.708 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.585 5.728 -0.476 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.254 10.897 0.681 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.166 11.314 1.726 1.00 10.00 C ATOM 1027 C GLU A 79 -10.454 10.173 2.687 1.00 10.00 C ATOM 1028 O GLU A 79 -9.941 9.066 2.528 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.463 11.845 1.117 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.305 13.202 0.448 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.872 14.288 1.412 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -10.644 15.431 0.961 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -10.765 14.013 2.625 1.00 10.00 O ATOM 0 H GLU A 79 -9.652 10.244 0.006 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.692 12.116 2.292 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.832 11.128 0.384 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.219 11.919 1.899 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.572 13.122 -0.355 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.251 13.487 -0.012 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.270 10.457 3.688 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.625 9.466 4.692 1.00 10.00 C ATOM 1042 C ASP A 80 -12.487 8.371 4.078 1.00 10.00 C ATOM 1043 O ASP A 80 -13.301 8.638 3.190 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.367 10.134 5.848 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.239 9.367 7.147 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.243 8.788 7.607 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.132 9.355 7.724 1.00 10.00 O ATOM 0 H ASP A 80 -11.702 11.371 3.828 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.710 9.013 5.073 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.980 11.143 5.987 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.422 10.230 5.590 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.265 7.141 4.533 1.00 10.00 N ATOM 1053 CA GLU A 81 -13.006 5.968 4.067 1.00 10.00 C ATOM 1054 C GLU A 81 -12.647 5.616 2.626 1.00 10.00 C ATOM 1055 O GLU A 81 -13.395 4.903 1.951 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.522 6.178 4.204 1.00 10.00 C ATOM 1057 CG GLU A 81 -15.015 6.179 5.644 1.00 10.00 C ATOM 1058 CD GLU A 81 -15.028 4.796 6.259 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -15.922 3.994 5.909 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -14.152 4.502 7.099 1.00 10.00 O ATOM 0 H GLU A 81 -11.562 6.927 5.240 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.716 5.131 4.702 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.792 7.125 3.737 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -15.039 5.392 3.653 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.378 6.831 6.241 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -16.021 6.597 5.679 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.490 6.095 2.163 1.00 10.00 N ATOM 1068 CA ASP A 82 -11.037 5.816 0.800 1.00 10.00 C ATOM 1069 C ASP A 82 -10.592 4.364 0.680 1.00 10.00 C ATOM 1070 O ASP A 82 -10.523 3.652 1.679 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.894 6.748 0.392 1.00 10.00 C ATOM 1072 CG ASP A 82 -10.213 7.517 -0.873 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -10.320 6.885 -1.946 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -10.376 8.754 -0.797 1.00 10.00 O ATOM 0 H ASP A 82 -10.853 6.675 2.709 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.875 5.992 0.126 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.692 7.449 1.201 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.986 6.164 0.242 1.00 10.00 H new ATOM 1079 N THR A 83 -10.282 3.920 -0.529 1.00 10.00 N ATOM 1080 CA THR A 83 -9.872 2.538 -0.737 1.00 10.00 C ATOM 1081 C THR A 83 -8.618 2.429 -1.603 1.00 10.00 C ATOM 1082 O THR A 83 -8.458 3.158 -2.584 1.00 10.00 O ATOM 1083 CB THR A 83 -11.011 1.729 -1.389 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.272 2.163 -0.860 1.00 10.00 O ATOM 1085 CG2 THR A 83 -10.840 0.236 -1.135 1.00 10.00 C ATOM 0 H THR A 83 -10.306 4.490 -1.374 1.00 10.00 H new ATOM 0 HA THR A 83 -9.640 2.128 0.246 1.00 10.00 H new ATOM 0 HB THR A 83 -10.980 1.900 -2.465 1.00 10.00 H new ATOM 0 HG1 THR A 83 -12.996 1.649 -1.276 1.00 10.00 H new ATOM 0 HG21 THR A 83 -11.658 -0.309 -1.606 1.00 10.00 H new ATOM 0 HG22 THR A 83 -9.891 -0.098 -1.555 1.00 10.00 H new ATOM 0 HG23 THR A 83 -10.849 0.046 -0.062 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.728 1.521 -1.216 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.497 1.277 -1.953 1.00 10.00 C ATOM 1095 C ILE A 84 -6.538 -0.129 -2.553 1.00 10.00 C ATOM 1096 O ILE A 84 -6.909 -1.086 -1.872 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.248 1.424 -1.049 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.245 2.797 -0.368 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -3.971 1.227 -1.858 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.108 2.994 0.613 1.00 10.00 C ATOM 0 H ILE A 84 -7.840 0.937 -0.387 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.422 2.022 -2.745 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.286 0.653 -0.280 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.189 3.571 -1.133 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.191 2.934 0.156 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.106 1.334 -1.204 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -3.970 0.231 -2.300 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -3.923 1.975 -2.649 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.175 3.989 1.053 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.173 2.244 1.401 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.156 2.891 0.092 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.178 -0.242 -3.823 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.188 -1.529 -4.513 1.00 10.00 C ATOM 1114 C ASP A 85 -4.867 -2.262 -4.322 1.00 10.00 C ATOM 1115 O ASP A 85 -3.797 -1.658 -4.404 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.438 -1.336 -6.010 1.00 10.00 C ATOM 1117 CG ASP A 85 -7.851 -0.891 -6.330 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.790 -1.690 -6.142 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.026 0.254 -6.801 1.00 10.00 O ATOM 0 H ASP A 85 -5.874 0.542 -4.400 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.993 -2.125 -4.082 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -5.736 -0.597 -6.396 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.233 -2.272 -6.529 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.947 -3.566 -4.072 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.758 -4.391 -3.881 1.00 10.00 C ATOM 1126 C VAL A 86 -3.711 -5.510 -4.918 1.00 10.00 C ATOM 1127 O VAL A 86 -4.661 -6.282 -5.054 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.711 -5.015 -2.468 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -2.385 -5.730 -2.238 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.943 -3.958 -1.400 1.00 10.00 C ATOM 0 H VAL A 86 -5.827 -4.076 -3.997 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.895 -3.736 -4.000 1.00 10.00 H new ATOM 0 HB VAL A 86 -4.513 -5.750 -2.397 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -2.373 -6.162 -1.237 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -2.266 -6.523 -2.977 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.566 -5.018 -2.335 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.905 -4.422 -0.414 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -3.170 -3.193 -1.471 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.921 -3.500 -1.548 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.610 -5.587 -5.650 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.434 -6.609 -6.677 1.00 10.00 C ATOM 1142 C PHE A 87 -1.135 -7.376 -6.453 1.00 10.00 C ATOM 1143 O PHE A 87 -0.329 -7.008 -5.596 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.427 -5.976 -8.071 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.776 -5.492 -8.519 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.650 -6.344 -9.173 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -4.170 -4.186 -8.280 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -5.893 -5.901 -9.583 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.410 -3.736 -8.687 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.274 -4.596 -9.339 1.00 10.00 C ATOM 0 H PHE A 87 -1.819 -4.951 -5.553 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.271 -7.304 -6.609 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.730 -5.138 -8.077 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.055 -6.706 -8.790 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.357 -7.366 -9.365 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.499 -3.511 -7.769 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.566 -6.574 -10.094 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.704 -2.715 -8.497 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.246 -4.248 -9.657 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.936 -8.437 -7.225 1.00 10.00 N ATOM 1161 CA GLN A 88 0.269 -9.255 -7.120 1.00 10.00 C ATOM 1162 C GLN A 88 1.018 -9.267 -8.447 1.00 10.00 C ATOM 1163 O GLN A 88 0.405 -9.226 -9.517 1.00 10.00 O ATOM 1164 CB GLN A 88 -0.088 -10.688 -6.710 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.477 -10.829 -5.246 1.00 10.00 C ATOM 1166 CD GLN A 88 0.578 -11.547 -4.424 1.00 10.00 C ATOM 1167 OE1 GLN A 88 1.768 -11.502 -4.735 1.00 10.00 O ATOM 1168 NE2 GLN A 88 0.147 -12.211 -3.362 1.00 10.00 N ATOM 0 H GLN A 88 -1.597 -8.754 -7.935 1.00 10.00 H new ATOM 0 HA GLN A 88 0.912 -8.821 -6.354 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.912 -11.039 -7.331 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.763 -11.337 -6.914 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.649 -9.839 -4.823 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.419 -11.373 -5.176 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -0.848 -12.224 -3.138 1.00 10.00 H new ATOM 0 HE22 GLN A 88 0.810 -12.709 -2.768 1.00 10.00 H new ATOM 1177 N GLN A 89 2.339 -9.312 -8.375 1.00 10.00 N ATOM 1178 CA GLN A 89 3.167 -9.330 -9.568 1.00 10.00 C ATOM 1179 C GLN A 89 3.228 -10.739 -10.151 1.00 10.00 C ATOM 1180 O GLN A 89 3.282 -11.727 -9.415 1.00 10.00 O ATOM 1181 CB GLN A 89 4.577 -8.828 -9.238 1.00 10.00 C ATOM 1182 CG GLN A 89 5.452 -8.596 -10.460 1.00 10.00 C ATOM 1183 CD GLN A 89 4.861 -7.584 -11.420 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.186 -6.642 -11.013 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.113 -7.772 -12.706 1.00 10.00 N ATOM 0 H GLN A 89 2.861 -9.337 -7.499 1.00 10.00 H new ATOM 0 HA GLN A 89 2.724 -8.667 -10.312 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.498 -7.896 -8.678 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.066 -9.552 -8.586 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.435 -8.253 -10.138 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.599 -9.542 -10.981 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.678 -8.567 -13.004 1.00 10.00 H new ATOM 0 HE22 GLN A 89 4.742 -7.122 -13.399 1.00 10.00 H new ATOM 1194 N GLN A 90 3.205 -10.823 -11.476 1.00 10.00 N ATOM 1195 CA GLN A 90 3.260 -12.104 -12.169 1.00 10.00 C ATOM 1196 C GLN A 90 4.627 -12.752 -11.975 1.00 10.00 C ATOM 1197 O GLN A 90 5.635 -12.055 -11.850 1.00 10.00 O ATOM 1198 CB GLN A 90 2.987 -11.921 -13.667 1.00 10.00 C ATOM 1199 CG GLN A 90 1.582 -11.424 -13.995 1.00 10.00 C ATOM 1200 CD GLN A 90 1.383 -9.950 -13.694 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.333 -9.164 -13.706 1.00 10.00 O ATOM 1202 NE2 GLN A 90 0.147 -9.562 -13.423 1.00 10.00 N ATOM 0 H GLN A 90 3.148 -10.014 -12.095 1.00 10.00 H new ATOM 0 HA GLN A 90 2.492 -12.751 -11.747 1.00 10.00 H new ATOM 0 HB2 GLN A 90 3.713 -11.216 -14.073 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.150 -12.873 -14.173 1.00 10.00 H new ATOM 0 HG2 GLN A 90 1.378 -11.603 -15.051 1.00 10.00 H new ATOM 0 HG3 GLN A 90 0.856 -12.005 -13.426 1.00 10.00 H new ATOM 0 HE21 GLN A 90 -0.613 -10.243 -13.423 1.00 10.00 H new ATOM 0 HE22 GLN A 90 -0.046 -8.582 -13.214 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.553 -8.829 7.691 1.00 10.00 N ATOM 1248 CA ASN B 358 -12.026 -8.414 8.976 1.00 10.00 C ATOM 1249 C ASN B 358 -11.427 -7.025 8.894 1.00 10.00 C ATOM 1250 O ASN B 358 -10.680 -6.720 7.964 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.983 -9.415 9.492 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.648 -9.318 8.777 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -9.558 -9.513 7.563 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -8.599 -9.016 9.525 1.00 10.00 N ATOM 0 HA ASN B 358 -12.856 -8.389 9.682 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.828 -9.250 10.558 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -11.374 -10.426 9.380 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -7.675 -8.937 9.100 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -8.714 -8.862 10.527 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.800 -6.158 9.828 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.249 -4.817 9.843 1.00 10.00 C ATOM 1263 C ARG B 359 -10.503 -4.532 11.151 1.00 10.00 C ATOM 1264 O ARG B 359 -11.030 -4.708 12.257 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.349 -3.774 9.585 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.294 -3.528 10.749 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.376 -2.529 10.362 1.00 10.00 C ATOM 1268 NE ARG B 359 -13.823 -1.335 9.709 1.00 10.00 N ATOM 1269 CZ ARG B 359 -14.540 -0.492 8.968 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -15.854 -0.654 8.853 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -13.942 0.517 8.344 1.00 10.00 N ATOM 0 H ARG B 359 -12.470 -6.358 10.571 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.521 -4.744 9.035 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -11.876 -2.830 9.316 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.935 -4.093 8.723 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.753 -4.468 11.056 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -12.734 -3.152 11.605 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -15.089 -3.010 9.692 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -14.928 -2.231 11.253 1.00 10.00 H new ATOM 0 HE ARG B 359 -12.829 -1.140 9.830 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.317 -1.426 9.333 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -16.400 -0.006 8.285 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -12.934 0.646 8.432 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -14.491 1.163 7.776 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.246 -4.141 10.987 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.343 -3.788 12.083 1.00 10.00 C ATOM 1287 C ASP B 360 -7.770 -2.394 11.815 1.00 10.00 C ATOM 1288 O ASP B 360 -7.493 -2.067 10.658 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.247 -4.849 12.285 1.00 10.00 C ATOM 1290 CG ASP B 360 -5.906 -4.471 11.697 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -5.696 -4.745 10.504 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.044 -3.940 12.435 1.00 10.00 O ATOM 0 H ASP B 360 -8.812 -4.057 10.068 1.00 10.00 H new ATOM 0 HA ASP B 360 -8.898 -3.764 13.021 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.125 -5.031 13.353 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.577 -5.786 11.837 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.606 -1.529 12.830 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.110 -0.181 12.611 1.00 10.00 C ATOM 1299 C PRO B 361 -5.654 -0.007 13.049 1.00 10.00 C ATOM 1300 O PRO B 361 -5.262 -0.338 14.168 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.038 0.621 13.536 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.433 -0.332 14.638 1.00 10.00 C ATOM 1303 CD PRO B 361 -7.994 -1.721 14.228 1.00 10.00 C ATOM 0 HA PRO B 361 -7.116 0.114 11.562 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.529 1.497 13.939 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.914 0.981 12.996 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -7.962 -0.045 15.578 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.511 -0.304 14.799 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.162 -2.080 14.835 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -8.800 -2.448 14.330 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.859 0.536 12.128 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.426 0.734 12.337 1.00 10.00 C ATOM 1313 C ILE B 362 -3.055 2.205 12.267 1.00 10.00 C ATOM 1314 O ILE B 362 -3.464 2.912 11.351 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.592 -0.028 11.276 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.161 -1.426 11.031 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.131 -0.121 11.687 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -4.033 -1.503 9.801 1.00 10.00 C ATOM 0 H ILE B 362 -5.190 0.851 11.216 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.201 0.346 13.330 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.651 0.538 10.346 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.338 -2.134 10.931 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.742 -1.733 11.901 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.572 -0.661 10.923 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.719 0.882 11.797 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.053 -0.651 12.636 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.406 -2.520 9.682 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -4.874 -0.818 9.908 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -3.449 -1.226 8.923 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.283 2.659 13.237 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.851 4.046 13.283 1.00 10.00 C ATOM 1332 C VAL B 363 -0.332 4.117 13.180 1.00 10.00 C ATOM 1333 O VAL B 363 0.381 3.413 13.898 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.294 4.734 14.595 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -1.832 6.182 14.639 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.800 4.652 14.758 1.00 10.00 C ATOM 0 H VAL B 363 -1.940 2.085 14.008 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.314 4.565 12.443 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.825 4.206 15.425 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.158 6.640 15.573 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -0.744 6.219 14.577 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.262 6.727 13.798 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.093 5.142 15.687 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.285 5.149 13.918 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.106 3.606 14.787 1.00 10.00 H new ATOM 1346 N ILE B 364 0.158 4.952 12.272 1.00 10.00 N ATOM 1347 CA ILE B 364 1.591 5.123 12.092 1.00 10.00 C ATOM 1348 C ILE B 364 1.977 6.574 12.330 1.00 10.00 C ATOM 1349 O ILE B 364 1.370 7.483 11.764 1.00 10.00 O ATOM 1350 CB ILE B 364 2.051 4.722 10.673 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.624 3.291 10.342 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.559 4.861 10.548 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.877 2.896 8.900 1.00 10.00 C ATOM 0 H ILE B 364 -0.417 5.520 11.650 1.00 10.00 H new ATOM 0 HA ILE B 364 2.081 4.470 12.814 1.00 10.00 H new ATOM 0 HB ILE B 364 1.573 5.394 9.960 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.157 2.602 10.997 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.562 3.179 10.559 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.869 4.575 9.543 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.846 5.896 10.735 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.046 4.212 11.276 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.549 1.869 8.741 1.00 10.00 H new ATOM 0 HD12 ILE B 364 1.322 3.561 8.238 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.942 2.974 8.683 1.00 10.00 H new ATOM 1365 N SER B 365 2.965 6.790 13.178 1.00 10.00 N ATOM 1366 CA SER B 365 3.431 8.134 13.452 1.00 10.00 C ATOM 1367 C SER B 365 4.916 8.258 13.125 1.00 10.00 C ATOM 1368 O SER B 365 5.733 7.456 13.579 1.00 10.00 O ATOM 1369 CB SER B 365 3.171 8.481 14.917 1.00 10.00 C ATOM 1370 OG SER B 365 3.061 7.306 15.708 1.00 10.00 O ATOM 0 H SER B 365 3.458 6.055 13.686 1.00 10.00 H new ATOM 0 HA SER B 365 2.885 8.836 12.822 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.981 9.104 15.296 1.00 10.00 H new ATOM 0 HB3 SER B 365 2.255 9.065 14.999 1.00 10.00 H new ATOM 0 HG SER B 365 2.896 7.554 16.642 1.00 10.00 H new