USER MOD reduce.3.24.130724 H: found=0, std=0, add=714, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 713 hydrogens (8 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 NoAdj-H: B 365 SEP H2 : B 365 SEP N : B 364 ILE C :(H bumps) USER MOD NoAdj-H: B 367 SEP H2 : B 367 SEP N : B 366 ASP C :(H bumps) USER MOD Set 1.1: A 45 LYS NZ :NH3+ 161:sc= 1.98 (180deg=1.16) USER MOD Set 1.2: A 59 MET CE :methyl -153:sc= -0.866 (180deg=-1.13) USER MOD Single : A 21 TYR OH : rot 0:sc= 1.18 USER MOD Single : A 23 LYS NZ :NH3+ -163:sc= 1.87 (180deg=1.46) USER MOD Single : A 25 LYS NZ :NH3+ 164:sc= 1.23 (180deg=1.13) USER MOD Single : A 29 GLN : amide:sc= -1.07 K(o=-1.1,f=-1.8) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -139:sc= 1.16 USER MOD Single : A 35 HIS : no HD1:sc= -2.61! C(o=-2.6!,f=-4.1!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -163:sc= 1.28 (180deg=1.08) USER MOD Single : A 40 MET CE :methyl 138:sc= -0.0958 (180deg=-0.827) USER MOD Single : A 41 THR OG1 : rot 3:sc= 0.397 USER MOD Single : A 42 THR OG1 : rot -44:sc= -1.27! USER MOD Single : A 43 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.55) USER MOD Single : A 46 LYS NZ :NH3+ -168:sc= 1.44 (180deg=0.952!) USER MOD Single : A 48 LYS NZ :NH3+ 165:sc= 2.16 (180deg=1.64) USER MOD Single : A 50 SER OG : rot 82:sc= 0.536 USER MOD Single : A 51 TYR OH : rot -140:sc= -0.307 USER MOD Single : A 52 CYS SG : rot 57:sc= -1.09! USER MOD Single : A 53 GLN : amide:sc= -2.06! C(o=-2.1!,f=-4.6!) USER MOD Single : A 55 GLN : amide:sc= -0.225 X(o=-0.23,f=-0.38) USER MOD Single : A 60 ASN : amide:sc= -0.18 X(o=-0.18,f=0) USER MOD Single : A 61 SER OG : rot -119:sc= 1.25 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 74 ASN : amide:sc= 0.0364 K(o=0.036,f=-3!) USER MOD Single : A 75 HIS : no HD1:sc= 0.878 K(o=0.88,f=-5.2!) USER MOD Single : A 76 THR OG1 : rot -54:sc= 1.11 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.101 K(o=-0.1,f=-1.6) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0126 USER MOD Single : B 357 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 358 ASN : amide:sc= -0.0375 K(o=-0.038,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.824 6.289 9.532 1.00 10.00 N ATOM 2 CA TYR A 21 2.910 5.426 8.332 1.00 10.00 C ATOM 3 C TYR A 21 1.532 4.902 7.948 1.00 10.00 C ATOM 4 O TYR A 21 0.611 4.892 8.764 1.00 10.00 O ATOM 5 CB TYR A 21 3.852 4.242 8.583 1.00 10.00 C ATOM 6 CG TYR A 21 5.279 4.473 8.137 1.00 10.00 C ATOM 7 CD1 TYR A 21 5.908 3.581 7.276 1.00 10.00 C ATOM 8 CD2 TYR A 21 6.000 5.575 8.576 1.00 10.00 C ATOM 9 CE1 TYR A 21 7.211 3.782 6.867 1.00 10.00 C ATOM 10 CE2 TYR A 21 7.304 5.784 8.171 1.00 10.00 C ATOM 11 CZ TYR A 21 7.905 4.885 7.317 1.00 10.00 C ATOM 12 OH TYR A 21 9.203 5.089 6.912 1.00 10.00 O ATOM 0 HA TYR A 21 3.304 6.030 7.515 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.850 4.011 9.648 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.460 3.366 8.066 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.368 2.716 6.921 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.533 6.282 9.246 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.684 3.079 6.198 1.00 10.00 H new ATOM 0 HE2 TYR A 21 7.850 6.647 8.522 1.00 10.00 H new ATOM 0 HH TYR A 21 9.476 4.364 6.313 1.00 10.00 H new ATOM 22 N ILE A 22 1.399 4.477 6.703 1.00 10.00 N ATOM 23 CA ILE A 22 0.146 3.935 6.197 1.00 10.00 C ATOM 24 C ILE A 22 0.380 2.523 5.675 1.00 10.00 C ATOM 25 O ILE A 22 1.149 2.318 4.736 1.00 10.00 O ATOM 26 CB ILE A 22 -0.439 4.820 5.071 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.892 6.175 5.629 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.593 4.119 4.369 1.00 10.00 C ATOM 29 CD1 ILE A 22 -2.057 6.087 6.595 1.00 10.00 C ATOM 0 H ILE A 22 2.152 4.497 6.016 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.574 3.915 7.015 1.00 10.00 H new ATOM 0 HB ILE A 22 0.348 4.994 4.337 1.00 10.00 H new ATOM 0 HG12 ILE A 22 -0.050 6.648 6.134 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -1.171 6.823 4.798 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.986 4.763 3.582 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.239 3.186 3.931 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.382 3.905 5.090 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -2.317 7.086 6.944 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.916 5.645 6.090 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.778 5.467 7.446 1.00 10.00 H new ATOM 41 N LYS A 23 -0.264 1.549 6.291 1.00 10.00 N ATOM 42 CA LYS A 23 -0.100 0.162 5.890 1.00 10.00 C ATOM 43 C LYS A 23 -1.169 -0.246 4.881 1.00 10.00 C ATOM 44 O LYS A 23 -2.367 -0.200 5.168 1.00 10.00 O ATOM 45 CB LYS A 23 -0.155 -0.741 7.121 1.00 10.00 C ATOM 46 CG LYS A 23 0.242 -2.181 6.854 1.00 10.00 C ATOM 47 CD LYS A 23 -0.317 -3.109 7.919 1.00 10.00 C ATOM 48 CE LYS A 23 -1.745 -3.526 7.603 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.747 -2.694 8.316 1.00 10.00 N ATOM 0 H LYS A 23 -0.906 1.692 7.071 1.00 10.00 H new ATOM 0 HA LYS A 23 0.872 0.052 5.409 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.502 -0.331 7.888 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -1.167 -0.724 7.525 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -0.123 -2.486 5.873 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.329 -2.263 6.829 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.313 -3.995 7.997 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.289 -2.611 8.888 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -1.913 -3.452 6.529 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -1.884 -4.572 7.876 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.668 -3.177 8.307 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.441 -2.549 9.299 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -2.834 -1.773 7.841 1.00 10.00 H new ATOM 63 N LEU A 24 -0.723 -0.642 3.698 1.00 10.00 N ATOM 64 CA LEU A 24 -1.626 -1.065 2.637 1.00 10.00 C ATOM 65 C LEU A 24 -1.644 -2.586 2.540 1.00 10.00 C ATOM 66 O LEU A 24 -0.609 -3.236 2.706 1.00 10.00 O ATOM 67 CB LEU A 24 -1.191 -0.470 1.293 1.00 10.00 C ATOM 68 CG LEU A 24 -1.044 1.053 1.260 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.457 1.498 -0.071 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.385 1.727 1.499 1.00 10.00 C ATOM 0 H LEU A 24 0.265 -0.679 3.447 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.628 -0.707 2.875 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.237 -0.915 1.011 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -1.917 -0.763 0.534 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.364 1.350 2.059 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.358 2.583 -0.080 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.524 1.043 -0.206 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -1.116 1.187 -0.882 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.258 2.809 1.472 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -3.088 1.424 0.723 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.772 1.432 2.474 1.00 10.00 H new ATOM 82 N LYS A 25 -2.812 -3.148 2.270 1.00 10.00 N ATOM 83 CA LYS A 25 -2.947 -4.590 2.146 1.00 10.00 C ATOM 84 C LYS A 25 -2.968 -4.998 0.683 1.00 10.00 C ATOM 85 O LYS A 25 -3.985 -4.858 0.000 1.00 10.00 O ATOM 86 CB LYS A 25 -4.216 -5.089 2.843 1.00 10.00 C ATOM 87 CG LYS A 25 -4.073 -5.235 4.349 1.00 10.00 C ATOM 88 CD LYS A 25 -5.160 -6.129 4.932 1.00 10.00 C ATOM 89 CE LYS A 25 -4.864 -7.605 4.699 1.00 10.00 C ATOM 90 NZ LYS A 25 -5.916 -8.487 5.271 1.00 10.00 N ATOM 0 H LYS A 25 -3.679 -2.628 2.133 1.00 10.00 H new ATOM 0 HA LYS A 25 -2.085 -5.047 2.632 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -5.032 -4.398 2.630 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.497 -6.053 2.419 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -3.094 -5.652 4.583 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -4.121 -4.252 4.817 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -5.250 -5.941 6.002 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -6.120 -5.875 4.482 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -4.778 -7.792 3.629 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -3.901 -7.855 5.144 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.827 -9.441 4.867 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -5.804 -8.536 6.304 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.854 -8.101 5.043 1.00 10.00 H new ATOM 104 N VAL A 26 -1.833 -5.479 0.203 1.00 10.00 N ATOM 105 CA VAL A 26 -1.717 -5.927 -1.171 1.00 10.00 C ATOM 106 C VAL A 26 -2.161 -7.378 -1.258 1.00 10.00 C ATOM 107 O VAL A 26 -1.570 -8.248 -0.624 1.00 10.00 O ATOM 108 CB VAL A 26 -0.273 -5.804 -1.708 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.271 -5.750 -3.229 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.426 -4.584 -1.124 1.00 10.00 C ATOM 0 H VAL A 26 -0.976 -5.569 0.749 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.352 -5.288 -1.784 1.00 10.00 H new ATOM 0 HB VAL A 26 0.281 -6.689 -1.394 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.754 -5.663 -3.589 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -0.719 -6.661 -3.626 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -0.847 -4.887 -3.563 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.440 -4.522 -1.519 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.125 -3.684 -1.396 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.464 -4.672 -0.038 1.00 10.00 H new ATOM 120 N ILE A 27 -3.209 -7.633 -2.020 1.00 10.00 N ATOM 121 CA ILE A 27 -3.732 -8.982 -2.152 1.00 10.00 C ATOM 122 C ILE A 27 -3.208 -9.663 -3.407 1.00 10.00 C ATOM 123 O ILE A 27 -3.522 -9.256 -4.531 1.00 10.00 O ATOM 124 CB ILE A 27 -5.276 -8.999 -2.173 1.00 10.00 C ATOM 125 CG1 ILE A 27 -5.842 -8.290 -0.936 1.00 10.00 C ATOM 126 CG2 ILE A 27 -5.792 -10.430 -2.250 1.00 10.00 C ATOM 127 CD1 ILE A 27 -5.452 -8.934 0.378 1.00 10.00 C ATOM 0 H ILE A 27 -3.714 -6.927 -2.556 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.386 -9.532 -1.277 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.613 -8.462 -3.060 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.501 -7.255 -0.936 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -6.929 -8.268 -1.009 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.882 -10.424 -2.264 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.420 -10.902 -3.159 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -5.444 -10.990 -1.382 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -5.892 -8.373 1.203 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -5.817 -9.961 0.402 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -4.366 -8.932 0.476 1.00 10.00 H new ATOM 139 N GLY A 28 -2.392 -10.686 -3.208 1.00 10.00 N ATOM 140 CA GLY A 28 -1.856 -11.437 -4.320 1.00 10.00 C ATOM 141 C GLY A 28 -2.840 -12.488 -4.786 1.00 10.00 C ATOM 142 O GLY A 28 -3.735 -12.880 -4.033 1.00 10.00 O ATOM 0 H GLY A 28 -2.090 -11.010 -2.289 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.624 -10.761 -5.143 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -0.921 -11.914 -4.025 1.00 10.00 H new ATOM 146 N GLN A 29 -2.674 -12.964 -6.014 1.00 10.00 N ATOM 147 CA GLN A 29 -3.575 -13.967 -6.573 1.00 10.00 C ATOM 148 C GLN A 29 -3.449 -15.303 -5.835 1.00 10.00 C ATOM 149 O GLN A 29 -4.345 -16.144 -5.902 1.00 10.00 O ATOM 150 CB GLN A 29 -3.300 -14.153 -8.068 1.00 10.00 C ATOM 151 CG GLN A 29 -4.408 -14.890 -8.809 1.00 10.00 C ATOM 152 CD GLN A 29 -5.746 -14.183 -8.724 1.00 10.00 C ATOM 153 OE1 GLN A 29 -6.070 -13.340 -9.561 1.00 10.00 O ATOM 154 NE2 GLN A 29 -6.537 -14.525 -7.720 1.00 10.00 N ATOM 0 H GLN A 29 -1.925 -12.673 -6.642 1.00 10.00 H new ATOM 0 HA GLN A 29 -4.597 -13.611 -6.444 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -3.158 -13.174 -8.526 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -2.366 -14.702 -8.191 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -4.127 -15.000 -9.856 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -4.507 -15.895 -8.398 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -6.232 -15.228 -7.047 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -7.452 -14.086 -7.619 1.00 10.00 H new ATOM 163 N ASP A 30 -2.339 -15.488 -5.128 1.00 10.00 N ATOM 164 CA ASP A 30 -2.099 -16.714 -4.369 1.00 10.00 C ATOM 165 C ASP A 30 -2.517 -16.546 -2.908 1.00 10.00 C ATOM 166 O ASP A 30 -1.980 -17.208 -2.022 1.00 10.00 O ATOM 167 CB ASP A 30 -0.622 -17.138 -4.455 1.00 10.00 C ATOM 168 CG ASP A 30 0.338 -15.963 -4.472 1.00 10.00 C ATOM 169 OD1 ASP A 30 0.389 -15.249 -5.501 1.00 10.00 O ATOM 170 OD2 ASP A 30 1.046 -15.744 -3.465 1.00 10.00 O ATOM 0 H ASP A 30 -1.587 -14.802 -5.064 1.00 10.00 H new ATOM 0 HA ASP A 30 -2.709 -17.500 -4.814 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -0.385 -17.780 -3.607 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.474 -17.733 -5.356 1.00 10.00 H new ATOM 175 N SER A 31 -3.490 -15.658 -2.675 1.00 10.00 N ATOM 176 CA SER A 31 -4.017 -15.389 -1.331 1.00 10.00 C ATOM 177 C SER A 31 -2.936 -14.827 -0.407 1.00 10.00 C ATOM 178 O SER A 31 -2.932 -15.082 0.799 1.00 10.00 O ATOM 179 CB SER A 31 -4.623 -16.661 -0.729 1.00 10.00 C ATOM 180 OG SER A 31 -5.597 -17.224 -1.598 1.00 10.00 O ATOM 0 H SER A 31 -3.934 -15.107 -3.410 1.00 10.00 H new ATOM 0 HA SER A 31 -4.799 -14.636 -1.427 1.00 10.00 H new ATOM 0 HB2 SER A 31 -3.834 -17.390 -0.541 1.00 10.00 H new ATOM 0 HB3 SER A 31 -5.080 -16.430 0.233 1.00 10.00 H new ATOM 0 HG SER A 31 -5.968 -18.035 -1.192 1.00 10.00 H new ATOM 186 N SER A 32 -2.032 -14.053 -0.978 1.00 10.00 N ATOM 187 CA SER A 32 -0.954 -13.457 -0.218 1.00 10.00 C ATOM 188 C SER A 32 -1.320 -12.041 0.204 1.00 10.00 C ATOM 189 O SER A 32 -1.430 -11.148 -0.634 1.00 10.00 O ATOM 190 CB SER A 32 0.321 -13.446 -1.063 1.00 10.00 C ATOM 191 OG SER A 32 0.007 -13.556 -2.442 1.00 10.00 O ATOM 0 H SER A 32 -2.025 -13.823 -1.972 1.00 10.00 H new ATOM 0 HA SER A 32 -0.783 -14.048 0.682 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.875 -12.525 -0.883 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.968 -14.271 -0.765 1.00 10.00 H new ATOM 0 HG SER A 32 0.648 -14.156 -2.877 1.00 10.00 H new ATOM 197 N GLU A 33 -1.546 -11.846 1.493 1.00 10.00 N ATOM 198 CA GLU A 33 -1.881 -10.528 2.006 1.00 10.00 C ATOM 199 C GLU A 33 -0.606 -9.815 2.427 1.00 10.00 C ATOM 200 O GLU A 33 -0.069 -10.066 3.507 1.00 10.00 O ATOM 201 CB GLU A 33 -2.840 -10.629 3.192 1.00 10.00 C ATOM 202 CG GLU A 33 -3.911 -11.694 3.033 1.00 10.00 C ATOM 203 CD GLU A 33 -4.608 -12.000 4.338 1.00 10.00 C ATOM 204 OE1 GLU A 33 -4.313 -13.053 4.939 1.00 10.00 O ATOM 205 OE2 GLU A 33 -5.453 -11.185 4.772 1.00 10.00 O ATOM 0 H GLU A 33 -1.504 -12.580 2.200 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.378 -9.961 1.219 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.265 -10.839 4.094 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.322 -9.663 3.339 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.646 -11.362 2.300 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.460 -12.606 2.641 1.00 10.00 H new ATOM 212 N ILE A 34 -0.112 -8.949 1.560 1.00 10.00 N ATOM 213 CA ILE A 34 1.108 -8.214 1.840 1.00 10.00 C ATOM 214 C ILE A 34 0.796 -6.938 2.611 1.00 10.00 C ATOM 215 O ILE A 34 -0.053 -6.147 2.204 1.00 10.00 O ATOM 216 CB ILE A 34 1.874 -7.844 0.550 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.775 -8.958 -0.503 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.330 -7.548 0.878 1.00 10.00 C ATOM 219 CD1 ILE A 34 2.485 -10.239 -0.122 1.00 10.00 C ATOM 0 H ILE A 34 -0.537 -8.738 0.657 1.00 10.00 H new ATOM 0 HA ILE A 34 1.740 -8.870 2.439 1.00 10.00 H new ATOM 0 HB ILE A 34 1.414 -6.951 0.127 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.723 -9.179 -0.683 1.00 10.00 H new ATOM 0 HG13 ILE A 34 2.189 -8.592 -1.442 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.863 -7.288 -0.036 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.383 -6.715 1.578 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.788 -8.429 1.327 1.00 10.00 H new ATOM 0 HD11 ILE A 34 2.366 -10.972 -0.920 1.00 10.00 H new ATOM 0 HD12 ILE A 34 3.545 -10.036 0.029 1.00 10.00 H new ATOM 0 HD13 ILE A 34 2.056 -10.632 0.800 1.00 10.00 H new ATOM 231 N HIS A 35 1.479 -6.751 3.724 1.00 10.00 N ATOM 232 CA HIS A 35 1.287 -5.581 4.563 1.00 10.00 C ATOM 233 C HIS A 35 2.439 -4.609 4.348 1.00 10.00 C ATOM 234 O HIS A 35 3.435 -4.633 5.073 1.00 10.00 O ATOM 235 CB HIS A 35 1.201 -5.984 6.041 1.00 10.00 C ATOM 236 CG HIS A 35 0.030 -6.866 6.376 1.00 10.00 C ATOM 237 ND1 HIS A 35 -0.860 -6.537 7.375 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.343 -8.051 5.831 1.00 10.00 C ATOM 239 CE1 HIS A 35 -1.745 -7.521 7.414 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.470 -8.458 6.498 1.00 10.00 N ATOM 0 H HIS A 35 2.181 -7.403 4.073 1.00 10.00 H new ATOM 0 HA HIS A 35 0.350 -5.097 4.288 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.120 -6.500 6.319 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.146 -5.081 6.649 1.00 10.00 H new ATOM 0 HD2 HIS A 35 0.153 -8.574 5.026 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -2.581 -7.562 8.097 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -1.999 -9.313 6.328 1.00 10.00 H new ATOM 248 N PHE A 36 2.308 -3.770 3.335 1.00 10.00 N ATOM 249 CA PHE A 36 3.344 -2.802 3.014 1.00 10.00 C ATOM 250 C PHE A 36 3.108 -1.498 3.763 1.00 10.00 C ATOM 251 O PHE A 36 2.075 -0.852 3.591 1.00 10.00 O ATOM 252 CB PHE A 36 3.382 -2.539 1.506 1.00 10.00 C ATOM 253 CG PHE A 36 4.775 -2.382 0.958 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.730 -1.651 1.648 1.00 10.00 C ATOM 255 CD2 PHE A 36 5.128 -2.966 -0.248 1.00 10.00 C ATOM 256 CE1 PHE A 36 7.009 -1.511 1.149 1.00 10.00 C ATOM 257 CE2 PHE A 36 6.408 -2.827 -0.752 1.00 10.00 C ATOM 258 CZ PHE A 36 7.348 -2.097 -0.054 1.00 10.00 C ATOM 0 H PHE A 36 1.495 -3.739 2.720 1.00 10.00 H new ATOM 0 HA PHE A 36 4.304 -3.215 3.324 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.888 -3.362 0.989 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.811 -1.637 1.288 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.470 -1.186 2.587 1.00 10.00 H new ATOM 0 HD2 PHE A 36 4.395 -3.536 -0.800 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.744 -0.943 1.699 1.00 10.00 H new ATOM 0 HE2 PHE A 36 6.672 -3.290 -1.692 1.00 10.00 H new ATOM 0 HZ PHE A 36 8.347 -1.984 -0.448 1.00 10.00 H new ATOM 268 N LYS A 37 4.063 -1.123 4.598 1.00 10.00 N ATOM 269 CA LYS A 37 3.960 0.102 5.371 1.00 10.00 C ATOM 270 C LYS A 37 4.584 1.261 4.603 1.00 10.00 C ATOM 271 O LYS A 37 5.805 1.403 4.563 1.00 10.00 O ATOM 272 CB LYS A 37 4.648 -0.071 6.725 1.00 10.00 C ATOM 273 CG LYS A 37 3.768 0.293 7.909 1.00 10.00 C ATOM 274 CD LYS A 37 4.470 0.035 9.233 1.00 10.00 C ATOM 275 CE LYS A 37 4.555 -1.452 9.547 1.00 10.00 C ATOM 276 NZ LYS A 37 5.195 -1.707 10.863 1.00 10.00 N ATOM 0 H LYS A 37 4.921 -1.652 4.758 1.00 10.00 H new ATOM 0 HA LYS A 37 2.907 0.324 5.541 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.971 -1.107 6.829 1.00 10.00 H new ATOM 0 HB3 LYS A 37 5.546 0.547 6.748 1.00 10.00 H new ATOM 0 HG2 LYS A 37 3.488 1.344 7.845 1.00 10.00 H new ATOM 0 HG3 LYS A 37 2.845 -0.286 7.868 1.00 10.00 H new ATOM 0 HD2 LYS A 37 5.474 0.458 9.200 1.00 10.00 H new ATOM 0 HD3 LYS A 37 3.935 0.546 10.034 1.00 10.00 H new ATOM 0 HE2 LYS A 37 3.553 -1.881 9.542 1.00 10.00 H new ATOM 0 HE3 LYS A 37 5.122 -1.956 8.764 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 5.233 -2.731 11.038 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 6.160 -1.320 10.860 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 4.640 -1.248 11.614 1.00 10.00 H new ATOM 290 N VAL A 38 3.739 2.078 3.989 1.00 10.00 N ATOM 291 CA VAL A 38 4.198 3.218 3.208 1.00 10.00 C ATOM 292 C VAL A 38 4.137 4.500 4.034 1.00 10.00 C ATOM 293 O VAL A 38 3.608 4.506 5.147 1.00 10.00 O ATOM 294 CB VAL A 38 3.360 3.392 1.914 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.115 2.044 1.250 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.035 4.091 2.194 1.00 10.00 C ATOM 0 H VAL A 38 2.725 1.971 4.018 1.00 10.00 H new ATOM 0 HA VAL A 38 5.233 3.022 2.927 1.00 10.00 H new ATOM 0 HB VAL A 38 3.933 4.022 1.234 1.00 10.00 H new ATOM 0 HG11 VAL A 38 2.526 2.186 0.344 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.070 1.586 0.993 1.00 10.00 H new ATOM 0 HG13 VAL A 38 2.573 1.393 1.937 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.475 4.195 1.265 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.455 3.500 2.903 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.226 5.078 2.615 1.00 10.00 H new ATOM 306 N LYS A 39 4.678 5.582 3.495 1.00 10.00 N ATOM 307 CA LYS A 39 4.673 6.862 4.186 1.00 10.00 C ATOM 308 C LYS A 39 4.005 7.918 3.313 1.00 10.00 C ATOM 309 O LYS A 39 4.195 7.936 2.096 1.00 10.00 O ATOM 310 CB LYS A 39 6.101 7.284 4.541 1.00 10.00 C ATOM 311 CG LYS A 39 6.174 8.523 5.419 1.00 10.00 C ATOM 312 CD LYS A 39 7.610 8.862 5.781 1.00 10.00 C ATOM 313 CE LYS A 39 7.706 10.207 6.481 1.00 10.00 C ATOM 314 NZ LYS A 39 9.105 10.706 6.540 1.00 10.00 N ATOM 0 H LYS A 39 5.127 5.599 2.579 1.00 10.00 H new ATOM 0 HA LYS A 39 4.107 6.762 5.112 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.598 6.459 5.051 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.655 7.469 3.621 1.00 10.00 H new ATOM 0 HG2 LYS A 39 5.719 9.366 4.899 1.00 10.00 H new ATOM 0 HG3 LYS A 39 5.596 8.360 6.329 1.00 10.00 H new ATOM 0 HD2 LYS A 39 8.016 8.084 6.428 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.220 8.876 4.878 1.00 10.00 H new ATOM 0 HE2 LYS A 39 7.084 10.933 5.958 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.310 10.118 7.493 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 9.176 11.457 7.256 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 9.742 9.924 6.794 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.377 11.086 5.611 1.00 10.00 H new ATOM 328 N MET A 40 3.231 8.798 3.937 1.00 10.00 N ATOM 329 CA MET A 40 2.521 9.853 3.218 1.00 10.00 C ATOM 330 C MET A 40 3.456 11.014 2.853 1.00 10.00 C ATOM 331 O MET A 40 3.183 12.174 3.168 1.00 10.00 O ATOM 332 CB MET A 40 1.345 10.355 4.068 1.00 10.00 C ATOM 333 CG MET A 40 0.301 11.138 3.281 1.00 10.00 C ATOM 334 SD MET A 40 -0.443 10.179 1.950 1.00 10.00 S ATOM 335 CE MET A 40 -1.267 8.884 2.877 1.00 10.00 C ATOM 0 H MET A 40 3.078 8.803 4.945 1.00 10.00 H new ATOM 0 HA MET A 40 2.141 9.436 2.285 1.00 10.00 H new ATOM 0 HB2 MET A 40 0.862 9.501 4.542 1.00 10.00 H new ATOM 0 HB3 MET A 40 1.732 10.987 4.868 1.00 10.00 H new ATOM 0 HG2 MET A 40 -0.482 11.474 3.961 1.00 10.00 H new ATOM 0 HG3 MET A 40 0.764 12.031 2.862 1.00 10.00 H new ATOM 0 HE1 MET A 40 -2.253 8.703 2.450 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.676 7.969 2.828 1.00 10.00 H new ATOM 0 HE3 MET A 40 -1.373 9.192 3.917 1.00 10.00 H new ATOM 345 N THR A 41 4.551 10.690 2.178 1.00 10.00 N ATOM 346 CA THR A 41 5.531 11.684 1.751 1.00 10.00 C ATOM 347 C THR A 41 6.296 11.180 0.527 1.00 10.00 C ATOM 348 O THR A 41 6.495 11.914 -0.445 1.00 10.00 O ATOM 349 CB THR A 41 6.537 12.031 2.877 1.00 10.00 C ATOM 350 OG1 THR A 41 5.865 12.685 3.964 1.00 10.00 O ATOM 351 CG2 THR A 41 7.643 12.936 2.356 1.00 10.00 C ATOM 0 H THR A 41 4.786 9.734 1.911 1.00 10.00 H new ATOM 0 HA THR A 41 4.980 12.590 1.499 1.00 10.00 H new ATOM 0 HB THR A 41 6.977 11.098 3.229 1.00 10.00 H new ATOM 0 HG1 THR A 41 4.905 12.731 3.775 1.00 10.00 H new ATOM 0 HG21 THR A 41 8.337 13.166 3.165 1.00 10.00 H new ATOM 0 HG22 THR A 41 8.178 12.431 1.552 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.208 13.861 1.977 1.00 10.00 H new ATOM 359 N THR A 42 6.716 9.923 0.587 1.00 10.00 N ATOM 360 CA THR A 42 7.454 9.302 -0.501 1.00 10.00 C ATOM 361 C THR A 42 6.530 9.001 -1.676 1.00 10.00 C ATOM 362 O THR A 42 5.325 8.811 -1.498 1.00 10.00 O ATOM 363 CB THR A 42 8.091 7.991 -0.024 1.00 10.00 C ATOM 364 OG1 THR A 42 8.080 7.966 1.404 1.00 10.00 O ATOM 365 CG2 THR A 42 9.520 7.861 -0.533 1.00 10.00 C ATOM 0 H THR A 42 6.555 9.310 1.386 1.00 10.00 H new ATOM 0 HA THR A 42 8.230 9.997 -0.822 1.00 10.00 H new ATOM 0 HB THR A 42 7.517 7.153 -0.419 1.00 10.00 H new ATOM 0 HG1 THR A 42 8.357 8.841 1.749 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.948 6.923 -0.180 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.521 7.873 -1.623 1.00 10.00 H new ATOM 0 HG23 THR A 42 10.116 8.694 -0.161 1.00 10.00 H new ATOM 373 N HIS A 43 7.090 8.966 -2.870 1.00 10.00 N ATOM 374 CA HIS A 43 6.312 8.672 -4.060 1.00 10.00 C ATOM 375 C HIS A 43 6.093 7.169 -4.150 1.00 10.00 C ATOM 376 O HIS A 43 6.882 6.389 -3.609 1.00 10.00 O ATOM 377 CB HIS A 43 7.020 9.180 -5.324 1.00 10.00 C ATOM 378 CG HIS A 43 7.911 10.365 -5.093 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.255 10.207 -4.860 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.610 11.688 -5.061 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.742 11.422 -4.688 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.783 12.351 -4.802 1.00 10.00 N ATOM 0 H HIS A 43 8.081 9.137 -3.043 1.00 10.00 H new ATOM 0 HA HIS A 43 5.352 9.183 -3.989 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.614 8.369 -5.745 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.268 9.444 -6.067 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.637 12.132 -5.210 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.780 11.639 -4.482 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.902 13.360 -4.713 1.00 10.00 H new ATOM 390 N LEU A 44 5.041 6.758 -4.842 1.00 10.00 N ATOM 391 CA LEU A 44 4.729 5.340 -4.982 1.00 10.00 C ATOM 392 C LEU A 44 5.753 4.635 -5.868 1.00 10.00 C ATOM 393 O LEU A 44 5.752 3.410 -5.979 1.00 10.00 O ATOM 394 CB LEU A 44 3.314 5.162 -5.534 1.00 10.00 C ATOM 395 CG LEU A 44 2.193 5.521 -4.554 1.00 10.00 C ATOM 396 CD1 LEU A 44 0.853 5.592 -5.268 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.134 4.512 -3.416 1.00 10.00 C ATOM 0 H LEU A 44 4.389 7.383 -5.315 1.00 10.00 H new ATOM 0 HA LEU A 44 4.776 4.880 -3.995 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.207 5.777 -6.427 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.188 4.125 -5.844 1.00 10.00 H new ATOM 0 HG LEU A 44 2.411 6.504 -4.136 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.072 5.848 -4.552 1.00 10.00 H new ATOM 0 HD12 LEU A 44 0.896 6.354 -6.047 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.629 4.625 -5.718 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.332 4.784 -2.730 1.00 10.00 H new ATOM 0 HD22 LEU A 44 1.944 3.518 -3.821 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.084 4.511 -2.881 1.00 10.00 H new ATOM 409 N LYS A 45 6.626 5.421 -6.487 1.00 10.00 N ATOM 410 CA LYS A 45 7.681 4.893 -7.344 1.00 10.00 C ATOM 411 C LYS A 45 8.574 3.945 -6.548 1.00 10.00 C ATOM 412 O LYS A 45 8.840 2.819 -6.972 1.00 10.00 O ATOM 413 CB LYS A 45 8.509 6.050 -7.918 1.00 10.00 C ATOM 414 CG LYS A 45 9.867 5.642 -8.470 1.00 10.00 C ATOM 415 CD LYS A 45 9.732 4.773 -9.705 1.00 10.00 C ATOM 416 CE LYS A 45 11.077 4.541 -10.369 1.00 10.00 C ATOM 417 NZ LYS A 45 10.972 3.621 -11.528 1.00 10.00 N ATOM 0 H LYS A 45 6.623 6.438 -6.410 1.00 10.00 H new ATOM 0 HA LYS A 45 7.231 4.338 -8.168 1.00 10.00 H new ATOM 0 HB2 LYS A 45 7.937 6.530 -8.712 1.00 10.00 H new ATOM 0 HB3 LYS A 45 8.658 6.796 -7.137 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.444 6.534 -8.714 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.424 5.102 -7.704 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.290 3.815 -9.431 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.052 5.247 -10.413 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.488 5.495 -10.699 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.775 4.128 -9.640 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.807 3.734 -12.137 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 10.921 2.639 -11.188 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 10.114 3.844 -12.072 1.00 10.00 H new ATOM 431 N LYS A 46 9.013 4.413 -5.382 1.00 10.00 N ATOM 432 CA LYS A 46 9.868 3.633 -4.500 1.00 10.00 C ATOM 433 C LYS A 46 9.167 2.338 -4.089 1.00 10.00 C ATOM 434 O LYS A 46 9.768 1.267 -4.069 1.00 10.00 O ATOM 435 CB LYS A 46 10.222 4.462 -3.257 1.00 10.00 C ATOM 436 CG LYS A 46 11.031 3.708 -2.212 1.00 10.00 C ATOM 437 CD LYS A 46 12.511 3.667 -2.562 1.00 10.00 C ATOM 438 CE LYS A 46 13.199 4.995 -2.273 1.00 10.00 C ATOM 439 NZ LYS A 46 13.228 5.313 -0.818 1.00 10.00 N ATOM 0 H LYS A 46 8.785 5.341 -5.026 1.00 10.00 H new ATOM 0 HA LYS A 46 10.785 3.376 -5.031 1.00 10.00 H new ATOM 0 HB2 LYS A 46 10.784 5.342 -3.569 1.00 10.00 H new ATOM 0 HB3 LYS A 46 9.300 4.819 -2.798 1.00 10.00 H new ATOM 0 HG2 LYS A 46 10.901 4.183 -1.240 1.00 10.00 H new ATOM 0 HG3 LYS A 46 10.651 2.690 -2.123 1.00 10.00 H new ATOM 0 HD2 LYS A 46 12.997 2.875 -1.993 1.00 10.00 H new ATOM 0 HD3 LYS A 46 12.628 3.419 -3.617 1.00 10.00 H new ATOM 0 HE2 LYS A 46 14.219 4.964 -2.656 1.00 10.00 H new ATOM 0 HE3 LYS A 46 12.682 5.793 -2.807 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 13.517 6.303 -0.685 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 12.281 5.171 -0.413 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 13.907 4.687 -0.339 1.00 10.00 H new ATOM 453 N LEU A 47 7.880 2.449 -3.795 1.00 10.00 N ATOM 454 CA LEU A 47 7.084 1.303 -3.375 1.00 10.00 C ATOM 455 C LEU A 47 6.972 0.264 -4.488 1.00 10.00 C ATOM 456 O LEU A 47 7.052 -0.939 -4.236 1.00 10.00 O ATOM 457 CB LEU A 47 5.680 1.753 -2.945 1.00 10.00 C ATOM 458 CG LEU A 47 5.571 2.356 -1.538 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.202 1.438 -0.508 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.208 3.736 -1.478 1.00 10.00 C ATOM 0 H LEU A 47 7.361 3.326 -3.840 1.00 10.00 H new ATOM 0 HA LEU A 47 7.592 0.844 -2.527 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.319 2.489 -3.664 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.010 0.895 -3.004 1.00 10.00 H new ATOM 0 HG LEU A 47 4.511 2.462 -1.306 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.113 1.886 0.482 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.692 0.475 -0.518 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.256 1.293 -0.747 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.114 4.136 -0.469 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.263 3.662 -1.743 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.704 4.400 -2.180 1.00 10.00 H new ATOM 472 N LYS A 48 6.801 0.734 -5.716 1.00 10.00 N ATOM 473 CA LYS A 48 6.663 -0.154 -6.864 1.00 10.00 C ATOM 474 C LYS A 48 7.928 -0.976 -7.109 1.00 10.00 C ATOM 475 O LYS A 48 7.851 -2.184 -7.339 1.00 10.00 O ATOM 476 CB LYS A 48 6.304 0.643 -8.122 1.00 10.00 C ATOM 477 CG LYS A 48 4.897 1.220 -8.098 1.00 10.00 C ATOM 478 CD LYS A 48 4.608 2.045 -9.345 1.00 10.00 C ATOM 479 CE LYS A 48 4.312 1.162 -10.549 1.00 10.00 C ATOM 480 NZ LYS A 48 4.094 1.961 -11.783 1.00 10.00 N ATOM 0 H LYS A 48 6.754 1.727 -5.944 1.00 10.00 H new ATOM 0 HA LYS A 48 5.855 -0.849 -6.636 1.00 10.00 H new ATOM 0 HB2 LYS A 48 7.019 1.457 -8.242 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.407 -0.004 -8.993 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.172 0.410 -8.021 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.774 1.843 -7.212 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.758 2.702 -9.158 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.463 2.685 -9.564 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.141 0.472 -10.705 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.428 0.558 -10.347 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.149 1.338 -12.614 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.156 2.408 -11.746 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.825 2.697 -11.854 1.00 10.00 H new ATOM 494 N GLU A 49 9.089 -0.331 -7.057 1.00 10.00 N ATOM 495 CA GLU A 49 10.344 -1.036 -7.300 1.00 10.00 C ATOM 496 C GLU A 49 10.723 -1.931 -6.119 1.00 10.00 C ATOM 497 O GLU A 49 11.198 -3.050 -6.318 1.00 10.00 O ATOM 498 CB GLU A 49 11.480 -0.060 -7.639 1.00 10.00 C ATOM 499 CG GLU A 49 11.654 1.080 -6.649 1.00 10.00 C ATOM 500 CD GLU A 49 12.915 1.880 -6.908 1.00 10.00 C ATOM 501 OE1 GLU A 49 12.886 2.796 -7.759 1.00 10.00 O ATOM 502 OE2 GLU A 49 13.944 1.591 -6.267 1.00 10.00 O ATOM 0 H GLU A 49 9.188 0.663 -6.852 1.00 10.00 H new ATOM 0 HA GLU A 49 10.190 -1.680 -8.166 1.00 10.00 H new ATOM 0 HB2 GLU A 49 12.415 -0.618 -7.698 1.00 10.00 H new ATOM 0 HB3 GLU A 49 11.297 0.360 -8.628 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.789 1.741 -6.704 1.00 10.00 H new ATOM 0 HG3 GLU A 49 11.683 0.678 -5.636 1.00 10.00 H new ATOM 509 N SER A 50 10.497 -1.458 -4.896 1.00 10.00 N ATOM 510 CA SER A 50 10.823 -2.243 -3.710 1.00 10.00 C ATOM 511 C SER A 50 9.965 -3.505 -3.633 1.00 10.00 C ATOM 512 O SER A 50 10.414 -4.545 -3.149 1.00 10.00 O ATOM 513 CB SER A 50 10.656 -1.400 -2.447 1.00 10.00 C ATOM 514 OG SER A 50 11.571 -0.316 -2.440 1.00 10.00 O ATOM 0 H SER A 50 10.093 -0.542 -4.701 1.00 10.00 H new ATOM 0 HA SER A 50 11.866 -2.551 -3.785 1.00 10.00 H new ATOM 0 HB2 SER A 50 9.636 -1.021 -2.390 1.00 10.00 H new ATOM 0 HB3 SER A 50 10.815 -2.022 -1.566 1.00 10.00 H new ATOM 0 HG SER A 50 11.215 0.416 -2.985 1.00 10.00 H new ATOM 520 N TYR A 51 8.732 -3.417 -4.125 1.00 10.00 N ATOM 521 CA TYR A 51 7.830 -4.560 -4.119 1.00 10.00 C ATOM 522 C TYR A 51 8.361 -5.661 -5.032 1.00 10.00 C ATOM 523 O TYR A 51 8.269 -6.848 -4.716 1.00 10.00 O ATOM 524 CB TYR A 51 6.427 -4.145 -4.567 1.00 10.00 C ATOM 525 CG TYR A 51 5.386 -5.228 -4.384 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.782 -5.438 -3.150 1.00 10.00 C ATOM 527 CD2 TYR A 51 5.008 -6.046 -5.444 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.833 -6.426 -2.978 1.00 10.00 C ATOM 529 CE2 TYR A 51 4.058 -7.037 -5.279 1.00 10.00 C ATOM 530 CZ TYR A 51 3.476 -7.223 -4.044 1.00 10.00 C ATOM 531 OH TYR A 51 2.530 -8.208 -3.874 1.00 10.00 O ATOM 0 H TYR A 51 8.338 -2.568 -4.531 1.00 10.00 H new ATOM 0 HA TYR A 51 7.772 -4.941 -3.099 1.00 10.00 H new ATOM 0 HB2 TYR A 51 6.122 -3.262 -4.006 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.460 -3.859 -5.618 1.00 10.00 H new ATOM 0 HD1 TYR A 51 5.060 -4.817 -2.311 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.465 -5.904 -6.412 1.00 10.00 H new ATOM 0 HE1 TYR A 51 3.373 -6.574 -2.012 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.774 -7.661 -6.113 1.00 10.00 H new ATOM 0 HH TYR A 51 2.799 -9.009 -4.370 1.00 10.00 H new ATOM 541 N CYS A 52 8.927 -5.250 -6.162 1.00 10.00 N ATOM 542 CA CYS A 52 9.481 -6.190 -7.127 1.00 10.00 C ATOM 543 C CYS A 52 10.638 -6.962 -6.503 1.00 10.00 C ATOM 544 O CYS A 52 10.813 -8.156 -6.754 1.00 10.00 O ATOM 545 CB CYS A 52 9.945 -5.444 -8.378 1.00 10.00 C ATOM 546 SG CYS A 52 8.657 -4.436 -9.158 1.00 10.00 S ATOM 0 H CYS A 52 9.014 -4.270 -6.431 1.00 10.00 H new ATOM 0 HA CYS A 52 8.707 -6.901 -7.415 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.785 -4.801 -8.114 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.314 -6.168 -9.104 1.00 10.00 H new ATOM 0 HG CYS A 52 8.184 -3.590 -8.292 1.00 10.00 H new ATOM 552 N GLN A 53 11.404 -6.276 -5.662 1.00 10.00 N ATOM 553 CA GLN A 53 12.543 -6.878 -4.982 1.00 10.00 C ATOM 554 C GLN A 53 12.073 -7.920 -3.972 1.00 10.00 C ATOM 555 O GLN A 53 12.738 -8.934 -3.748 1.00 10.00 O ATOM 556 CB GLN A 53 13.361 -5.803 -4.266 1.00 10.00 C ATOM 557 CG GLN A 53 13.839 -4.687 -5.179 1.00 10.00 C ATOM 558 CD GLN A 53 14.307 -3.467 -4.408 1.00 10.00 C ATOM 559 OE1 GLN A 53 13.807 -3.172 -3.323 1.00 10.00 O ATOM 560 NE2 GLN A 53 15.270 -2.752 -4.963 1.00 10.00 N ATOM 0 H GLN A 53 11.254 -5.293 -5.434 1.00 10.00 H new ATOM 0 HA GLN A 53 13.168 -7.366 -5.730 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.758 -5.373 -3.467 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.226 -6.271 -3.796 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.655 -5.055 -5.801 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.030 -4.400 -5.851 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.658 -3.031 -5.864 1.00 10.00 H new ATOM 0 HE22 GLN A 53 15.626 -1.921 -4.490 1.00 10.00 H new ATOM 569 N ARG A 54 10.923 -7.660 -3.361 1.00 10.00 N ATOM 570 CA ARG A 54 10.356 -8.570 -2.376 1.00 10.00 C ATOM 571 C ARG A 54 9.922 -9.874 -3.038 1.00 10.00 C ATOM 572 O ARG A 54 10.100 -10.954 -2.479 1.00 10.00 O ATOM 573 CB ARG A 54 9.159 -7.922 -1.676 1.00 10.00 C ATOM 574 CG ARG A 54 8.634 -8.720 -0.489 1.00 10.00 C ATOM 575 CD ARG A 54 9.594 -8.655 0.686 1.00 10.00 C ATOM 576 NE ARG A 54 9.043 -9.257 1.901 1.00 10.00 N ATOM 577 CZ ARG A 54 9.776 -9.556 2.970 1.00 10.00 C ATOM 578 NH1 ARG A 54 11.079 -9.287 2.982 1.00 10.00 N ATOM 579 NH2 ARG A 54 9.213 -10.117 4.029 1.00 10.00 N ATOM 0 H ARG A 54 10.364 -6.824 -3.532 1.00 10.00 H new ATOM 0 HA ARG A 54 11.124 -8.790 -1.635 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.445 -6.927 -1.335 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.354 -7.792 -2.399 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.661 -8.332 -0.188 1.00 10.00 H new ATOM 0 HG3 ARG A 54 8.486 -9.759 -0.783 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.520 -9.165 0.421 1.00 10.00 H new ATOM 0 HD3 ARG A 54 9.848 -7.614 0.885 1.00 10.00 H new ATOM 0 HE ARG A 54 8.043 -9.458 1.930 1.00 10.00 H new ATOM 0 HH11 ARG A 54 11.517 -8.851 2.171 1.00 10.00 H new ATOM 0 HH12 ARG A 54 11.640 -9.517 3.802 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.214 -10.321 4.027 1.00 10.00 H new ATOM 0 HH22 ARG A 54 9.779 -10.345 4.847 1.00 10.00 H new ATOM 593 N GLN A 55 9.373 -9.759 -4.240 1.00 10.00 N ATOM 594 CA GLN A 55 8.906 -10.925 -4.982 1.00 10.00 C ATOM 595 C GLN A 55 10.060 -11.633 -5.686 1.00 10.00 C ATOM 596 O GLN A 55 10.067 -12.860 -5.804 1.00 10.00 O ATOM 597 CB GLN A 55 7.836 -10.514 -5.995 1.00 10.00 C ATOM 598 CG GLN A 55 6.540 -10.052 -5.352 1.00 10.00 C ATOM 599 CD GLN A 55 5.962 -11.079 -4.392 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.232 -11.051 -3.191 1.00 10.00 O ATOM 601 NE2 GLN A 55 5.173 -11.999 -4.918 1.00 10.00 N ATOM 0 H GLN A 55 9.240 -8.871 -4.723 1.00 10.00 H new ATOM 0 HA GLN A 55 8.469 -11.625 -4.269 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.228 -9.712 -6.621 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.626 -11.358 -6.652 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.717 -9.120 -4.816 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.809 -9.838 -6.131 1.00 10.00 H new ATOM 0 HE21 GLN A 55 4.973 -11.988 -5.918 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.764 -12.720 -4.324 1.00 10.00 H new ATOM 610 N GLY A 56 11.035 -10.860 -6.143 1.00 10.00 N ATOM 611 CA GLY A 56 12.177 -11.435 -6.823 1.00 10.00 C ATOM 612 C GLY A 56 12.062 -11.322 -8.328 1.00 10.00 C ATOM 613 O GLY A 56 12.460 -12.225 -9.061 1.00 10.00 O ATOM 0 H GLY A 56 11.055 -9.844 -6.055 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.086 -10.933 -6.491 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.273 -12.485 -6.545 1.00 10.00 H new ATOM 617 N VAL A 57 11.515 -10.209 -8.787 1.00 10.00 N ATOM 618 CA VAL A 57 11.340 -9.964 -10.211 1.00 10.00 C ATOM 619 C VAL A 57 11.724 -8.529 -10.543 1.00 10.00 C ATOM 620 O VAL A 57 11.701 -7.666 -9.666 1.00 10.00 O ATOM 621 CB VAL A 57 9.882 -10.215 -10.666 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.620 -11.701 -10.860 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.893 -9.619 -9.672 1.00 10.00 C ATOM 0 H VAL A 57 11.181 -9.453 -8.189 1.00 10.00 H new ATOM 0 HA VAL A 57 11.988 -10.661 -10.742 1.00 10.00 H new ATOM 0 HB VAL A 57 9.741 -9.719 -11.626 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.589 -11.850 -11.180 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.296 -12.093 -11.620 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.788 -12.226 -9.920 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.875 -9.808 -10.013 1.00 10.00 H new ATOM 0 HG22 VAL A 57 9.039 -10.078 -8.694 1.00 10.00 H new ATOM 0 HG23 VAL A 57 9.056 -8.544 -9.596 1.00 10.00 H new ATOM 633 N PRO A 58 12.102 -8.255 -11.799 1.00 10.00 N ATOM 634 CA PRO A 58 12.474 -6.905 -12.224 1.00 10.00 C ATOM 635 C PRO A 58 11.264 -5.975 -12.245 1.00 10.00 C ATOM 636 O PRO A 58 10.129 -6.432 -12.379 1.00 10.00 O ATOM 637 CB PRO A 58 13.022 -7.111 -13.638 1.00 10.00 C ATOM 638 CG PRO A 58 12.384 -8.366 -14.115 1.00 10.00 C ATOM 639 CD PRO A 58 12.208 -9.232 -12.900 1.00 10.00 C ATOM 0 HA PRO A 58 13.192 -6.438 -11.549 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.773 -6.270 -14.285 1.00 10.00 H new ATOM 0 HB3 PRO A 58 14.109 -7.197 -13.632 1.00 10.00 H new ATOM 0 HG2 PRO A 58 11.424 -8.160 -14.589 1.00 10.00 H new ATOM 0 HG3 PRO A 58 13.007 -8.861 -14.860 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.315 -9.853 -12.974 1.00 10.00 H new ATOM 0 HD3 PRO A 58 13.054 -9.905 -12.760 1.00 10.00 H new ATOM 647 N MET A 59 11.503 -4.679 -12.110 1.00 10.00 N ATOM 648 CA MET A 59 10.414 -3.708 -12.109 1.00 10.00 C ATOM 649 C MET A 59 9.690 -3.688 -13.457 1.00 10.00 C ATOM 650 O MET A 59 10.246 -4.119 -14.465 1.00 10.00 O ATOM 651 CB MET A 59 10.941 -2.310 -11.780 1.00 10.00 C ATOM 652 CG MET A 59 9.861 -1.365 -11.280 1.00 10.00 C ATOM 653 SD MET A 59 10.390 0.355 -11.241 1.00 10.00 S ATOM 654 CE MET A 59 8.895 1.131 -10.638 1.00 10.00 C ATOM 0 H MET A 59 12.433 -4.275 -12.000 1.00 10.00 H new ATOM 0 HA MET A 59 9.702 -4.009 -11.341 1.00 10.00 H new ATOM 0 HB2 MET A 59 11.722 -2.392 -11.024 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.403 -1.884 -12.671 1.00 10.00 H new ATOM 0 HG2 MET A 59 8.983 -1.454 -11.920 1.00 10.00 H new ATOM 0 HG3 MET A 59 9.557 -1.668 -10.278 1.00 10.00 H new ATOM 0 HE1 MET A 59 8.853 2.162 -10.989 1.00 10.00 H new ATOM 0 HE2 MET A 59 8.027 0.586 -11.009 1.00 10.00 H new ATOM 0 HE3 MET A 59 8.893 1.119 -9.548 1.00 10.00 H new ATOM 664 N ASN A 60 8.440 -3.207 -13.444 1.00 10.00 N ATOM 665 CA ASN A 60 7.592 -3.096 -14.646 1.00 10.00 C ATOM 666 C ASN A 60 6.938 -4.434 -14.995 1.00 10.00 C ATOM 667 O ASN A 60 6.172 -4.528 -15.950 1.00 10.00 O ATOM 668 CB ASN A 60 8.383 -2.548 -15.850 1.00 10.00 C ATOM 669 CG ASN A 60 7.502 -1.894 -16.907 1.00 10.00 C ATOM 670 OD1 ASN A 60 7.119 -0.728 -16.781 1.00 10.00 O ATOM 671 ND2 ASN A 60 7.189 -2.631 -17.964 1.00 10.00 N ATOM 0 H ASN A 60 7.982 -2.880 -12.593 1.00 10.00 H new ATOM 0 HA ASN A 60 6.801 -2.384 -14.413 1.00 10.00 H new ATOM 0 HB2 ASN A 60 9.112 -1.820 -15.495 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.943 -3.363 -16.308 1.00 10.00 H new ATOM 0 HD21 ASN A 60 6.613 -2.237 -18.708 1.00 10.00 H new ATOM 0 HD22 ASN A 60 7.524 -3.592 -18.033 1.00 10.00 H new ATOM 678 N SER A 61 7.221 -5.464 -14.208 1.00 10.00 N ATOM 679 CA SER A 61 6.637 -6.777 -14.449 1.00 10.00 C ATOM 680 C SER A 61 5.274 -6.886 -13.773 1.00 10.00 C ATOM 681 O SER A 61 4.384 -7.597 -14.243 1.00 10.00 O ATOM 682 CB SER A 61 7.566 -7.874 -13.930 1.00 10.00 C ATOM 683 OG SER A 61 7.868 -7.673 -12.559 1.00 10.00 O ATOM 0 H SER A 61 7.846 -5.417 -13.403 1.00 10.00 H new ATOM 0 HA SER A 61 6.507 -6.904 -15.524 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.096 -8.848 -14.064 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.487 -7.882 -14.512 1.00 10.00 H new ATOM 0 HG SER A 61 8.835 -7.554 -12.451 1.00 10.00 H new ATOM 689 N LEU A 62 5.116 -6.160 -12.676 1.00 10.00 N ATOM 690 CA LEU A 62 3.876 -6.173 -11.917 1.00 10.00 C ATOM 691 C LEU A 62 3.254 -4.781 -11.872 1.00 10.00 C ATOM 692 O LEU A 62 3.962 -3.780 -11.739 1.00 10.00 O ATOM 693 CB LEU A 62 4.142 -6.661 -10.491 1.00 10.00 C ATOM 694 CG LEU A 62 4.554 -8.127 -10.365 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.296 -8.360 -9.060 1.00 10.00 C ATOM 696 CD2 LEU A 62 3.335 -9.033 -10.452 1.00 10.00 C ATOM 0 H LEU A 62 5.837 -5.551 -12.290 1.00 10.00 H new ATOM 0 HA LEU A 62 3.180 -6.851 -12.411 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.926 -6.042 -10.054 1.00 10.00 H new ATOM 0 HB3 LEU A 62 3.242 -6.502 -9.897 1.00 10.00 H new ATOM 0 HG LEU A 62 5.223 -8.369 -11.191 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.582 -9.409 -8.986 1.00 10.00 H new ATOM 0 HD12 LEU A 62 6.190 -7.737 -9.034 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.649 -8.101 -8.222 1.00 10.00 H new ATOM 0 HD21 LEU A 62 3.648 -10.073 -10.360 1.00 10.00 H new ATOM 0 HD22 LEU A 62 2.643 -8.790 -9.646 1.00 10.00 H new ATOM 0 HD23 LEU A 62 2.840 -8.886 -11.412 1.00 10.00 H new ATOM 708 N ARG A 63 1.934 -4.725 -11.986 1.00 10.00 N ATOM 709 CA ARG A 63 1.216 -3.461 -11.942 1.00 10.00 C ATOM 710 C ARG A 63 0.273 -3.434 -10.745 1.00 10.00 C ATOM 711 O ARG A 63 -0.341 -4.446 -10.401 1.00 10.00 O ATOM 712 CB ARG A 63 0.431 -3.226 -13.239 1.00 10.00 C ATOM 713 CG ARG A 63 -0.732 -4.182 -13.441 1.00 10.00 C ATOM 714 CD ARG A 63 -1.677 -3.689 -14.526 1.00 10.00 C ATOM 715 NE ARG A 63 -2.792 -4.608 -14.743 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.806 -5.555 -15.681 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.781 -5.691 -16.519 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.857 -6.358 -15.792 1.00 10.00 N ATOM 0 H ARG A 63 1.338 -5.544 -12.110 1.00 10.00 H new ATOM 0 HA ARG A 63 1.947 -2.659 -11.838 1.00 10.00 H new ATOM 0 HB2 ARG A 63 0.052 -2.204 -13.242 1.00 10.00 H new ATOM 0 HB3 ARG A 63 1.112 -3.316 -14.085 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.352 -5.168 -13.709 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.279 -4.295 -12.505 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.065 -2.708 -14.250 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.125 -3.563 -15.457 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.610 -4.519 -14.140 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -0.977 -5.068 -16.446 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.800 -6.418 -17.234 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.651 -6.249 -15.161 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.871 -7.084 -16.509 1.00 10.00 H new ATOM 732 N PHE A 64 0.171 -2.277 -10.110 1.00 10.00 N ATOM 733 CA PHE A 64 -0.691 -2.114 -8.951 1.00 10.00 C ATOM 734 C PHE A 64 -2.026 -1.521 -9.371 1.00 10.00 C ATOM 735 O PHE A 64 -2.067 -0.507 -10.070 1.00 10.00 O ATOM 736 CB PHE A 64 -0.027 -1.212 -7.913 1.00 10.00 C ATOM 737 CG PHE A 64 1.186 -1.818 -7.272 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.434 -1.684 -7.857 1.00 10.00 C ATOM 739 CD2 PHE A 64 1.075 -2.517 -6.083 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.551 -2.242 -7.268 1.00 10.00 C ATOM 741 CE2 PHE A 64 2.189 -3.077 -5.489 1.00 10.00 C ATOM 742 CZ PHE A 64 3.428 -2.936 -6.082 1.00 10.00 C ATOM 0 H PHE A 64 0.677 -1.434 -10.380 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.860 -3.095 -8.506 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.256 -0.273 -8.389 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.754 -0.970 -7.137 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.534 -1.138 -8.783 1.00 10.00 H new ATOM 0 HD2 PHE A 64 0.108 -2.626 -5.615 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.519 -2.135 -7.735 1.00 10.00 H new ATOM 0 HE2 PHE A 64 2.091 -3.624 -4.563 1.00 10.00 H new ATOM 0 HZ PHE A 64 4.301 -3.369 -5.617 1.00 10.00 H new ATOM 752 N LEU A 65 -3.106 -2.148 -8.943 1.00 10.00 N ATOM 753 CA LEU A 65 -4.438 -1.682 -9.285 1.00 10.00 C ATOM 754 C LEU A 65 -5.121 -1.052 -8.079 1.00 10.00 C ATOM 755 O LEU A 65 -5.383 -1.722 -7.080 1.00 10.00 O ATOM 756 CB LEU A 65 -5.286 -2.839 -9.813 1.00 10.00 C ATOM 757 CG LEU A 65 -4.732 -3.540 -11.054 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.600 -4.733 -11.415 1.00 10.00 C ATOM 759 CD2 LEU A 65 -4.644 -2.570 -12.223 1.00 10.00 C ATOM 0 H LEU A 65 -3.087 -2.983 -8.357 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.340 -0.925 -10.063 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.399 -3.577 -9.019 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.283 -2.462 -10.043 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.726 -3.896 -10.831 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.195 -5.223 -12.300 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.613 -5.438 -10.584 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.616 -4.395 -11.620 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.248 -3.088 -13.096 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -5.637 -2.183 -12.450 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -3.984 -1.743 -11.961 1.00 10.00 H new ATOM 771 N PHE A 66 -5.402 0.234 -8.179 1.00 10.00 N ATOM 772 CA PHE A 66 -6.066 0.964 -7.115 1.00 10.00 C ATOM 773 C PHE A 66 -7.314 1.631 -7.670 1.00 10.00 C ATOM 774 O PHE A 66 -7.219 2.517 -8.519 1.00 10.00 O ATOM 775 CB PHE A 66 -5.127 2.012 -6.510 1.00 10.00 C ATOM 776 CG PHE A 66 -5.697 2.720 -5.311 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.766 2.081 -4.084 1.00 10.00 C ATOM 778 CD2 PHE A 66 -6.159 4.023 -5.411 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.290 2.727 -2.978 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.684 4.674 -4.310 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.749 4.025 -3.093 1.00 10.00 C ATOM 0 H PHE A 66 -5.177 0.800 -8.997 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.346 0.267 -6.325 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.193 1.527 -6.224 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -4.882 2.750 -7.273 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.407 1.067 -3.989 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -6.108 4.536 -6.360 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.340 2.218 -2.027 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -7.043 5.689 -4.402 1.00 10.00 H new ATOM 0 HZ PHE A 66 -7.158 4.532 -2.232 1.00 10.00 H new ATOM 791 N GLU A 67 -8.478 1.175 -7.211 1.00 10.00 N ATOM 792 CA GLU A 67 -9.760 1.717 -7.659 1.00 10.00 C ATOM 793 C GLU A 67 -9.947 1.508 -9.161 1.00 10.00 C ATOM 794 O GLU A 67 -10.563 2.327 -9.843 1.00 10.00 O ATOM 795 CB GLU A 67 -9.870 3.203 -7.300 1.00 10.00 C ATOM 796 CG GLU A 67 -10.050 3.452 -5.812 1.00 10.00 C ATOM 797 CD GLU A 67 -11.438 3.089 -5.329 1.00 10.00 C ATOM 798 OE1 GLU A 67 -11.704 1.890 -5.098 1.00 10.00 O ATOM 799 OE2 GLU A 67 -12.275 4.003 -5.186 1.00 10.00 O ATOM 0 H GLU A 67 -8.560 0.426 -6.524 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.555 1.179 -7.144 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -8.973 3.719 -7.641 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -10.712 3.638 -7.838 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -9.312 2.872 -5.258 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -9.857 4.503 -5.596 1.00 10.00 H new ATOM 806 N GLY A 68 -9.399 0.407 -9.669 1.00 10.00 N ATOM 807 CA GLY A 68 -9.521 0.094 -11.080 1.00 10.00 C ATOM 808 C GLY A 68 -8.441 0.736 -11.927 1.00 10.00 C ATOM 809 O GLY A 68 -8.246 0.359 -13.082 1.00 10.00 O ATOM 0 H GLY A 68 -8.871 -0.275 -9.125 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.482 -0.987 -11.211 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.497 0.423 -11.436 1.00 10.00 H new ATOM 813 N GLN A 69 -7.725 1.692 -11.357 1.00 10.00 N ATOM 814 CA GLN A 69 -6.674 2.383 -12.083 1.00 10.00 C ATOM 815 C GLN A 69 -5.309 1.825 -11.711 1.00 10.00 C ATOM 816 O GLN A 69 -5.090 1.391 -10.580 1.00 10.00 O ATOM 817 CB GLN A 69 -6.733 3.882 -11.799 1.00 10.00 C ATOM 818 CG GLN A 69 -8.107 4.481 -12.044 1.00 10.00 C ATOM 819 CD GLN A 69 -8.070 5.981 -12.223 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.244 6.670 -11.629 1.00 10.00 O ATOM 821 NE2 GLN A 69 -8.965 6.495 -13.047 1.00 10.00 N ATOM 0 H GLN A 69 -7.853 2.006 -10.395 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.829 2.224 -13.150 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.445 4.061 -10.763 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.003 4.394 -12.426 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.544 4.025 -12.932 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.760 4.236 -11.206 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.633 5.885 -13.520 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -8.989 7.501 -13.211 1.00 10.00 H new ATOM 830 N ARG A 70 -4.394 1.828 -12.667 1.00 10.00 N ATOM 831 CA ARG A 70 -3.052 1.320 -12.431 1.00 10.00 C ATOM 832 C ARG A 70 -2.143 2.430 -11.922 1.00 10.00 C ATOM 833 O ARG A 70 -2.041 3.496 -12.531 1.00 10.00 O ATOM 834 CB ARG A 70 -2.473 0.690 -13.703 1.00 10.00 C ATOM 835 CG ARG A 70 -2.654 1.536 -14.953 1.00 10.00 C ATOM 836 CD ARG A 70 -2.257 0.777 -16.206 1.00 10.00 C ATOM 837 NE ARG A 70 -0.811 0.590 -16.304 1.00 10.00 N ATOM 838 CZ ARG A 70 -0.226 -0.549 -16.667 1.00 10.00 C ATOM 839 NH1 ARG A 70 -0.958 -1.615 -16.974 1.00 10.00 N ATOM 840 NH2 ARG A 70 1.095 -0.621 -16.739 1.00 10.00 N ATOM 0 H ARG A 70 -4.555 2.176 -13.612 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.112 0.545 -11.667 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.409 0.506 -13.553 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -2.945 -0.280 -13.862 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.695 1.850 -15.032 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -2.053 2.441 -14.870 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.748 -0.196 -16.210 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -2.612 1.317 -17.084 1.00 10.00 H new ATOM 0 HE ARG A 70 -0.211 1.384 -16.080 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.976 -1.564 -16.932 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.502 -2.484 -17.251 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.663 0.196 -16.516 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.544 -1.494 -17.017 1.00 10.00 H new ATOM 854 N ILE A 71 -1.498 2.169 -10.794 1.00 10.00 N ATOM 855 CA ILE A 71 -0.595 3.129 -10.173 1.00 10.00 C ATOM 856 C ILE A 71 0.606 3.418 -11.071 1.00 10.00 C ATOM 857 O ILE A 71 1.321 2.503 -11.493 1.00 10.00 O ATOM 858 CB ILE A 71 -0.105 2.619 -8.799 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.285 2.478 -7.828 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.956 3.547 -8.221 1.00 10.00 C ATOM 861 CD1 ILE A 71 -2.035 3.773 -7.581 1.00 10.00 C ATOM 0 H ILE A 71 -1.585 1.290 -10.285 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.154 4.053 -10.028 1.00 10.00 H new ATOM 0 HB ILE A 71 0.346 1.637 -8.942 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.980 1.736 -8.221 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.916 2.096 -6.876 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.285 3.166 -7.254 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.807 3.595 -8.900 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.537 4.545 -8.095 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.854 3.592 -6.885 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.355 4.512 -7.157 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.436 4.147 -8.523 1.00 10.00 H new ATOM 873 N ALA A 72 0.817 4.693 -11.356 1.00 10.00 N ATOM 874 CA ALA A 72 1.921 5.122 -12.200 1.00 10.00 C ATOM 875 C ALA A 72 3.206 5.251 -11.392 1.00 10.00 C ATOM 876 O ALA A 72 3.222 4.995 -10.190 1.00 10.00 O ATOM 877 CB ALA A 72 1.578 6.440 -12.871 1.00 10.00 C ATOM 0 H ALA A 72 0.233 5.455 -11.012 1.00 10.00 H new ATOM 0 HA ALA A 72 2.084 4.366 -12.968 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.410 6.755 -13.501 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.685 6.315 -13.484 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.392 7.198 -12.110 1.00 10.00 H new ATOM 883 N ASP A 73 4.282 5.652 -12.053 1.00 10.00 N ATOM 884 CA ASP A 73 5.573 5.801 -11.387 1.00 10.00 C ATOM 885 C ASP A 73 5.738 7.199 -10.804 1.00 10.00 C ATOM 886 O ASP A 73 6.744 7.498 -10.165 1.00 10.00 O ATOM 887 CB ASP A 73 6.720 5.513 -12.362 1.00 10.00 C ATOM 888 CG ASP A 73 7.211 4.081 -12.281 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.383 3.178 -12.042 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.430 3.856 -12.467 1.00 10.00 O ATOM 0 H ASP A 73 4.290 5.880 -13.047 1.00 10.00 H new ATOM 0 HA ASP A 73 5.605 5.079 -10.571 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.388 5.722 -13.379 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.549 6.189 -12.152 1.00 10.00 H new ATOM 895 N ASN A 74 4.750 8.055 -11.026 1.00 10.00 N ATOM 896 CA ASN A 74 4.803 9.425 -10.522 1.00 10.00 C ATOM 897 C ASN A 74 3.647 9.705 -9.567 1.00 10.00 C ATOM 898 O ASN A 74 3.401 10.852 -9.199 1.00 10.00 O ATOM 899 CB ASN A 74 4.773 10.432 -11.680 1.00 10.00 C ATOM 900 CG ASN A 74 3.416 10.518 -12.366 1.00 10.00 C ATOM 901 OD1 ASN A 74 2.746 9.506 -12.576 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.003 11.727 -12.715 1.00 10.00 N ATOM 0 H ASN A 74 3.904 7.829 -11.549 1.00 10.00 H new ATOM 0 HA ASN A 74 5.740 9.538 -9.977 1.00 10.00 H new ATOM 0 HB2 ASN A 74 5.045 11.418 -11.303 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.527 10.153 -12.415 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.100 11.844 -13.175 1.00 10.00 H new ATOM 0 HD22 ASN A 74 3.588 12.541 -12.523 1.00 10.00 H new ATOM 909 N HIS A 75 2.955 8.653 -9.156 1.00 10.00 N ATOM 910 CA HIS A 75 1.814 8.798 -8.255 1.00 10.00 C ATOM 911 C HIS A 75 2.252 8.865 -6.796 1.00 10.00 C ATOM 912 O HIS A 75 3.312 8.356 -6.425 1.00 10.00 O ATOM 913 CB HIS A 75 0.833 7.637 -8.436 1.00 10.00 C ATOM 914 CG HIS A 75 -0.080 7.784 -9.614 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.839 6.730 -10.059 1.00 10.00 N ATOM 916 CD2 HIS A 75 -0.328 8.867 -10.391 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.530 7.189 -11.086 1.00 10.00 C ATOM 918 NE2 HIS A 75 -1.253 8.479 -11.327 1.00 10.00 N ATOM 0 H HIS A 75 3.160 7.692 -9.429 1.00 10.00 H new ATOM 0 HA HIS A 75 1.321 9.736 -8.511 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.398 6.711 -8.542 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.230 7.541 -7.533 1.00 10.00 H new ATOM 0 HD2 HIS A 75 0.117 9.846 -10.292 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.230 6.600 -11.660 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -1.653 9.060 -12.064 1.00 10.00 H new ATOM 926 N THR A 76 1.430 9.509 -5.982 1.00 10.00 N ATOM 927 CA THR A 76 1.690 9.643 -4.557 1.00 10.00 C ATOM 928 C THR A 76 0.496 9.108 -3.764 1.00 10.00 C ATOM 929 O THR A 76 -0.612 9.038 -4.292 1.00 10.00 O ATOM 930 CB THR A 76 1.946 11.116 -4.165 1.00 10.00 C ATOM 931 OG1 THR A 76 0.882 11.954 -4.640 1.00 10.00 O ATOM 932 CG2 THR A 76 3.275 11.606 -4.724 1.00 10.00 C ATOM 0 H THR A 76 0.565 9.953 -6.290 1.00 10.00 H new ATOM 0 HA THR A 76 2.585 9.066 -4.323 1.00 10.00 H new ATOM 0 HB THR A 76 1.985 11.170 -3.077 1.00 10.00 H new ATOM 0 HG1 THR A 76 0.765 11.820 -5.604 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.431 12.645 -4.434 1.00 10.00 H new ATOM 0 HG22 THR A 76 4.085 10.993 -4.328 1.00 10.00 H new ATOM 0 HG23 THR A 76 3.262 11.531 -5.811 1.00 10.00 H new ATOM 940 N PRO A 77 0.694 8.715 -2.494 1.00 10.00 N ATOM 941 CA PRO A 77 -0.393 8.191 -1.653 1.00 10.00 C ATOM 942 C PRO A 77 -1.417 9.265 -1.274 1.00 10.00 C ATOM 943 O PRO A 77 -2.502 8.954 -0.775 1.00 10.00 O ATOM 944 CB PRO A 77 0.330 7.673 -0.397 1.00 10.00 C ATOM 945 CG PRO A 77 1.781 7.651 -0.744 1.00 10.00 C ATOM 946 CD PRO A 77 1.979 8.718 -1.779 1.00 10.00 C ATOM 0 HA PRO A 77 -0.967 7.425 -2.175 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.142 8.322 0.458 1.00 10.00 H new ATOM 0 HB3 PRO A 77 -0.022 6.678 -0.125 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.395 7.843 0.136 1.00 10.00 H new ATOM 0 HG3 PRO A 77 2.074 6.675 -1.130 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.189 9.687 -1.327 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.813 8.489 -2.443 1.00 10.00 H new ATOM 954 N LYS A 78 -1.071 10.526 -1.515 1.00 10.00 N ATOM 955 CA LYS A 78 -1.961 11.633 -1.190 1.00 10.00 C ATOM 956 C LYS A 78 -3.076 11.749 -2.226 1.00 10.00 C ATOM 957 O LYS A 78 -4.236 11.985 -1.879 1.00 10.00 O ATOM 958 CB LYS A 78 -1.173 12.946 -1.092 1.00 10.00 C ATOM 959 CG LYS A 78 -2.033 14.169 -0.779 1.00 10.00 C ATOM 960 CD LYS A 78 -2.814 14.013 0.521 1.00 10.00 C ATOM 961 CE LYS A 78 -1.901 14.014 1.741 1.00 10.00 C ATOM 962 NZ LYS A 78 -2.672 14.106 3.011 1.00 10.00 N ATOM 0 H LYS A 78 -0.183 10.805 -1.933 1.00 10.00 H new ATOM 0 HA LYS A 78 -2.417 11.434 -0.220 1.00 10.00 H new ATOM 0 HB2 LYS A 78 -0.412 12.843 -0.319 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.650 13.114 -2.034 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -1.396 15.051 -0.713 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.730 14.340 -1.600 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -3.537 14.824 0.609 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -3.381 13.082 0.494 1.00 10.00 H new ATOM 0 HE2 LYS A 78 -1.301 13.104 1.746 1.00 10.00 H new ATOM 0 HE3 LYS A 78 -1.208 14.853 1.675 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 -2.015 14.104 3.817 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -3.226 14.986 3.018 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -3.315 13.292 3.086 1.00 10.00 H new ATOM 976 N GLU A 79 -2.728 11.578 -3.496 1.00 10.00 N ATOM 977 CA GLU A 79 -3.717 11.652 -4.558 1.00 10.00 C ATOM 978 C GLU A 79 -4.506 10.353 -4.600 1.00 10.00 C ATOM 979 O GLU A 79 -4.059 9.342 -4.050 1.00 10.00 O ATOM 980 CB GLU A 79 -3.055 11.941 -5.909 1.00 10.00 C ATOM 981 CG GLU A 79 -2.080 10.868 -6.366 1.00 10.00 C ATOM 982 CD GLU A 79 -1.163 11.358 -7.464 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.639 11.558 -8.601 1.00 10.00 O ATOM 984 OE2 GLU A 79 0.041 11.557 -7.187 1.00 10.00 O ATOM 0 H GLU A 79 -1.776 11.389 -3.811 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.400 12.476 -4.353 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -3.832 12.056 -6.665 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.528 12.893 -5.847 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.482 10.537 -5.517 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.637 10.001 -6.721 1.00 10.00 H new ATOM 991 N LEU A 80 -5.691 10.395 -5.215 1.00 10.00 N ATOM 992 CA LEU A 80 -6.580 9.229 -5.316 1.00 10.00 C ATOM 993 C LEU A 80 -7.237 8.941 -3.964 1.00 10.00 C ATOM 994 O LEU A 80 -8.437 8.667 -3.888 1.00 10.00 O ATOM 995 CB LEU A 80 -5.831 7.993 -5.832 1.00 10.00 C ATOM 996 CG LEU A 80 -5.277 8.115 -7.253 1.00 10.00 C ATOM 997 CD1 LEU A 80 -4.199 7.072 -7.498 1.00 10.00 C ATOM 998 CD2 LEU A 80 -6.394 7.969 -8.274 1.00 10.00 C ATOM 0 H LEU A 80 -6.063 11.236 -5.657 1.00 10.00 H new ATOM 0 HA LEU A 80 -7.360 9.464 -6.040 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -5.005 7.779 -5.154 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -6.505 7.137 -5.794 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.832 9.104 -7.363 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -3.817 7.175 -8.514 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -3.385 7.217 -6.788 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -4.621 6.075 -7.368 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -5.982 8.058 -9.279 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -6.865 6.993 -8.160 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -7.137 8.751 -8.115 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.449 9.004 -2.899 1.00 10.00 N ATOM 1011 CA GLY A 81 -6.975 8.783 -1.570 1.00 10.00 C ATOM 1012 C GLY A 81 -6.604 7.435 -0.989 1.00 10.00 C ATOM 1013 O GLY A 81 -7.439 6.534 -0.919 1.00 10.00 O ATOM 0 H GLY A 81 -5.450 9.205 -2.934 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -6.609 9.568 -0.908 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.061 8.871 -1.599 1.00 10.00 H new ATOM 1017 N MET A 82 -5.356 7.292 -0.572 1.00 10.00 N ATOM 1018 CA MET A 82 -4.890 6.049 0.031 1.00 10.00 C ATOM 1019 C MET A 82 -4.947 6.162 1.548 1.00 10.00 C ATOM 1020 O MET A 82 -4.501 7.160 2.118 1.00 10.00 O ATOM 1021 CB MET A 82 -3.462 5.731 -0.421 1.00 10.00 C ATOM 1022 CG MET A 82 -3.398 4.972 -1.734 1.00 10.00 C ATOM 1023 SD MET A 82 -1.710 4.599 -2.244 1.00 10.00 S ATOM 1024 CE MET A 82 -2.019 3.554 -3.664 1.00 10.00 C ATOM 0 H MET A 82 -4.645 8.021 -0.639 1.00 10.00 H new ATOM 0 HA MET A 82 -5.540 5.237 -0.294 1.00 10.00 H new ATOM 0 HB2 MET A 82 -2.905 6.663 -0.521 1.00 10.00 H new ATOM 0 HB3 MET A 82 -2.966 5.145 0.353 1.00 10.00 H new ATOM 0 HG2 MET A 82 -3.958 4.042 -1.638 1.00 10.00 H new ATOM 0 HG3 MET A 82 -3.886 5.559 -2.512 1.00 10.00 H new ATOM 0 HE1 MET A 82 -1.070 3.237 -4.096 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.587 2.677 -3.354 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.589 4.110 -4.408 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.518 5.157 2.201 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.636 5.167 3.654 1.00 10.00 C ATOM 1036 C GLU A 83 -5.128 3.863 4.265 1.00 10.00 C ATOM 1037 O GLU A 83 -4.701 2.955 3.553 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.090 5.409 4.062 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.311 6.743 4.761 1.00 10.00 C ATOM 1040 CD GLU A 83 -6.598 6.829 6.095 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.753 5.902 6.920 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -5.889 7.827 6.333 1.00 10.00 O ATOM 0 H GLU A 83 -5.905 4.328 1.750 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.016 5.978 4.035 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.720 5.364 3.174 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.412 4.604 4.722 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -6.963 7.549 4.115 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.379 6.896 4.914 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.177 3.788 5.587 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.728 2.611 6.320 1.00 10.00 C ATOM 1051 C GLU A 84 -5.670 1.432 6.073 1.00 10.00 C ATOM 1052 O GLU A 84 -6.883 1.620 5.956 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.658 2.940 7.817 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.338 1.752 8.712 1.00 10.00 C ATOM 1055 CD GLU A 84 -2.975 1.156 8.442 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -1.988 1.915 8.380 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.886 -0.080 8.305 1.00 10.00 O ATOM 0 H GLU A 84 -5.528 4.539 6.182 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.736 2.328 5.969 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -3.901 3.709 7.972 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.612 3.365 8.127 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.391 2.066 9.755 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.098 0.984 8.571 1.00 10.00 H new ATOM 1064 N GLU A 85 -5.093 0.231 5.972 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.855 -0.999 5.745 1.00 10.00 C ATOM 1066 C GLU A 85 -6.508 -0.998 4.368 1.00 10.00 C ATOM 1067 O GLU A 85 -7.454 -1.745 4.120 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.924 -1.198 6.829 1.00 10.00 C ATOM 1069 CG GLU A 85 -6.437 -1.988 8.032 1.00 10.00 C ATOM 1070 CD GLU A 85 -6.136 -3.436 7.698 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -4.955 -3.764 7.486 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -7.082 -4.250 7.652 1.00 10.00 O ATOM 0 H GLU A 85 -4.086 0.085 6.045 1.00 10.00 H new ATOM 0 HA GLU A 85 -5.150 -1.829 5.795 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -7.274 -0.222 7.165 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.781 -1.711 6.392 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.539 -1.517 8.431 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -7.193 -1.950 8.817 1.00 10.00 H new ATOM 1079 N ASP A 86 -5.993 -0.166 3.475 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.532 -0.077 2.126 1.00 10.00 C ATOM 1081 C ASP A 86 -6.214 -1.344 1.351 1.00 10.00 C ATOM 1082 O ASP A 86 -5.108 -1.880 1.448 1.00 10.00 O ATOM 1083 CB ASP A 86 -5.964 1.133 1.389 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.032 1.903 0.645 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -7.725 1.305 -0.200 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.194 3.111 0.917 1.00 10.00 O ATOM 0 H ASP A 86 -5.205 0.455 3.659 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.613 0.040 2.201 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.473 1.794 2.104 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.201 0.802 0.685 1.00 10.00 H new ATOM 1091 N VAL A 87 -7.180 -1.820 0.587 1.00 10.00 N ATOM 1092 CA VAL A 87 -7.000 -3.033 -0.191 1.00 10.00 C ATOM 1093 C VAL A 87 -6.539 -2.707 -1.604 1.00 10.00 C ATOM 1094 O VAL A 87 -7.226 -2.002 -2.347 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.303 -3.857 -0.261 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -8.051 -5.209 -0.910 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.908 -4.030 1.124 1.00 10.00 C ATOM 0 H VAL A 87 -8.098 -1.385 0.488 1.00 10.00 H new ATOM 0 HA VAL A 87 -6.236 -3.625 0.312 1.00 10.00 H new ATOM 0 HB VAL A 87 -9.017 -3.311 -0.878 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -8.983 -5.773 -0.949 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.673 -5.062 -1.922 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -7.316 -5.762 -0.325 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.825 -4.614 1.050 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -8.199 -4.549 1.769 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -9.134 -3.051 1.547 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.373 -3.214 -1.967 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.818 -2.994 -3.291 1.00 10.00 C ATOM 1109 C ILE A 88 -4.316 -4.318 -3.860 1.00 10.00 C ATOM 1110 O ILE A 88 -3.757 -5.137 -3.136 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.679 -1.940 -3.265 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -3.148 -1.678 -4.678 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.550 -2.374 -2.338 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -2.208 -0.492 -4.763 1.00 10.00 C ATOM 0 H ILE A 88 -4.788 -3.786 -1.357 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.606 -2.601 -3.934 1.00 10.00 H new ATOM 0 HB ILE A 88 -4.094 -1.010 -2.877 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.629 -2.568 -5.033 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.991 -1.512 -5.349 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.766 -1.617 -2.340 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -2.936 -2.494 -1.326 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.139 -3.322 -2.684 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.872 -0.367 -5.792 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.729 0.409 -4.439 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -1.346 -0.664 -4.119 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.548 -4.547 -5.141 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.119 -5.786 -5.774 1.00 10.00 C ATOM 1128 C GLU A 89 -3.012 -5.530 -6.785 1.00 10.00 C ATOM 1129 O GLU A 89 -2.901 -4.433 -7.339 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.296 -6.479 -6.464 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.450 -6.810 -5.530 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.618 -5.864 -5.704 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.679 -6.307 -6.186 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -7.478 -4.668 -5.379 1.00 10.00 O ATOM 0 H GLU A 89 -5.028 -3.896 -5.762 1.00 10.00 H new ATOM 0 HA GLU A 89 -3.732 -6.438 -4.991 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.663 -5.838 -7.266 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -4.942 -7.399 -6.928 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.782 -7.832 -5.714 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -6.102 -6.769 -4.498 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.201 -6.549 -7.022 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.102 -6.456 -7.966 1.00 10.00 C ATOM 1143 C VAL A 90 -1.167 -7.623 -8.954 1.00 10.00 C ATOM 1144 O VAL A 90 -1.438 -8.760 -8.565 1.00 10.00 O ATOM 1145 CB VAL A 90 0.262 -6.435 -7.233 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.498 -7.729 -6.466 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.400 -6.166 -8.207 1.00 10.00 C ATOM 0 H VAL A 90 -2.286 -7.458 -6.568 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.196 -5.520 -8.516 1.00 10.00 H new ATOM 0 HB VAL A 90 0.236 -5.620 -6.510 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.464 -7.683 -5.963 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.291 -7.862 -5.726 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.490 -8.570 -7.160 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.347 -6.156 -7.667 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.423 -6.949 -8.965 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.247 -5.200 -8.688 1.00 10.00 H new ATOM 1157 N TYR A 91 -0.960 -7.338 -10.230 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.011 -8.373 -11.257 1.00 10.00 C ATOM 1159 C TYR A 91 0.151 -8.229 -12.228 1.00 10.00 C ATOM 1160 O TYR A 91 0.721 -7.146 -12.367 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.334 -8.308 -12.024 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.535 -8.729 -11.208 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -3.937 -10.058 -11.163 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.266 -7.799 -10.484 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.032 -10.445 -10.415 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.360 -8.177 -9.734 1.00 10.00 C ATOM 1167 CZ TYR A 91 -5.740 -9.501 -9.705 1.00 10.00 C ATOM 1168 OH TYR A 91 -6.835 -9.879 -8.962 1.00 10.00 O ATOM 0 H TYR A 91 -0.756 -6.402 -10.581 1.00 10.00 H new ATOM 0 HA TYR A 91 -0.936 -9.340 -10.760 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.487 -7.289 -12.379 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.264 -8.946 -12.905 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.385 -10.800 -11.721 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.973 -6.760 -10.508 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.331 -11.482 -10.387 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.915 -7.440 -9.173 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.219 -9.092 -8.522 1.00 10.00 H new ATOM 1178 N GLN A 92 0.494 -9.324 -12.894 1.00 10.00 N ATOM 1179 CA GLN A 92 1.586 -9.326 -13.859 1.00 10.00 C ATOM 1180 C GLN A 92 1.165 -8.622 -15.146 1.00 10.00 C ATOM 1181 O GLN A 92 0.052 -8.821 -15.642 1.00 10.00 O ATOM 1182 CB GLN A 92 2.036 -10.759 -14.169 1.00 10.00 C ATOM 1183 CG GLN A 92 3.287 -10.831 -15.033 1.00 10.00 C ATOM 1184 CD GLN A 92 3.525 -12.210 -15.616 1.00 10.00 C ATOM 1185 OE1 GLN A 92 4.207 -13.044 -15.019 1.00 10.00 O ATOM 1186 NE2 GLN A 92 2.970 -12.459 -16.793 1.00 10.00 N ATOM 0 H GLN A 92 0.030 -10.225 -12.783 1.00 10.00 H new ATOM 0 HA GLN A 92 2.425 -8.785 -13.420 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.221 -11.284 -13.232 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.225 -11.284 -14.674 1.00 10.00 H new ATOM 0 HG2 GLN A 92 3.203 -10.109 -15.845 1.00 10.00 H new ATOM 0 HG3 GLN A 92 4.152 -10.541 -14.436 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.412 -11.742 -17.256 1.00 10.00 H new ATOM 0 HE22 GLN A 92 3.101 -13.368 -17.236 1.00 10.00 H new ATOM 1195 N GLU A 93 2.059 -7.793 -15.670 1.00 10.00 N ATOM 1196 CA GLU A 93 1.803 -7.054 -16.898 1.00 10.00 C ATOM 1197 C GLU A 93 1.816 -7.984 -18.105 1.00 10.00 C ATOM 1198 O GLU A 93 2.355 -9.092 -18.042 1.00 10.00 O ATOM 1199 CB GLU A 93 2.853 -5.957 -17.079 1.00 10.00 C ATOM 1200 CG GLU A 93 2.526 -4.672 -16.338 1.00 10.00 C ATOM 1201 CD GLU A 93 1.506 -3.828 -17.072 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.292 -4.056 -16.892 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.912 -2.918 -17.824 1.00 10.00 O ATOM 0 H GLU A 93 2.975 -7.615 -15.259 1.00 10.00 H new ATOM 0 HA GLU A 93 0.815 -6.600 -16.822 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.818 -6.329 -16.735 1.00 10.00 H new ATOM 0 HB3 GLU A 93 2.957 -5.737 -18.142 1.00 10.00 H new ATOM 0 HG2 GLU A 93 2.147 -4.914 -15.345 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.439 -4.094 -16.198 1.00 10.00 H new ATOM 1210 N GLN A 94 1.233 -7.518 -19.203 1.00 10.00 N ATOM 1211 CA GLN A 94 1.167 -8.295 -20.434 1.00 10.00 C ATOM 1212 C GLN A 94 2.563 -8.519 -21.010 1.00 10.00 C ATOM 1213 O GLN A 94 2.846 -9.565 -21.593 1.00 10.00 O ATOM 1214 CB GLN A 94 0.272 -7.582 -21.456 1.00 10.00 C ATOM 1215 CG GLN A 94 0.042 -8.376 -22.733 1.00 10.00 C ATOM 1216 CD GLN A 94 0.796 -7.806 -23.919 1.00 10.00 C ATOM 1217 OE1 GLN A 94 1.849 -7.185 -23.767 1.00 10.00 O ATOM 1218 NE2 GLN A 94 0.270 -8.022 -25.111 1.00 10.00 N ATOM 0 H GLN A 94 0.796 -6.598 -19.265 1.00 10.00 H new ATOM 0 HA GLN A 94 0.736 -9.270 -20.206 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.692 -7.368 -20.994 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.722 -6.623 -21.712 1.00 10.00 H new ATOM 0 HG2 GLN A 94 0.350 -9.409 -22.574 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -1.024 -8.392 -22.959 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -0.604 -8.541 -25.196 1.00 10.00 H new ATOM 0 HE22 GLN A 94 0.738 -7.670 -25.946 1.00 10.00 H new ATOM 1227 N THR A 95 3.437 -7.536 -20.835 1.00 10.00 N ATOM 1228 CA THR A 95 4.799 -7.630 -21.336 1.00 10.00 C ATOM 1229 C THR A 95 5.595 -8.660 -20.543 1.00 10.00 C ATOM 1230 O THR A 95 6.496 -9.310 -21.073 1.00 10.00 O ATOM 1231 CB THR A 95 5.512 -6.268 -21.259 1.00 10.00 C ATOM 1232 OG1 THR A 95 5.261 -5.660 -19.983 1.00 10.00 O ATOM 1233 CG2 THR A 95 5.033 -5.346 -22.371 1.00 10.00 C ATOM 0 H THR A 95 3.225 -6.664 -20.349 1.00 10.00 H new ATOM 0 HA THR A 95 4.743 -7.942 -22.379 1.00 10.00 H new ATOM 0 HB THR A 95 6.583 -6.430 -21.381 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.718 -4.794 -19.938 1.00 10.00 H new ATOM 0 HG21 THR A 95 5.550 -4.389 -22.298 1.00 10.00 H new ATOM 0 HG22 THR A 95 5.247 -5.801 -23.338 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.959 -5.187 -22.274 1.00 10.00 H new ATOM 1241 N GLY A 96 5.239 -8.816 -19.272 1.00 10.00 N ATOM 1242 CA GLY A 96 5.926 -9.760 -18.414 1.00 10.00 C ATOM 1243 C GLY A 96 7.166 -9.159 -17.792 1.00 10.00 C ATOM 1244 O GLY A 96 7.906 -9.837 -17.078 1.00 10.00 O ATOM 0 H GLY A 96 4.483 -8.302 -18.820 1.00 10.00 H new ATOM 0 HA2 GLY A 96 5.250 -10.093 -17.626 1.00 10.00 H new ATOM 0 HA3 GLY A 96 6.201 -10.642 -18.992 1.00 10.00 H new ATOM 1248 N GLY A 97 7.383 -7.882 -18.063 1.00 10.00 N ATOM 1249 CA GLY A 97 8.531 -7.184 -17.536 1.00 10.00 C ATOM 1250 C GLY A 97 8.720 -5.850 -18.222 1.00 10.00 C ATOM 1251 O GLY A 97 9.850 -5.322 -18.206 1.00 10.00 O ATOM 0 H GLY A 97 6.773 -7.311 -18.648 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.407 -7.031 -16.464 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.424 -7.794 -17.669 1.00 10.00 H new TER 1255 GLY A 97 ATOM 1256 N ASN B 357 -5.028 -15.296 5.908 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.248 -16.208 6.779 1.00 10.00 C ATOM 1258 C ASN B 357 -2.749 -16.095 6.504 1.00 10.00 C ATOM 1259 O ASN B 357 -1.950 -16.752 7.165 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.713 -17.662 6.587 1.00 10.00 C ATOM 1261 CG ASN B 357 -4.627 -18.112 5.145 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -5.534 -17.863 4.354 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -3.538 -18.775 4.789 1.00 10.00 N ATOM 0 HA ASN B 357 -4.425 -15.911 7.813 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -4.103 -18.320 7.207 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -5.742 -17.760 6.934 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -3.430 -19.099 3.828 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -2.807 -18.962 5.476 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.352 -15.273 5.535 1.00 10.00 N ATOM 1271 CA ASN B 358 -0.929 -15.106 5.238 1.00 10.00 C ATOM 1272 C ASN B 358 -0.548 -13.645 5.438 1.00 10.00 C ATOM 1273 O ASN B 358 -1.145 -12.763 4.830 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.650 -15.518 3.789 1.00 10.00 C ATOM 1275 CG ASN B 358 0.819 -15.770 3.533 1.00 10.00 C ATOM 1276 OD1 ASN B 358 1.673 -15.396 4.329 1.00 10.00 O ATOM 1277 ND2 ASN B 358 1.125 -16.410 2.419 1.00 10.00 N ATOM 0 H ASN B 358 -2.981 -14.721 4.951 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.339 -15.735 5.905 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -1.216 -16.419 3.555 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -1.004 -14.736 3.117 1.00 10.00 H new ATOM 0 HD21 ASN B 358 2.100 -16.609 2.197 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.386 -16.705 1.781 1.00 10.00 H new ATOM 1284 N ARG B 359 0.436 -13.379 6.282 1.00 10.00 N ATOM 1285 CA ARG B 359 0.846 -12.000 6.533 1.00 10.00 C ATOM 1286 C ARG B 359 2.330 -11.771 6.300 1.00 10.00 C ATOM 1287 O ARG B 359 3.176 -12.486 6.837 1.00 10.00 O ATOM 1288 CB ARG B 359 0.492 -11.586 7.966 1.00 10.00 C ATOM 1289 CG ARG B 359 1.073 -12.494 9.037 1.00 10.00 C ATOM 1290 CD ARG B 359 0.628 -12.073 10.428 1.00 10.00 C ATOM 1291 NE ARG B 359 0.552 -13.212 11.338 1.00 10.00 N ATOM 1292 CZ ARG B 359 -0.386 -13.355 12.279 1.00 10.00 C ATOM 1293 NH1 ARG B 359 -1.298 -12.406 12.473 1.00 10.00 N ATOM 1294 NH2 ARG B 359 -0.402 -14.444 13.038 1.00 10.00 N ATOM 0 H ARG B 359 0.961 -14.085 6.799 1.00 10.00 H new ATOM 0 HA ARG B 359 0.300 -11.385 5.817 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.845 -10.569 8.136 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.593 -11.568 8.070 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.763 -13.522 8.851 1.00 10.00 H new ATOM 0 HG3 ARG B 359 2.161 -12.474 8.981 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.325 -11.335 10.826 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.347 -11.590 10.368 1.00 10.00 H new ATOM 0 HE ARG B 359 1.258 -13.943 11.250 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -1.285 -11.561 11.901 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -2.011 -12.523 13.193 1.00 10.00 H new ATOM 0 HH21 ARG B 359 0.301 -15.170 12.903 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -1.117 -14.554 13.757 1.00 10.00 H new ATOM 1308 N ASP B 360 2.633 -10.783 5.474 1.00 10.00 N ATOM 1309 CA ASP B 360 4.013 -10.388 5.232 1.00 10.00 C ATOM 1310 C ASP B 360 4.144 -8.885 5.486 1.00 10.00 C ATOM 1311 O ASP B 360 3.388 -8.111 4.910 1.00 10.00 O ATOM 1312 CB ASP B 360 4.463 -10.738 3.811 1.00 10.00 C ATOM 1313 CG ASP B 360 5.948 -10.492 3.612 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.325 -9.707 2.716 1.00 10.00 O ATOM 1315 OD2 ASP B 360 6.754 -11.078 4.371 1.00 10.00 O ATOM 0 H ASP B 360 1.942 -10.238 4.959 1.00 10.00 H new ATOM 0 HA ASP B 360 4.662 -10.939 5.912 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.237 -11.785 3.606 1.00 10.00 H new ATOM 0 HB3 ASP B 360 3.897 -10.143 3.094 1.00 10.00 H new ATOM 1320 N PRO B 361 5.095 -8.437 6.321 1.00 10.00 N ATOM 1321 CA PRO B 361 5.266 -7.017 6.604 1.00 10.00 C ATOM 1322 C PRO B 361 6.560 -6.430 6.021 1.00 10.00 C ATOM 1323 O PRO B 361 7.663 -6.919 6.270 1.00 10.00 O ATOM 1324 CB PRO B 361 5.356 -7.056 8.141 1.00 10.00 C ATOM 1325 CG PRO B 361 5.905 -8.422 8.476 1.00 10.00 C ATOM 1326 CD PRO B 361 5.938 -9.232 7.198 1.00 10.00 C ATOM 0 HA PRO B 361 4.478 -6.396 6.177 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.008 -6.268 8.516 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.377 -6.904 8.596 1.00 10.00 H new ATOM 0 HG2 PRO B 361 6.905 -8.338 8.901 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.281 -8.912 9.223 1.00 10.00 H new ATOM 0 HD2 PRO B 361 6.950 -9.338 6.807 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.545 -10.238 7.341 1.00 10.00 H new ATOM 1334 N ILE B 362 6.392 -5.360 5.251 1.00 10.00 N ATOM 1335 CA ILE B 362 7.506 -4.673 4.604 1.00 10.00 C ATOM 1336 C ILE B 362 7.535 -3.202 5.014 1.00 10.00 C ATOM 1337 O ILE B 362 6.494 -2.546 5.079 1.00 10.00 O ATOM 1338 CB ILE B 362 7.456 -4.777 3.064 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.916 -6.141 2.623 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.845 -4.543 2.473 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.523 -6.173 1.166 1.00 10.00 C ATOM 0 H ILE B 362 5.481 -4.944 5.057 1.00 10.00 H new ATOM 0 HA ILE B 362 8.416 -5.171 4.939 1.00 10.00 H new ATOM 0 HB ILE B 362 6.779 -4.007 2.694 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.674 -6.903 2.807 1.00 10.00 H new ATOM 0 HG13 ILE B 362 6.050 -6.398 3.234 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.796 -4.619 1.387 1.00 10.00 H new ATOM 0 HG22 ILE B 362 9.196 -3.549 2.752 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.535 -5.293 2.858 1.00 10.00 H new ATOM 0 HD11 ILE B 362 6.148 -7.164 0.912 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.744 -5.433 0.983 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.393 -5.945 0.550 1.00 10.00 H new ATOM 1353 N VAL B 363 8.722 -2.692 5.308 1.00 10.00 N ATOM 1354 CA VAL B 363 8.884 -1.303 5.719 1.00 10.00 C ATOM 1355 C VAL B 363 9.667 -0.532 4.658 1.00 10.00 C ATOM 1356 O VAL B 363 10.677 -1.011 4.142 1.00 10.00 O ATOM 1357 CB VAL B 363 9.590 -1.186 7.089 1.00 10.00 C ATOM 1358 CG1 VAL B 363 9.657 0.267 7.542 1.00 10.00 C ATOM 1359 CG2 VAL B 363 8.878 -2.032 8.133 1.00 10.00 C ATOM 0 H VAL B 363 9.593 -3.222 5.269 1.00 10.00 H new ATOM 0 HA VAL B 363 7.889 -0.871 5.824 1.00 10.00 H new ATOM 0 HB VAL B 363 10.608 -1.558 6.976 1.00 10.00 H new ATOM 0 HG11 VAL B 363 10.158 0.324 8.508 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.214 0.851 6.809 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.647 0.667 7.633 1.00 10.00 H new ATOM 0 HG21 VAL B 363 9.390 -1.936 9.090 1.00 10.00 H new ATOM 0 HG22 VAL B 363 7.848 -1.691 8.237 1.00 10.00 H new ATOM 0 HG23 VAL B 363 8.885 -3.076 7.821 1.00 10.00 H new ATOM 1369 N ILE B 364 9.181 0.663 4.354 1.00 10.00 N ATOM 1370 CA ILE B 364 9.749 1.521 3.318 1.00 10.00 C ATOM 1371 C ILE B 364 10.386 2.774 3.918 1.00 10.00 C ATOM 1372 O ILE B 364 9.922 3.310 4.930 1.00 10.00 O ATOM 1373 CB ILE B 364 8.710 1.920 2.234 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.423 2.307 0.933 1.00 10.00 C ATOM 1375 CG2 ILE B 364 7.820 3.070 2.707 1.00 10.00 C ATOM 1376 CD1 ILE B 364 10.037 1.133 0.196 1.00 10.00 C ATOM 0 H ILE B 364 8.372 1.071 4.824 1.00 10.00 H new ATOM 0 HA ILE B 364 10.524 0.930 2.829 1.00 10.00 H new ATOM 0 HB ILE B 364 8.072 1.055 2.051 1.00 10.00 H new ATOM 0 HG12 ILE B 364 8.711 2.805 0.274 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.206 3.030 1.161 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.105 3.323 1.924 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.282 2.768 3.605 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.438 3.940 2.929 1.00 10.00 H new ATOM 0 HD11 ILE B 364 10.522 1.488 -0.713 1.00 10.00 H new ATOM 0 HD12 ILE B 364 10.774 0.647 0.835 1.00 10.00 H new ATOM 0 HD13 ILE B 364 9.256 0.419 -0.065 1.00 10.00 H new HETATM 1388 N SEP B 365 11.467 3.207 3.287 1.00 10.00 N HETATM 1389 CA SEP B 365 12.246 4.343 3.739 1.00 10.00 C HETATM 1390 CB SEP B 365 13.733 3.989 3.687 1.00 10.00 C HETATM 1391 OG SEP B 365 13.988 2.999 2.692 1.00 10.00 O HETATM 1392 C SEP B 365 11.966 5.544 2.849 1.00 10.00 C HETATM 1393 O SEP B 365 11.875 5.439 1.622 1.00 10.00 O HETATM 1394 P SEP B 365 14.868 3.351 1.397 1.00 10.00 P HETATM 1395 O1P SEP B 365 16.104 2.560 1.279 1.00 10.00 O HETATM 1396 O2P SEP B 365 15.068 4.795 1.162 1.00 10.00 O HETATM 1397 O3P SEP B 365 13.979 2.870 0.159 1.00 10.00 O HETATM 0 HB3 SEP B 365 14.316 4.884 3.472 1.00 10.00 H new HETATM 0 HB2 SEP B 365 14.058 3.623 4.661 1.00 10.00 H new HETATM 0 HA SEP B 365 11.970 4.591 4.764 1.00 10.00 H new HETATM 0 H SEP B 365 11.937 2.348 3.000 1.00 10.00 H new ATOM 1402 N ASP B 366 11.782 6.675 3.506 1.00 10.00 N ATOM 1403 CA ASP B 366 11.435 7.925 2.847 1.00 10.00 C ATOM 1404 C ASP B 366 12.549 8.945 2.992 1.00 10.00 C ATOM 1405 O ASP B 366 13.094 9.135 4.081 1.00 10.00 O ATOM 1406 CB ASP B 366 10.151 8.468 3.473 1.00 10.00 C ATOM 1407 CG ASP B 366 9.882 9.925 3.144 1.00 10.00 C ATOM 1408 OD1 ASP B 366 10.061 10.783 4.038 1.00 10.00 O ATOM 1409 OD2 ASP B 366 9.457 10.205 2.009 1.00 10.00 O ATOM 0 H ASP B 366 11.869 6.754 4.519 1.00 10.00 H new ATOM 0 HA ASP B 366 11.288 7.738 1.783 1.00 10.00 H new ATOM 0 HB2 ASP B 366 9.308 7.866 3.133 1.00 10.00 H new ATOM 0 HB3 ASP B 366 10.208 8.353 4.555 1.00 10.00 H new HETATM 1414 N SEP B 367 12.896 9.568 1.873 1.00 10.00 N HETATM 1415 CA SEP B 367 13.955 10.567 1.835 1.00 10.00 C HETATM 1416 CB SEP B 367 14.479 10.703 0.403 1.00 10.00 C HETATM 1417 OG SEP B 367 15.111 9.501 -0.015 1.00 10.00 O HETATM 1418 C SEP B 367 13.467 11.924 2.363 1.00 10.00 C HETATM 1419 O SEP B 367 12.675 12.606 1.707 1.00 10.00 O HETATM 1420 P SEP B 367 14.678 8.785 -1.371 1.00 10.00 P HETATM 1421 O1P SEP B 367 14.298 9.719 -2.445 1.00 10.00 O HETATM 1422 O2P SEP B 367 15.609 7.732 -1.806 1.00 10.00 O HETATM 1423 O3P SEP B 367 13.333 8.003 -1.011 1.00 10.00 O HETATM 0 HB3 SEP B 367 13.655 10.940 -0.270 1.00 10.00 H new HETATM 0 HB2 SEP B 367 15.186 11.531 0.346 1.00 10.00 H new HETATM 0 HA SEP B 367 14.764 10.237 2.486 1.00 10.00 H new HETATM 0 H SEP B 367 12.618 9.087 1.018 1.00 10.00 H new ATOM 1428 N PRO B 368 13.941 12.336 3.557 1.00 10.00 N ATOM 1429 CA PRO B 368 13.548 13.603 4.176 1.00 10.00 C ATOM 1430 C PRO B 368 14.215 14.798 3.511 1.00 10.00 C ATOM 1431 O PRO B 368 13.512 15.791 3.218 1.00 10.00 O ATOM 1432 CB PRO B 368 14.022 13.473 5.632 1.00 10.00 C ATOM 1433 CG PRO B 368 14.552 12.083 5.777 1.00 10.00 C ATOM 1434 CD PRO B 368 14.900 11.609 4.397 1.00 10.00 C ATOM 0 HA PRO B 368 12.476 13.777 4.084 1.00 10.00 H new ATOM 0 HB2 PRO B 368 14.794 14.209 5.857 1.00 10.00 H new ATOM 0 HB3 PRO B 368 13.200 13.650 6.326 1.00 10.00 H new ATOM 0 HG2 PRO B 368 15.429 12.069 6.424 1.00 10.00 H new ATOM 0 HG3 PRO B 368 13.808 11.431 6.234 1.00 10.00 H new ATOM 0 HD2 PRO B 368 15.931 11.847 4.135 1.00 10.00 H new ATOM 0 HD3 PRO B 368 14.788 10.529 4.299 1.00 10.00 H new TER 1442 PRO B 368